0 B15R1.10394 C#CCC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100011220946 [0,0,0,0,0,0|1,0,3]=4 1 B15R1.10394 C#CCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100011220946 [0,0,0,0,0,0|0,0,3]=3 2 B15R1.10394 C#CCC(=O)N(CC)c1ccccc1F 1626a_100000220365_100011220946 [0,0,0,0,0,0|1,0,3]=4 3 B15R1.10394 C=CCC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000210623 [0,0,0,0,0,0|2,0,2]=4 4 B15R1.10394 C=CCC(=O)C(OC)c1ccccc1C 1458a_100012277922_100000210623 [0,0,0,0,0,0|2,0,2]=4 5 B15R1.10394 C=CCC(=O)N(CC)c1ccccc1Br 11a_114873767003_100000210193 [0,0,0,0,0,0|1,0,2]=3 6 B15R1.10394 C=CCC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000210193 [0,0,0,0,0,0|1,0,2]=3 7 B15R1.10394 C=CCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000210193 [0,0,0,0,0,0|0,0,2]=2 8 B15R1.10394 C=CCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000210193 [0,0,0,0,0,0|0,0,2]=2 9 B15R1.10394 C=CCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000210193 [0,0,0,0,0,0|0,0,2]=2 10 B15R1.10394 C=CCC(=O)N(CC)c1ccccc1F 11a_100000220365_100000210193 [0,0,0,0,0,0|1,0,2]=3 11 B15R1.10394 C=CCC(=O)N(CC)c1ccccc1F 1626a_100000220365_100000210193 [0,0,0,0,0,0|1,0,2]=3 12 B15R1.10394 C=CCC(=O)N(CC)c1ccccc1O 22a_103624766699_100000210193 [0,0,0,0,0,0|1,0,2]=3 13 B15R1.10394 CC#CC(=O)N(CC)c1ccccc1C 22a_100000211084_100000763181 [0,0,0,0,0,0|0,0,2]=2 14 B15R1.10394 CC#CC(=O)N(CC)c1ccccc1O 22a_103624766699_100000763181 [0,0,0,0,0,0|1,0,2]=3 15 B15R1.10394 CC=CC(=O)N(CC)c1ccccc1Br 11a_114873767003_100000210699 [0,0,0,0,0,0|1,0,0]=1 16 B15R1.10394 CC=CC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000210699 [0,0,0,0,0,0|1,0,0]=1 17 B15R1.10394 CC=CC(=O)N(CC)c1ccccc1C 11a_100000211084_100000210699 [0,0,0,0,0,0|0,0,0]=0 18 B15R1.10394 CC=CC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000210699 [0,0,0,0,0,0|0,0,0]=0 19 B15R1.10394 CC=CC(=O)N(CC)c1ccccc1C 22a_100000211084_100000210699 [0,0,0,0,0,0|0,0,0]=0 20 B15R1.10394 CC=CC(=O)N(CC)c1ccccc1F 11a_100000220365_100000210699 [0,0,0,0,0,0|1,0,0]=1 21 B15R1.10394 CC=CC(=O)N(CC)c1ccccc1F 1626a_100000220365_100000210699 [0,0,0,0,0,0|1,0,0]=1 22 B15R1.10394 CC=CC(=O)N(CC)c1ccccc1O 22a_103624766699_100000210699 [0,0,0,0,0,0|1,0,0]=1 23 B15R1.10394 CCC(C(=O)NNC)c1ccccc1Cl 22a_100016993582_100011667493 [0,0,0,0,0,0|4,0,0]=4 24 B15R1.10394 CCCC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000210303 [0,0,0,0,0,0|2,0,2]=4 25 B15R1.10394 CCCC(=O)C(OC)c1ccccc1C 1458a_100012277922_100000210303 [0,0,0,0,0,0|2,0,2]=4 26 B15R1.10394 CCCC(=O)N(CC)c1ccccc1Br 11a_114873767003_100000211992 [0,0,0,0,0,0|1,0,2]=3 27 B15R1.10394 CCCC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000211992 [0,0,0,0,0,0|1,0,2]=3 28 B15R1.10394 CCCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000211992 [0,0,0,0,0,0|0,0,2]=2 29 B15R1.10394 CCCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000211992 [0,0,0,0,0,0|0,0,2]=2 30 B15R1.10394 CCCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000211992 [0,0,0,0,0,0|0,0,2]=2 31 B15R1.10394 CCCC(=O)N(CC)c1ccccc1F 11a_100000220365_100000211992 [0,0,0,0,0,0|1,0,2]=3 32 B15R1.10394 CCCC(=O)N(CC)c1ccccc1F 1626a_100000220365_100000211992 [0,0,0,0,0,0|1,0,2]=3 33 B15R1.10394 CCCC(=O)N(CC)c1ccccc1O 22a_103624766699_100000211992 [0,0,0,0,0,0|1,0,2]=3 34 B15R1.10394 CCCC(C)N(CC)c1ccccc1C 2230a_100000211084_100000766640 [0,0,0,0,0,0|1,0,3]=4 35 B15R1.10394 CCCC(C)N(CC)c1ccccc1C 269982a_100000211084_100000766640 [0,0,0,0,0,0|1,0,3]=4 36 B15R1.10394 CCCC(C)N(CC)c1ccccc1C 34a_100000211084_100000766640 [0,0,0,0,0,0|1,0,3]=4 37 B15R1.10394 CCN(C(=O)C=CBr)c1ccccc1Br 1626a_114873767003_100016273825 [0,0,0,0,0,0|2,0,0]=2 38 B15R1.10394 CCN(C(=O)C=CBr)c1ccccc1C 1626a_100000211084_100016273825 [0,0,0,0,0,0|1,0,0]=1 39 B15R1.10394 CCN(C(=O)C=CBr)c1ccccc1F 1626a_100000220365_100016273825 [0,0,0,0,0,0|2,0,0]=2 40 B15R1.10394 CCN(C(=O)C=CCl)c1ccccc1Br 11a_114873767003_200016279998 [0,0,0,0,0,0|2,0,0]=2 41 B15R1.10394 CCN(C(=O)C=CCl)c1ccccc1Br 1626a_114873767003_200016279998 [0,0,0,0,0,0|2,0,0]=2 42 B15R1.10394 CCN(C(=O)C=CCl)c1ccccc1C 11a_100000211084_200016279998 [0,0,0,0,0,0|1,0,0]=1 43 B15R1.10394 CCN(C(=O)C=CCl)c1ccccc1C 1626a_100000211084_200016279998 [0,0,0,0,0,0|1,0,0]=1 44 B15R1.10394 CCN(C(=O)C=CCl)c1ccccc1F 11a_100000220365_200016279998 [0,0,0,0,0,0|2,0,0]=2 45 B15R1.10394 CCN(C(=O)C=CCl)c1ccccc1F 1626a_100000220365_200016279998 [0,0,0,0,0,0|2,0,0]=2 46 B15R1.10394 CCN(C(=O)C=CI)c1ccccc1Br 1626a_114873767003_100016256311 [0,0,0,0,0,0|2,0,0]=2 47 B15R1.10394 CCN(C(=O)C=CI)c1ccccc1C 1626a_100000211084_100016256311 [0,0,0,0,0,0|1,0,0]=1 48 B15R1.10394 CCN(C(=O)C=CI)c1ccccc1F 1626a_100000220365_100016256311 [0,0,0,0,0,0|2,0,0]=2 49 B15R1.10394 CCN(C(=O)CC#N)c1ccccc1Br 1626a_114873767003_100051588842 [0,0,0,0,0,0|2,0,2]=4 50 B15R1.10394 CCN(C(=O)CC#N)c1ccccc1C 1626a_100000211084_100051588842 [0,0,0,0,0,0|1,0,2]=3 51 B15R1.10394 CCN(C(=O)CC#N)c1ccccc1C 22a_100000211084_100051588842 [0,0,0,0,0,0|1,0,2]=3 52 B15R1.10394 CCN(C(=O)CC#N)c1ccccc1F 1626a_100000220365_100051588842 [0,0,0,0,0,0|2,0,2]=4 53 B15R1.10394 CCN(C(=O)CC#N)c1ccccc1O 22a_103624766699_100051588842 [0,0,0,0,0,0|2,0,2]=4 54 B15R1.10394 CCN(C(=O)CCO)c1ccccc1C 22a_100000211084_100011216618 [0,0,0,0,0,0|1,0,2]=3 55 B15R1.10394 CCN(C(=O)CCO)c1ccccc1O 22a_103624766699_100011216618 [0,0,0,0,0,0|2,0,2]=4 56 B15R1.10394 CCN(C(=O)CNC)c1ccccc1C 2230a_106832991635_100000239579 [0,0,0,0,0,0|1,0,1]=2 57 B15R1.10394 CCN(C(=O)CNC)c1ccccc1C 34a_100102657272_100000239579 [0,0,0,0,0,0|1,0,1]=2 58 B15R1.10394 CCN(C(=O)CNC)c1ccccc1C 7a_106832991635_100000239579 [0,0,0,0,0,0|1,0,1]=2 59 B15R1.10394 CCN(C(=O)COC)c1ccccc1Br 11a_114873767003_100000210968 [0,0,0,0,0,0|2,0,1]=3 60 B15R1.10394 CCN(C(=O)COC)c1ccccc1Br 1626a_114873767003_100000210968 [0,0,0,0,0,0|2,0,1]=3 61 B15R1.10394 CCN(C(=O)COC)c1ccccc1C 11a_100000211084_100000210968 [0,0,0,0,0,0|1,0,1]=2 62 B15R1.10394 CCN(C(=O)COC)c1ccccc1C 1626a_100000211084_100000210968 [0,0,0,0,0,0|1,0,1]=2 63 B15R1.10394 CCN(C(=O)COC)c1ccccc1C 22a_100000211084_100000210968 [0,0,0,0,0,0|1,0,1]=2 64 B15R1.10394 CCN(C(=O)COC)c1ccccc1C 34a_100138415774_100000239579 [0,0,0,0,0,0|1,0,1]=2 65 B15R1.10394 CCN(C(=O)COC)c1ccccc1F 11a_100000220365_100000210968 [0,0,0,0,0,0|2,0,1]=3 66 B15R1.10394 CCN(C(=O)COC)c1ccccc1F 1626a_100000220365_100000210968 [0,0,0,0,0,0|2,0,1]=3 67 B15R1.10394 CCN(C(=O)COC)c1ccccc1O 22a_103624766699_100000210968 [0,0,0,0,0,0|2,0,1]=3 68 B15R1.10394 CCN(C(=O)CSC)c1ccccc1Br 11a_114873767003_100000184570 [0,0,0,0,0,0|2,0,1]=3 69 B15R1.10394 CCN(C(=O)CSC)c1ccccc1Br 1626a_114873767003_100000184570 [0,0,0,0,0,0|2,0,1]=3 70 B15R1.10394 CCN(C(=O)CSC)c1ccccc1C 11a_100000211084_100000184570 [0,0,0,0,0,0|1,0,1]=2 71 B15R1.10394 CCN(C(=O)CSC)c1ccccc1C 1626a_100000211084_100000184570 [0,0,0,0,0,0|1,0,1]=2 72 B15R1.10394 CCN(C(=O)CSC)c1ccccc1C 22a_100000211084_100000184570 [0,0,0,0,0,0|1,0,1]=2 73 B15R1.10394 CCN(C(=O)CSC)c1ccccc1C 62a_200000210301_100000239579 [0,0,0,0,0,0|1,0,1]=2 74 B15R1.10394 CCN(C(=O)CSC)c1ccccc1F 11a_100000220365_100000184570 [0,0,0,0,0,0|2,0,1]=3 75 B15R1.10394 CCN(C(=O)CSC)c1ccccc1F 1626a_100000220365_100000184570 [0,0,0,0,0,0|2,0,1]=3 76 B15R1.10394 CCN(C(=O)CSC)c1ccccc1O 22a_103624766699_100000184570 [0,0,0,0,0,0|2,0,1]=3 77 B15R1.10394 CCN(C(=O)CS[13CH3])c1ccccc1C 62a_200025704644_100000239579 [0,0,0,0,0,0|1,0,1]=2 78 B15R1.10394 CCN(C(=O)NNC)c1ccccc1Br 512a_114873767003_100016993582 [0,0,0,0,0,0|3,0,0]=3 79 B15R1.10394 CCN(C(=O)NNC)c1ccccc1C 512a_100000211084_100016993582 [0,0,0,0,0,0|2,0,0]=2 80 B15R1.10394 CCN(C(=O)NNC)c1ccccc1C 512a_100016993582_100000211084 [0,0,0,0,0,0|2,0,0]=2 81 B15R1.10394 CCN(C(=O)NNC)c1ccccc1F 512a_100000220365_100016993582 [0,0,0,0,0,0|3,0,0]=3 82 B15R1.10394 CCN(c1ccccc1C)C(C)COC 2230a_100000211084_100000765312 [0,0,0,0,0,0|2,0,2]=4 83 B15R1.10394 CCN(c1ccccc1C)C(C)COC 269982a_100000211084_100000765312 [0,0,0,0,0,0|2,0,2]=4 84 B15R1.10394 CCN(c1ccccc1C)C(C)COC 34a_100000211084_100000765312 [0,0,0,0,0,0|2,0,2]=4 85 B15R1.10394 CCNC(=O)C(CC)c1ccccc1Cl 11a_100015525214_100011667493 [0,0,0,0,0,0|3,0,1]=4 86 B15R1.10394 CCNC(=O)C(CC)c1ccccc1Cl 240690a_100015525214_100011667493 [0,0,0,0,0,0|3,0,1]=4 87 B15R1.10394 CCNC(=O)C(CC)c1ccccc1Cl 527a_100015525214_100011667493 [0,0,0,0,0,0|3,0,1]=4 88 B15R1.10394 CCNC(=O)C(OC)c1ccccc1C 11a_100015525214_100012277922 [0,0,0,0,0,0|3,0,1]=4 89 B15R1.10394 CCNC(=O)C(OC)c1ccccc1C 240690a_100015525214_100012277922 [0,0,0,0,0,0|3,0,1]=4 90 B15R1.10394 CCNC(=O)C(OC)c1ccccc1C 527a_100015525214_100012277922 [0,0,0,0,0,0|3,0,1]=4 91 B15R1.10394 CCNC(=O)N(CC)c1ccccc1Br 512a_114873767003_100015525214 [0,0,0,0,0,0|2,0,1]=3 92 B15R1.10394 CCNC(=O)N(CC)c1ccccc1C 512a_100000211084_100015525214 [0,0,0,0,0,0|1,0,1]=2 93 B15R1.10394 CCNC(=O)N(CC)c1ccccc1C 512a_100015525214_100000211084 [0,0,0,0,0,0|1,0,1]=2 94 B15R1.10394 CCNC(=O)N(CC)c1ccccc1F 512a_100000220365_100015525214 [0,0,0,0,0,0|2,0,1]=3 95 B15R1.10394 CNNC(=O)C(OC)c1ccccc1C 22a_100016993582_100012277922 [0,0,0,0,0,0|4,0,0]=4 96 B14R1.604 C#CCC(=O)N(CC)c1ccccc1 1626a_100000210013_100011220946 [1,0,0,0,0,0|0,0,3]=4 97 B14R1.604 C=CCC(=O)C(CC)c1ccccc1 1458a_100000211302_100000210623 [1,0,0,0,0,0|1,0,2]=4 98 B14R1.604 C=CCC(=O)N(CC)c1ccccc1 11a_100000210013_100000210193 [1,0,0,0,0,0|0,0,2]=3 99 B14R1.604 C=CCC(=O)N(CC)c1ccccc1 1626a_100000210013_100000210193 [1,0,0,0,0,0|0,0,2]=3 100 B14R1.604 C=CCC(=O)N(CC)c1ccccc1 22a_100000210013_100000210193 [1,0,0,0,0,0|0,0,2]=3 101 B14R1.604 CC#CC(=O)N(CC)c1ccccc1 22a_100000210013_100000763181 [1,0,0,0,0,0|0,0,2]=3 102 B14R1.604 CC=CC(=O)N(CC)c1ccccc1 11a_100000210013_100000210699 [1,0,0,0,0,0|0,0,0]=1 103 B14R1.604 CC=CC(=O)N(CC)c1ccccc1 1626a_100000210013_100000210699 [1,0,0,0,0,0|0,0,0]=1 104 B14R1.604 CC=CC(=O)N(CC)c1ccccc1 22a_100000210013_100000210699 [1,0,0,0,0,0|0,0,0]=1 105 B14R1.604 CCC(C(=O)NNC)c1ccccc1 22a_100016993582_100000211302 [1,0,0,0,0,0|3,0,0]=4 106 B14R1.604 CCCC(=O)C(CC)c1ccccc1 1458a_100000211302_100000210303 [1,0,0,0,0,0|1,0,2]=4 107 B14R1.604 CCCC(=O)N(CC)c1ccccc1 11a_100000210013_100000211992 [1,0,0,0,0,0|0,0,2]=3 108 B14R1.604 CCCC(=O)N(CC)c1ccccc1 1626a_100000210013_100000211992 [1,0,0,0,0,0|0,0,2]=3 109 B14R1.604 CCCC(=O)N(CC)c1ccccc1 22a_100000210013_100000211992 [1,0,0,0,0,0|0,0,2]=3 110 B14R1.604 CCN(C(=O)C=CBr)c1ccccc1 1626a_100000210013_100016273825 [1,0,0,0,0,0|1,0,0]=2 111 B14R1.604 CCN(C(=O)C=CCl)c1ccccc1 11a_100000210013_200016279998 [1,0,0,0,0,0|1,0,0]=2 112 B14R1.604 CCN(C(=O)C=CCl)c1ccccc1 1626a_100000210013_200016279998 [1,0,0,0,0,0|1,0,0]=2 113 B14R1.604 CCN(C(=O)C=CI)c1ccccc1 1626a_100000210013_100016256311 [1,0,0,0,0,0|1,0,0]=2 114 B14R1.604 CCN(C(=O)CC#N)c1ccccc1 1626a_100000210013_100051588842 [1,0,0,0,0,0|1,0,2]=4 115 B14R1.604 CCN(C(=O)CC#N)c1ccccc1 22a_100000210013_100051588842 [1,0,0,0,0,0|1,0,2]=4 116 B14R1.604 CCN(C(=O)CCO)c1ccccc1 22a_100000210013_100011216618 [1,0,0,0,0,0|1,0,2]=4 117 B14R1.604 CCN(C(=O)CNC)c1ccccc1 2230a_106832991635_100000183513 [1,0,0,0,0,0|1,0,1]=3 118 B14R1.604 CCN(C(=O)CNC)c1ccccc1 34a_100102657272_100000183513 [1,0,0,0,0,0|1,0,1]=3 119 B14R1.604 CCN(C(=O)CNC)c1ccccc1 7a_106832991635_100000183513 [1,0,0,0,0,0|1,0,1]=3 120 B14R1.604 CCN(C(=O)COC)c1ccccc1 11a_100000210013_100000210968 [1,0,0,0,0,0|1,0,1]=3 121 B14R1.604 CCN(C(=O)COC)c1ccccc1 1626a_100000210013_100000210968 [1,0,0,0,0,0|1,0,1]=3 122 B14R1.604 CCN(C(=O)COC)c1ccccc1 22a_100000210013_100000210968 [1,0,0,0,0,0|1,0,1]=3 123 B14R1.604 CCN(C(=O)COC)c1ccccc1 34a_100138415774_100000183513 [1,0,0,0,0,0|1,0,1]=3 124 B14R1.604 CCN(C(=O)CSC)c1ccccc1 11a_100000210013_100000184570 [1,0,0,0,0,0|1,0,1]=3 125 B14R1.604 CCN(C(=O)CSC)c1ccccc1 1626a_100000210013_100000184570 [1,0,0,0,0,0|1,0,1]=3 126 B14R1.604 CCN(C(=O)CSC)c1ccccc1 22a_100000210013_100000184570 [1,0,0,0,0,0|1,0,1]=3 127 B14R1.604 CCN(C(=O)CSC)c1ccccc1 62a_200000210301_100000183513 [1,0,0,0,0,0|1,0,1]=3 128 B14R1.604 CCN(C(=O)CS[13CH3])c1ccccc1 62a_200025704644_100000183513 [1,0,0,0,0,0|1,0,1]=3 129 B14R1.604 CCNC(=O)C(CC)c1ccccc1 11a_100015525214_100000211302 [1,0,0,0,0,0|2,0,1]=4 130 B14R1.604 CCNC(=O)C(CC)c1ccccc1 240690a_100015525214_100000211302 [1,0,0,0,0,0|2,0,1]=4 131 B14R1.604 CCNC(=O)C(CC)c1ccccc1 527a_100015525214_100000211302 [1,0,0,0,0,0|2,0,1]=4 132 B14R1.3111 C/C=C/CN(CC)c1ccccc1Br 269982a_114873767003_100102629194 [1,0,0,0,0,0|1,0,1]=3 133 B14R1.3111 C/C=C/CN(CC)c1ccccc1Br 34a_114873767003_100102629194 [1,0,0,0,0,0|1,0,1]=3 134 B14R1.3111 C/C=C/CN(CC)c1ccccc1C 269982a_100000211084_100102629194 [1,0,0,0,0,0|0,0,1]=2 135 B14R1.3111 C/C=C/CN(CC)c1ccccc1C 34a_100000211084_100102629194 [1,0,0,0,0,0|0,0,1]=2 136 B14R1.3111 C/C=C/CN(CC)c1ccccc1F 269982a_100000220365_100102629194 [1,0,0,0,0,0|1,0,1]=3 137 B14R1.3111 C/C=C/CN(CC)c1ccccc1F 34a_100000220365_100102629194 [1,0,0,0,0,0|1,0,1]=3 138 B14R1.3111 C/C=C/CN(CC)c1ccccc1O 269982a_103624766699_100102629194 [1,0,0,0,0,0|1,0,1]=3 139 B14R1.3111 C=CCCN(CC)c1ccccc1C 2230a_100000211084_100000754431 [1,0,0,0,0,0|0,0,3]=4 140 B14R1.3111 C=CCCN(CC)c1ccccc1C 269982a_100000211084_100000754431 [1,0,0,0,0,0|0,0,3]=4 141 B14R1.3111 C=CCCN(CC)c1ccccc1C 34a_100000211084_100000754431 [1,0,0,0,0,0|0,0,3]=4 142 B14R1.3111 CC#CCN(CC)c1ccccc1C 2230a_100000211084_100000748600 [1,0,0,0,0,0|0,0,3]=4 143 B14R1.3111 CC#CCN(CC)c1ccccc1C 34a_100000211084_100000748600 [1,0,0,0,0,0|0,0,3]=4 144 B14R1.3111 CC=CCN(CC)c1ccccc1Br 2230a_114873767003_100000070051 [1,0,0,0,0,0|1,0,1]=3 145 B14R1.3111 CC=CCN(CC)c1ccccc1Br 34a_114873767003_100000070051 [1,0,0,0,0,0|1,0,1]=3 146 B14R1.3111 CC=CCN(CC)c1ccccc1C 2230a_100000211084_100000070051 [1,0,0,0,0,0|0,0,1]=2 147 B14R1.3111 CC=CCN(CC)c1ccccc1C 34a_100000211084_100000070051 [1,0,0,0,0,0|0,0,1]=2 148 B14R1.3111 CC=CCN(CC)c1ccccc1F 2230a_100000220365_100000070051 [1,0,0,0,0,0|1,0,1]=3 149 B14R1.3111 CC=CCN(CC)c1ccccc1F 34a_100000220365_100000070051 [1,0,0,0,0,0|1,0,1]=3 150 B14R1.3111 CCCCN(CC)c1ccccc1C 2230a_100000211084_100000210211 [1,0,0,0,0,0|0,0,3]=4 151 B14R1.3111 CCCCN(CC)c1ccccc1C 269982a_100000211084_100000210211 [1,0,0,0,0,0|0,0,3]=4 152 B14R1.3111 CCCCN(CC)c1ccccc1C 34a_100000211084_100000210210 [1,0,0,0,0,0|0,0,3]=4 153 B14R1.3111 CCN(CCOC)c1ccccc1C 2230a_100000211084_100011201679 [1,0,0,0,0,0|1,0,2]=4 154 B14R1.3111 CCN(CCOC)c1ccccc1C 269982a_100000211084_100000233755 [1,0,0,0,0,0|1,0,2]=4 155 B14R1.3111 CCN(CCOC)c1ccccc1C 34a_100000211084_100011201679 [1,0,0,0,0,0|1,0,2]=4 156 B14R1.3111 CCN(CCSC)c1ccccc1C 2230a_100000211084_100000751147 [1,0,0,0,0,0|1,0,2]=4 157 B14R1.3111 CCN(CCSC)c1ccccc1C 269982a_100000211084_100000212216 [1,0,0,0,0,0|1,0,2]=4 158 B14R1.3111 CCN(CCSC)c1ccccc1C 34a_100000211084_100000212216 [1,0,0,0,0,0|1,0,2]=4 159 B14R1.3111 CCOCN(CC)c1ccccc1C 269982a_100000211084_100000739092 [1,0,0,0,0,0|1,0,2]=4 160 B14R1.3348 C#CCC(=O)N(C)c1ccccc1C 1626a_100000219699_100011220946 [1,0,0,0,0,0|0,0,3]=4 161 B14R1.3348 C=CCC(=O)N(C)c1ccccc1Br 11a_100020606079_100000210193 [1,0,0,0,0,0|1,0,2]=4 162 B14R1.3348 C=CCC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000210193 [1,0,0,0,0,0|1,0,2]=4 163 B14R1.3348 C=CCC(=O)N(C)c1ccccc1C 11a_100000219699_100000210193 [1,0,0,0,0,0|0,0,2]=3 164 B14R1.3348 C=CCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000210193 [1,0,0,0,0,0|0,0,2]=3 165 B14R1.3348 C=CCC(=O)N(C)c1ccccc1C 22a_100000219699_100000210193 [1,0,0,0,0,0|0,0,2]=3 166 B14R1.3348 C=CCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000210193 [1,0,0,0,0,0|1,0,2]=4 167 B14R1.3348 C=CCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000210193 [1,0,0,0,0,0|1,0,2]=4 168 B14R1.3348 C=CCC(=O)N(C)c1ccccc1F 11a_100000220357_100000210193 [1,0,0,0,0,0|1,0,2]=4 169 B14R1.3348 C=CCC(=O)N(C)c1ccccc1F 1626a_100000220357_100000210193 [1,0,0,0,0,0|1,0,2]=4 170 B14R1.3348 C=CCC(=O)N(C)c1ccccc1F 22a_100000220357_100000210193 [1,0,0,0,0,0|1,0,2]=4 171 B14R1.3348 C=CCC(=O)N(C)c1ccccc1O 22a_100000033821_100000210193 [1,0,0,0,0,0|1,0,2]=4 172 B14R1.3348 C=CCC(=O)N(C)c1ccccc1O 527a_100000033821_100000210193 [1,0,0,0,0,0|1,0,2]=4 173 B14R1.3348 CC#CC(=O)N(C)c1ccccc1C 22a_100000219699_100000763181 [1,0,0,0,0,0|0,0,2]=3 174 B14R1.3348 CC#CC(=O)N(C)c1ccccc1F 22a_100000220357_100000763181 [1,0,0,0,0,0|1,0,2]=4 175 B14R1.3348 CC#CC(=O)N(C)c1ccccc1O 22a_100000033821_100000763181 [1,0,0,0,0,0|1,0,2]=4 176 B14R1.3348 CC(C(=O)C=CBr)c1ccccc1Cl 1458a_100016273825_100000181259 [1,0,0,0,0,0|3,0,0]=4 177 B14R1.3348 CC(C(=O)C=CBr)c1ccccc1F 1458a_100016273825_200000741388 [1,0,0,0,0,0|3,0,0]=4 178 B14R1.3348 CC(C(=O)C=CCl)c1ccccc1Cl 1458a_200016279998_100000181259 [1,0,0,0,0,0|3,0,0]=4 179 B14R1.3348 CC(C(=O)C=CCl)c1ccccc1F 1458a_200016279998_200000741388 [1,0,0,0,0,0|3,0,0]=4 180 B14R1.3348 CC(C(=O)C=CI)c1ccccc1Cl 1458a_100016256311_100000181259 [1,0,0,0,0,0|3,0,0]=4 181 B14R1.3348 CC(C(=O)C=CI)c1ccccc1F 1458a_100016256311_200000741388 [1,0,0,0,0,0|3,0,0]=4 182 B14R1.3348 CC=CC(=O)C(C)c1ccccc1Cl 1458a_100000210699_100000181259 [1,0,0,0,0,0|2,0,0]=3 183 B14R1.3348 CC=CC(=O)C(C)c1ccccc1F 1458a_100000210699_200000741388 [1,0,0,0,0,0|2,0,0]=3 184 B14R1.3348 CC=CC(=O)N(C)c1ccccc1Br 11a_100020606079_100000210699 [1,0,0,0,0,0|1,0,0]=2 185 B14R1.3348 CC=CC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000210699 [1,0,0,0,0,0|1,0,0]=2 186 B14R1.3348 CC=CC(=O)N(C)c1ccccc1C 11a_100000219699_100000210699 [1,0,0,0,0,0|0,0,0]=1 187 B14R1.3348 CC=CC(=O)N(C)c1ccccc1C 1626a_100000219699_100000210699 [1,0,0,0,0,0|0,0,0]=1 188 B14R1.3348 CC=CC(=O)N(C)c1ccccc1C 22a_100000219699_100000210699 [1,0,0,0,0,0|0,0,0]=1 189 B14R1.3348 CC=CC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000210699 [1,0,0,0,0,0|1,0,0]=2 190 B14R1.3348 CC=CC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000210699 [1,0,0,0,0,0|1,0,0]=2 191 B14R1.3348 CC=CC(=O)N(C)c1ccccc1F 11a_100000220357_100000210699 [1,0,0,0,0,0|1,0,0]=2 192 B14R1.3348 CC=CC(=O)N(C)c1ccccc1F 1626a_100000220357_100000210699 [1,0,0,0,0,0|1,0,0]=2 193 B14R1.3348 CC=CC(=O)N(C)c1ccccc1F 22a_100000220357_100000210699 [1,0,0,0,0,0|1,0,0]=2 194 B14R1.3348 CC=CC(=O)N(C)c1ccccc1O 22a_100000033821_100000210699 [1,0,0,0,0,0|1,0,0]=2 195 B14R1.3348 CCCC(=O)N(C)c1ccccc1Br 11a_100020606079_100000211992 [1,0,0,0,0,0|1,0,2]=4 196 B14R1.3348 CCCC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000211992 [1,0,0,0,0,0|1,0,2]=4 197 B14R1.3348 CCCC(=O)N(C)c1ccccc1C 11a_100000219699_100000211992 [1,0,0,0,0,0|0,0,2]=3 198 B14R1.3348 CCCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000211992 [1,0,0,0,0,0|0,0,2]=3 199 B14R1.3348 CCCC(=O)N(C)c1ccccc1C 22a_100000219699_100000211992 [1,0,0,0,0,0|0,0,2]=3 200 B14R1.3348 CCCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000211992 [1,0,0,0,0,0|1,0,2]=4 201 B14R1.3348 CCCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000211992 [1,0,0,0,0,0|1,0,2]=4 202 B14R1.3348 CCCC(=O)N(C)c1ccccc1F 11a_100000220357_100000211992 [1,0,0,0,0,0|1,0,2]=4 203 B14R1.3348 CCCC(=O)N(C)c1ccccc1F 1626a_100000220357_100000211992 [1,0,0,0,0,0|1,0,2]=4 204 B14R1.3348 CCCC(=O)N(C)c1ccccc1F 22a_100000220357_100000211992 [1,0,0,0,0,0|1,0,2]=4 205 B14R1.3348 CCCC(=O)N(C)c1ccccc1O 22a_100000033821_100000211992 [1,0,0,0,0,0|1,0,2]=4 206 B14R1.3348 CCCC(=O)N(C)c1ccccc1O 527a_100000033821_100000211992 [1,0,0,0,0,0|1,0,2]=4 207 B14R1.3348 CCNC(=O)N(C)c1ccccc1Br 512a_100015525214_100020606079 [1,0,0,0,0,0|2,0,1]=4 208 B14R1.3348 CCNC(=O)N(C)c1ccccc1C 512a_100015525214_100000219699 [1,0,0,0,0,0|1,0,1]=3 209 B14R1.3348 CCNC(=O)N(C)c1ccccc1Cl 512a_100015525214_100000219374 [1,0,0,0,0,0|2,0,1]=4 210 B14R1.3348 CN(C(=O)C=CBr)c1ccccc1Br 1626a_100020606079_100016273825 [1,0,0,0,0,0|2,0,0]=3 211 B14R1.3348 CN(C(=O)C=CBr)c1ccccc1Cl 1626a_100000219374_100016273825 [1,0,0,0,0,0|2,0,0]=3 212 B14R1.3348 CN(C(=O)C=CBr)c1ccccc1F 1626a_100000220357_100016273825 [1,0,0,0,0,0|2,0,0]=3 213 B14R1.3348 CN(C(=O)C=CCl)c1ccccc1Br 11a_100020606079_200016279998 [1,0,0,0,0,0|2,0,0]=3 214 B14R1.3348 CN(C(=O)C=CCl)c1ccccc1Br 1626a_100020606079_200016279998 [1,0,0,0,0,0|2,0,0]=3 215 B14R1.3348 CN(C(=O)C=CCl)c1ccccc1Cl 11a_100000219374_200016279998 [1,0,0,0,0,0|2,0,0]=3 216 B14R1.3348 CN(C(=O)C=CCl)c1ccccc1Cl 1626a_100000219374_200016279998 [1,0,0,0,0,0|2,0,0]=3 217 B14R1.3348 CN(C(=O)C=CCl)c1ccccc1F 11a_100000220357_200016279998 [1,0,0,0,0,0|2,0,0]=3 218 B14R1.3348 CN(C(=O)C=CCl)c1ccccc1F 1626a_100000220357_200016279998 [1,0,0,0,0,0|2,0,0]=3 219 B14R1.3348 CN(C(=O)C=CI)c1ccccc1Br 1626a_100020606079_100016256311 [1,0,0,0,0,0|2,0,0]=3 220 B14R1.3348 CN(C(=O)C=CI)c1ccccc1Cl 1626a_100000219374_100016256311 [1,0,0,0,0,0|2,0,0]=3 221 B14R1.3348 CN(C(=O)C=CI)c1ccccc1F 1626a_100000220357_100016256311 [1,0,0,0,0,0|2,0,0]=3 222 B14R1.3348 CNNC(=O)N(C)c1ccccc1Br 512a_100016993582_100020606079 [1,0,0,0,0,0|3,0,0]=4 223 B14R1.3348 CNNC(=O)N(C)c1ccccc1C 512a_100016993582_100000219699 [1,0,0,0,0,0|2,0,0]=3 224 B14R1.3348 CNNC(=O)N(C)c1ccccc1Cl 512a_100016993582_100000219374 [1,0,0,0,0,0|3,0,0]=4 225 B14R1.3348 COCC(=O)N(C)c1ccccc1Br 11a_100020606079_100000210968 [1,0,0,0,0,0|2,0,1]=4 226 B14R1.3348 COCC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000210968 [1,0,0,0,0,0|2,0,1]=4 227 B14R1.3348 COCC(=O)N(C)c1ccccc1C 11a_100000219699_100000210968 [1,0,0,0,0,0|1,0,1]=3 228 B14R1.3348 COCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000210968 [1,0,0,0,0,0|1,0,1]=3 229 B14R1.3348 COCC(=O)N(C)c1ccccc1C 22a_100000219699_100000210968 [1,0,0,0,0,0|1,0,1]=3 230 B14R1.3348 COCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000210968 [1,0,0,0,0,0|2,0,1]=4 231 B14R1.3348 COCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000210968 [1,0,0,0,0,0|2,0,1]=4 232 B14R1.3348 COCC(=O)N(C)c1ccccc1F 11a_100000220357_100000210968 [1,0,0,0,0,0|2,0,1]=4 233 B14R1.3348 COCC(=O)N(C)c1ccccc1F 1626a_100000220357_100000210968 [1,0,0,0,0,0|2,0,1]=4 234 B14R1.3348 COCC(=O)N(C)c1ccccc1F 22a_100000220357_100000210968 [1,0,0,0,0,0|2,0,1]=4 235 B14R1.3348 COCC(=O)N(C)c1ccccc1O 22a_100000033821_100000210968 [1,0,0,0,0,0|2,0,1]=4 236 B14R1.3348 COCC(=O)N(C)c1ccccc1O 527a_100000033821_100000210968 [1,0,0,0,0,0|2,0,1]=4 237 B14R1.3348 CSCC(=O)N(C)c1ccccc1Br 11a_100020606079_100000184570 [1,0,0,0,0,0|2,0,1]=4 238 B14R1.3348 CSCC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000184570 [1,0,0,0,0,0|2,0,1]=4 239 B14R1.3348 CSCC(=O)N(C)c1ccccc1C 11a_100000219699_100000184570 [1,0,0,0,0,0|1,0,1]=3 240 B14R1.3348 CSCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000184570 [1,0,0,0,0,0|1,0,1]=3 241 B14R1.3348 CSCC(=O)N(C)c1ccccc1C 22a_100000219699_100000184570 [1,0,0,0,0,0|1,0,1]=3 242 B14R1.3348 CSCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000184570 [1,0,0,0,0,0|2,0,1]=4 243 B14R1.3348 CSCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000184570 [1,0,0,0,0,0|2,0,1]=4 244 B14R1.3348 CSCC(=O)N(C)c1ccccc1F 11a_100000220357_100000184570 [1,0,0,0,0,0|2,0,1]=4 245 B14R1.3348 CSCC(=O)N(C)c1ccccc1F 1626a_100000220357_100000184570 [1,0,0,0,0,0|2,0,1]=4 246 B14R1.3348 CSCC(=O)N(C)c1ccccc1F 22a_100000220357_100000184570 [1,0,0,0,0,0|2,0,1]=4 247 B14R1.3348 CSCC(=O)N(C)c1ccccc1O 22a_100000033821_100000184570 [1,0,0,0,0,0|2,0,1]=4 248 B14R1.3348 CSCC(=O)N(C)c1ccccc1O 527a_100000033821_100000184570 [1,0,0,0,0,0|2,0,1]=4 249 B14R1.3348 Cc1ccccc1N(C)C(=O)C=CBr 1626a_100000219699_100016273825 [1,0,0,0,0,0|1,0,0]=2 250 B14R1.3348 Cc1ccccc1N(C)C(=O)C=CCl 11a_100000219699_200016279998 [1,0,0,0,0,0|1,0,0]=2 251 B14R1.3348 Cc1ccccc1N(C)C(=O)C=CCl 1626a_100000219699_200016279998 [1,0,0,0,0,0|1,0,0]=2 252 B14R1.3348 Cc1ccccc1N(C)C(=O)C=CI 1626a_100000219699_100016256311 [1,0,0,0,0,0|1,0,0]=2 253 B14R1.3348 Cc1ccccc1N(C)C(=O)CC#N 1626a_100000219699_100051588842 [1,0,0,0,0,0|1,0,2]=4 254 B14R1.3348 Cc1ccccc1N(C)C(=O)CC#N 22a_100000219699_100051588842 [1,0,0,0,0,0|1,0,2]=4 255 B14R1.3348 Cc1ccccc1N(C)C(=O)CCO 22a_100000219699_100011216618 [1,0,0,0,0,0|1,0,2]=4 256 B14R1.7706 C=CC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000185746 [1,0,0,0,0,0|1,0,0]=2 257 B14R1.7706 C=CC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000185746 [1,0,0,0,0,0|0,0,0]=1 258 B14R1.7706 C=CC(=O)N(CC)c1ccccc1C 22a_100000211084_100000185746 [1,0,0,0,0,0|0,0,0]=1 259 B14R1.7706 C=CC(=O)N(CC)c1ccccc1F 1626a_100000220365_100000185746 [1,0,0,0,0,0|1,0,0]=2 260 B14R1.7706 C=CC(=O)N(CC)c1ccccc1O 22a_103624766699_100000185746 [1,0,0,0,0,0|1,0,0]=2 261 B14R1.7706 C=CC(C)N(CC)c1ccccc1Br 269982a_114873767003_100011215867 [1,0,0,0,0,0|2,0,1]=4 262 B14R1.7706 C=CC(C)N(CC)c1ccccc1C 269982a_100000211084_100011215867 [1,0,0,0,0,0|1,0,1]=3 263 B14R1.7706 C=CC(C)N(CC)c1ccccc1F 269982a_100000220365_100011215867 [1,0,0,0,0,0|2,0,1]=4 264 B14R1.7706 C=CC(C)N(CC)c1ccccc1O 269982a_103624766699_100011215867 [1,0,0,0,0,0|2,0,1]=4 265 B14R1.7706 CCC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000210202 [1,0,0,0,0,0|2,0,1]=4 266 B14R1.7706 CCC(=O)C(OC)c1ccccc1C 1458a_100012277922_100000210202 [1,0,0,0,0,0|2,0,1]=4 267 B14R1.7706 CCC(=O)N(CC)c1ccccc1Br 11a_114873767003_100000210414 [1,0,0,0,0,0|1,0,1]=3 268 B14R1.7706 CCC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000210414 [1,0,0,0,0,0|1,0,1]=3 269 B14R1.7706 CCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000210414 [1,0,0,0,0,0|0,0,1]=2 270 B14R1.7706 CCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000210414 [1,0,0,0,0,0|0,0,1]=2 271 B14R1.7706 CCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000210414 [1,0,0,0,0,0|0,0,1]=2 272 B14R1.7706 CCC(=O)N(CC)c1ccccc1F 11a_100000220365_100000210414 [1,0,0,0,0,0|1,0,1]=3 273 B14R1.7706 CCC(=O)N(CC)c1ccccc1F 1626a_100000220365_100000210414 [1,0,0,0,0,0|1,0,1]=3 274 B14R1.7706 CCC(=O)N(CC)c1ccccc1O 22a_103624766699_100000210414 [1,0,0,0,0,0|1,0,1]=3 275 B14R1.7706 CCC(C(=O)NC)c1ccccc1Cl 11a_106832991635_100011667493 [1,0,0,0,0,0|3,0,0]=4 276 B14R1.7706 CCC(C(=O)NC)c1ccccc1Cl 1626a_100102657272_100011667493 [1,0,0,0,0,0|3,0,0]=4 277 B14R1.7706 CCC(C(=O)NC)c1ccccc1Cl 240690a_100102657272_100011667493 [1,0,0,0,0,0|3,0,0]=4 278 B14R1.7706 CCC(C(=O)NC)c1ccccc1Cl 527a_100102657272_100011667493 [1,0,0,0,0,0|3,0,0]=4 279 B14R1.7706 CCC(C)N(CC)c1ccccc1C 2230a_100000211084_100000758301 [1,0,0,0,0,0|1,0,2]=4 280 B14R1.7706 CCC(C)N(CC)c1ccccc1C 269982a_100000211084_100000758301 [1,0,0,0,0,0|1,0,2]=4 281 B14R1.7706 CCC(C)N(CC)c1ccccc1C 34a_100000211084_100011215416 [1,0,0,0,0,0|1,0,2]=4 282 B14R1.7706 CCN(C(=O)CO)c1ccccc1C 22a_100000211084_100000210174 [1,0,0,0,0,0|1,0,1]=3 283 B14R1.7706 CCN(C(=O)CO)c1ccccc1O 22a_103624766699_100000210174 [1,0,0,0,0,0|2,0,1]=4 284 B14R1.7706 CCN(C(=O)NC)c1ccccc1Br 512a_114873767003_100102657272 [1,0,0,0,0,0|2,0,0]=3 285 B14R1.7706 CCN(C(=O)NC)c1ccccc1C 512a_100000211084_100102657272 [1,0,0,0,0,0|1,0,0]=2 286 B14R1.7706 CCN(C(=O)NC)c1ccccc1C 512a_106832991638_100000211084 [1,0,0,0,0,0|1,0,0]=2 287 B14R1.7706 CCN(C(=O)NC)c1ccccc1F 512a_100000220365_100102657272 [1,0,0,0,0,0|2,0,0]=3 288 B14R1.7706 CCN(c1ccccc1C)C(C)OC 269982a_100000211084_100009879195 [1,0,0,0,0,0|2,0,1]=4 289 B14R1.7706 CNC(=O)C(OC)c1ccccc1C 11a_106832991635_100012277922 [1,0,0,0,0,0|3,0,0]=4 290 B14R1.7706 CNC(=O)C(OC)c1ccccc1C 1626a_100102657272_100012277922 [1,0,0,0,0,0|3,0,0]=4 291 B14R1.7706 CNC(=O)C(OC)c1ccccc1C 240690a_100102657272_100012277922 [1,0,0,0,0,0|3,0,0]=4 292 B14R1.7706 CNC(=O)C(OC)c1ccccc1C 527a_100102657272_100012277922 [1,0,0,0,0,0|3,0,0]=4 293 B16R1.895 C#CCC(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100011220946 [0,1,0,0,0,0|0,0,3]=4 294 B16R1.895 C=CCC(=O)N(CC)c1cccc(c1C)C 11a_100000219776_100000210193 [0,1,0,0,0,0|0,0,2]=3 295 B16R1.895 C=CCC(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100000210193 [0,1,0,0,0,0|0,0,2]=3 296 B16R1.895 C=CCC(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100000210193 [0,1,0,0,0,0|0,0,2]=3 297 B16R1.895 CC#CC(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100000763181 [0,1,0,0,0,0|0,0,2]=3 298 B16R1.895 CC=CC(=O)N(CC)c1cccc(c1C)C 11a_100000219776_100000210699 [0,1,0,0,0,0|0,0,0]=1 299 B16R1.895 CC=CC(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100000210699 [0,1,0,0,0,0|0,0,0]=1 300 B16R1.895 CC=CC(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100000210699 [0,1,0,0,0,0|0,0,0]=1 301 B16R1.895 CCCC(=O)N(CC)c1cccc(c1C)C 11a_100000219776_100000211992 [0,1,0,0,0,0|0,0,2]=3 302 B16R1.895 CCCC(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100000211992 [0,1,0,0,0,0|0,0,2]=3 303 B16R1.895 CCCC(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100000211992 [0,1,0,0,0,0|0,0,2]=3 304 B16R1.895 CCN(C(=O)C=CBr)c1cccc(c1C)C 1626a_100000219776_100016273825 [0,1,0,0,0,0|1,0,0]=2 305 B16R1.895 CCN(C(=O)C=CCl)c1cccc(c1C)C 11a_100000219776_200016279998 [0,1,0,0,0,0|1,0,0]=2 306 B16R1.895 CCN(C(=O)C=CCl)c1cccc(c1C)C 1626a_100000219776_200016279998 [0,1,0,0,0,0|1,0,0]=2 307 B16R1.895 CCN(C(=O)C=CI)c1cccc(c1C)C 1626a_100000219776_100016256311 [0,1,0,0,0,0|1,0,0]=2 308 B16R1.895 CCN(C(=O)CC#N)c1cccc(c1C)C 1626a_100000219776_100051588842 [0,1,0,0,0,0|1,0,2]=4 309 B16R1.895 CCN(C(=O)CC#N)c1cccc(c1C)C 22a_100000219776_100051588842 [0,1,0,0,0,0|1,0,2]=4 310 B16R1.895 CCN(C(=O)CCO)c1cccc(c1C)C 22a_100000219776_100011216618 [0,1,0,0,0,0|1,0,2]=4 311 B16R1.895 CCN(C(=O)COC)c1cccc(c1C)C 11a_100000219776_100000210968 [0,1,0,0,0,0|1,0,1]=3 312 B16R1.895 CCN(C(=O)COC)c1cccc(c1C)C 1626a_100000219776_100000210968 [0,1,0,0,0,0|1,0,1]=3 313 B16R1.895 CCN(C(=O)COC)c1cccc(c1C)C 22a_100000219776_100000210968 [0,1,0,0,0,0|1,0,1]=3 314 B16R1.895 CCN(C(=O)CSC)c1cccc(c1C)C 11a_100000219776_100000184570 [0,1,0,0,0,0|1,0,1]=3 315 B16R1.895 CCN(C(=O)CSC)c1cccc(c1C)C 1626a_100000219776_100000184570 [0,1,0,0,0,0|1,0,1]=3 316 B16R1.895 CCN(C(=O)CSC)c1cccc(c1C)C 22a_100000219776_100000184570 [0,1,0,0,0,0|1,0,1]=3 317 B16R1.895 CCN(C(=O)NNC)c1cccc(c1C)C 512a_100000219776_100016993582 [0,1,0,0,0,0|2,0,0]=3 318 B16R1.895 CCN(C(=O)NNC)c1cccc(c1C)C 512a_100016993582_100000219776 [0,1,0,0,0,0|2,0,0]=3 319 B16R1.895 CCNC(=O)N(CC)c1cccc(c1C)C 512a_100000219776_100015525214 [0,1,0,0,0,0|1,0,1]=3 320 B16R1.895 CCNC(=O)N(CC)c1cccc(c1C)C 512a_100015525214_100000219776 [0,1,0,0,0,0|1,0,1]=3 321 B16R1.2644 C/C=C(\C)/C(=O)N(CC)c1ccccc1Br 11a_114873767003_100020587367 [0,1,0,0,0,0|1,0,0]=2 322 B16R1.2644 C/C=C(\C)/C(=O)N(CC)c1ccccc1Br 1626a_114873767003_100020587367 [0,1,0,0,0,0|1,0,0]=2 323 B16R1.2644 C/C=C(\C)/C(=O)N(CC)c1ccccc1C 11a_100000211084_100020587367 [0,1,0,0,0,0|0,0,0]=1 324 B16R1.2644 C/C=C(\C)/C(=O)N(CC)c1ccccc1C 1626a_100000211084_100020587367 [0,1,0,0,0,0|0,0,0]=1 325 B16R1.2644 C/C=C(\C)/C(=O)N(CC)c1ccccc1C 22a_100000211084_100020587367 [0,1,0,0,0,0|0,0,0]=1 326 B16R1.2644 C/C=C(\C)/C(=O)N(CC)c1ccccc1F 11a_100000220365_100020587367 [0,1,0,0,0,0|1,0,0]=2 327 B16R1.2644 C/C=C(\C)/C(=O)N(CC)c1ccccc1F 1626a_100000220365_100020587367 [0,1,0,0,0,0|1,0,0]=2 328 B16R1.2644 C/C=C(\C)/C(=O)N(CC)c1ccccc1O 22a_103624766699_100020587367 [0,1,0,0,0,0|1,0,0]=2 329 B16R1.2644 C=C(CO)C(=O)N(CC)c1ccccc1C 22a_100000211084_200000705526 [0,1,0,0,0,0|1,0,1]=3 330 B16R1.2644 C=C(CO)C(=O)N(CC)c1ccccc1O 22a_103624766699_200000705526 [0,1,0,0,0,0|2,0,1]=4 331 B16R1.2644 C=CC(C)C(=O)N(CC)c1ccccc1Br 11a_114873767003_100011216780 [0,1,0,0,0,0|1,0,2]=4 332 B16R1.2644 C=CC(C)C(=O)N(CC)c1ccccc1Br 1626a_114873767003_100011216780 [0,1,0,0,0,0|1,0,2]=4 333 B16R1.2644 C=CC(C)C(=O)N(CC)c1ccccc1C 11a_100000211084_100011216780 [0,1,0,0,0,0|0,0,2]=3 334 B16R1.2644 C=CC(C)C(=O)N(CC)c1ccccc1C 1626a_100000211084_100011216780 [0,1,0,0,0,0|0,0,2]=3 335 B16R1.2644 C=CC(C)C(=O)N(CC)c1ccccc1C 22a_100000211084_100011216780 [0,1,0,0,0,0|0,0,2]=3 336 B16R1.2644 C=CC(C)C(=O)N(CC)c1ccccc1F 11a_100000220365_100011216780 [0,1,0,0,0,0|1,0,2]=4 337 B16R1.2644 C=CC(C)C(=O)N(CC)c1ccccc1F 1626a_100000220365_100011216780 [0,1,0,0,0,0|1,0,2]=4 338 B16R1.2644 C=CC(C)C(=O)N(CC)c1ccccc1O 22a_103624766699_100011216780 [0,1,0,0,0,0|1,0,2]=4 339 B16R1.2644 CCC(=O)C(C)N(CC)c1ccccc1C 2230a_100000211084_100000742827 [0,1,0,0,0,0|1,0,2]=4 340 B16R1.2644 CCC(=O)C(C)N(CC)c1ccccc1C 269982a_100000211084_100000742827 [0,1,0,0,0,0|1,0,2]=4 341 B16R1.2644 CCC(C)C(=O)N(CC)c1ccccc1Br 11a_114873767003_100011192722 [0,1,0,0,0,0|1,0,2]=4 342 B16R1.2644 CCC(C)C(=O)N(CC)c1ccccc1Br 1626a_114873767003_100011192722 [0,1,0,0,0,0|1,0,2]=4 343 B16R1.2644 CCC(C)C(=O)N(CC)c1ccccc1C 11a_100000211084_100011192722 [0,1,0,0,0,0|0,0,2]=3 344 B16R1.2644 CCC(C)C(=O)N(CC)c1ccccc1C 1626a_100000211084_100011192722 [0,1,0,0,0,0|0,0,2]=3 345 B16R1.2644 CCC(C)C(=O)N(CC)c1ccccc1C 22a_100000211084_100011192722 [0,1,0,0,0,0|0,0,2]=3 346 B16R1.2644 CCC(C)C(=O)N(CC)c1ccccc1F 11a_100000220365_100011192722 [0,1,0,0,0,0|1,0,2]=4 347 B16R1.2644 CCC(C)C(=O)N(CC)c1ccccc1F 1626a_100000220365_100011192722 [0,1,0,0,0,0|1,0,2]=4 348 B16R1.2644 CCC(C)C(=O)N(CC)c1ccccc1O 22a_103624766699_100011192722 [0,1,0,0,0,0|1,0,2]=4 349 B16R1.2644 CCC(O)C(=O)N(CC)c1ccccc1C 22a_100000211084_100011196387 [0,1,0,0,0,0|0,0,2]=3 350 B16R1.2644 CCC(O)C(=O)N(CC)c1ccccc1O 22a_103624766699_100011196387 [0,1,0,0,0,0|1,0,2]=4 351 B16R1.2644 CCN(C(=O)C(=O)NC)c1ccccc1Br 1626a_114873767003_100011218921 [0,1,0,0,0,0|2,0,0]=3 352 B16R1.2644 CCN(C(=O)C(=O)NC)c1ccccc1C 1626a_100000211084_100011218921 [0,1,0,0,0,0|1,0,0]=2 353 B16R1.2644 CCN(C(=O)C(=O)NC)c1ccccc1C 22a_100000211084_100011218921 [0,1,0,0,0,0|1,0,0]=2 354 B16R1.2644 CCN(C(=O)C(=O)NC)c1ccccc1F 1626a_100000220365_100011218921 [0,1,0,0,0,0|2,0,0]=3 355 B16R1.2644 CCN(C(=O)C(=O)NC)c1ccccc1O 22a_103624766699_100011218921 [0,1,0,0,0,0|2,0,0]=3 356 B16R1.2644 CCN(C(=O)C(=O)OC)c1ccccc1Br 11a_114873767003_100000024059 [0,1,0,0,0,0|2,0,0]=3 357 B16R1.2644 CCN(C(=O)C(=O)OC)c1ccccc1Br 1626a_114873767003_100000024059 [0,1,0,0,0,0|2,0,0]=3 358 B16R1.2644 CCN(C(=O)C(=O)OC)c1ccccc1C 11a_100000211084_100000024059 [0,1,0,0,0,0|1,0,0]=2 359 B16R1.2644 CCN(C(=O)C(=O)OC)c1ccccc1C 1626a_100000211084_100000024059 [0,1,0,0,0,0|1,0,0]=2 360 B16R1.2644 CCN(C(=O)C(=O)OC)c1ccccc1F 11a_100000220365_100000024059 [0,1,0,0,0,0|2,0,0]=3 361 B16R1.2644 CCN(C(=O)C(=O)OC)c1ccccc1F 1626a_100000220365_100000024059 [0,1,0,0,0,0|2,0,0]=3 362 B16R1.2644 CCN(C(=O)C(C)C#N)c1ccccc1C 11a_100000211084_100000753662 [0,1,0,0,0,0|1,0,2]=4 363 B16R1.2644 CCN(C(=O)C(C)C#N)c1ccccc1C 1626a_100000211084_100000753662 [0,1,0,0,0,0|1,0,2]=4 364 B16R1.2644 CCN(C(=O)C(C)C#N)c1ccccc1C 22a_100000211084_100000753662 [0,1,0,0,0,0|1,0,2]=4 365 B16R1.2644 CCN(C(=O)C(C)OC)c1ccccc1Br 11a_114873767003_100000743197 [0,1,0,0,0,0|2,0,1]=4 366 B16R1.2644 CCN(C(=O)C(C)OC)c1ccccc1Br 1626a_114873767003_100000743197 [0,1,0,0,0,0|2,0,1]=4 367 B16R1.2644 CCN(C(=O)C(C)OC)c1ccccc1C 11a_100000211084_100000743197 [0,1,0,0,0,0|1,0,1]=3 368 B16R1.2644 CCN(C(=O)C(C)OC)c1ccccc1C 1626a_100000211084_100000743197 [0,1,0,0,0,0|1,0,1]=3 369 B16R1.2644 CCN(C(=O)C(C)OC)c1ccccc1C 22a_100000211084_100000743197 [0,1,0,0,0,0|1,0,1]=3 370 B16R1.2644 CCN(C(=O)C(C)OC)c1ccccc1F 11a_100000220365_100000743197 [0,1,0,0,0,0|2,0,1]=4 371 B16R1.2644 CCN(C(=O)C(C)OC)c1ccccc1F 1626a_100000220365_100000743197 [0,1,0,0,0,0|2,0,1]=4 372 B16R1.2644 CCN(C(=O)C(C)OC)c1ccccc1O 22a_103624766699_100000743197 [0,1,0,0,0,0|2,0,1]=4 373 B16R1.2644 CCN(C(=O)C(C)SC)c1ccccc1Br 11a_114873767003_100000149566 [0,1,0,0,0,0|2,0,1]=4 374 B16R1.2644 CCN(C(=O)C(C)SC)c1ccccc1Br 1626a_114873767003_100000149566 [0,1,0,0,0,0|2,0,1]=4 375 B16R1.2644 CCN(C(=O)C(C)SC)c1ccccc1C 11a_100000211084_100000149566 [0,1,0,0,0,0|1,0,1]=3 376 B16R1.2644 CCN(C(=O)C(C)SC)c1ccccc1C 1626a_100000211084_100000149566 [0,1,0,0,0,0|1,0,1]=3 377 B16R1.2644 CCN(C(=O)C(C)SC)c1ccccc1C 22a_100000211084_100000149566 [0,1,0,0,0,0|1,0,1]=3 378 B16R1.2644 CCN(C(=O)C(C)SC)c1ccccc1F 11a_100000220365_100000149566 [0,1,0,0,0,0|2,0,1]=4 379 B16R1.2644 CCN(C(=O)C(C)SC)c1ccccc1F 1626a_100000220365_100000149566 [0,1,0,0,0,0|2,0,1]=4 380 B16R1.2644 CCN(C(=O)C(C)SC)c1ccccc1O 22a_103624766699_100000149566 [0,1,0,0,0,0|2,0,1]=4 381 B16R1.2644 CCN(C(=O)C(O)CO)c1ccccc1C 22a_100000211084_100011215603 [0,1,0,0,0,0|1,0,2]=4 382 B16R1.2644 CCN(c1ccccc1C)C(C)C(=O)NC 2230a_100000211084_100000731044 [0,1,0,0,0,0|2,0,1]=4 383 B16R1.2644 CCN(c1ccccc1C)C(C)C(=O)NC 269982a_100000211084_100000209862 [0,1,0,0,0,0|2,0,1]=4 384 B16R1.2644 CCN(c1ccccc1C)C(C)C(=O)NC 34a_100000211084_100000731044 [0,1,0,0,0,0|2,0,1]=4 385 B16R1.2644 CCN(c1ccccc1C)C(C)C(=O)OC 2230a_100000211084_100000211248 [0,1,0,0,0,0|2,0,1]=4 386 B16R1.2644 CCN(c1ccccc1C)C(C)C(=O)OC 269982a_100000211084_100000211248 [0,1,0,0,0,0|2,0,1]=4 387 B16R1.2644 CCN(c1ccccc1C)C(C)C(=O)OC 34a_100000211084_100000211248 [0,1,0,0,0,0|2,0,1]=4 388 B16R1.2644 CCN(c1ccccc1C)C(F)C(=O)NC 2230a_100000211084_100009813575 [0,1,0,0,0,0|2,0,1]=4 389 B16R1.2644 CCN(c1ccccc1C)C(F)C(=O)NC 269982a_100000211084_100009813575 [0,1,0,0,0,0|2,0,1]=4 390 B16R1.2644 CCN(c1ccccc1C)C(F)C(=O)NC 34a_100000211084_100009813575 [0,1,0,0,0,0|2,0,1]=4 391 B16R1.3316 C=C(C)CC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000748629 [0,1,0,0,0,0|2,0,1]=4 392 B16R1.3316 C=C(C)CC(=O)C(OC)c1ccccc1C 1458a_100012277922_100000748629 [0,1,0,0,0,0|2,0,1]=4 393 B16R1.3316 CCN(C(=O)C=C(C)C)c1ccccc1Br 11a_114873767003_100000211388 [0,1,0,0,0,0|1,0,0]=2 394 B16R1.3316 CCN(C(=O)C=C(C)C)c1ccccc1Br 1626a_114873767003_100000211388 [0,1,0,0,0,0|1,0,0]=2 395 B16R1.3316 CCN(C(=O)C=C(C)C)c1ccccc1C 11a_100000211084_100000211388 [0,1,0,0,0,0|0,0,0]=1 396 B16R1.3316 CCN(C(=O)C=C(C)C)c1ccccc1C 1626a_100000211084_100000211388 [0,1,0,0,0,0|0,0,0]=1 397 B16R1.3316 CCN(C(=O)C=C(C)C)c1ccccc1C 22a_100000211084_100000211388 [0,1,0,0,0,0|0,0,0]=1 398 B16R1.3316 CCN(C(=O)C=C(C)C)c1ccccc1F 11a_100000220365_100000211388 [0,1,0,0,0,0|1,0,0]=2 399 B16R1.3316 CCN(C(=O)C=C(C)C)c1ccccc1F 1626a_100000220365_100000211388 [0,1,0,0,0,0|1,0,0]=2 400 B16R1.3316 CCN(C(=O)C=C(C)C)c1ccccc1O 22a_103624766699_100000211388 [0,1,0,0,0,0|1,0,0]=2 401 B16R1.3316 CCN(C(=O)C=C(C)Cl)c1ccccc1Br 11a_114873767003_200042562850 [0,1,0,0,0,0|1,0,0]=2 402 B16R1.3316 CCN(C(=O)C=C(C)Cl)c1ccccc1Br 1626a_114873767003_200042562850 [0,1,0,0,0,0|1,0,0]=2 403 B16R1.3316 CCN(C(=O)C=C(C)Cl)c1ccccc1C 11a_100000211084_200042562850 [0,1,0,0,0,0|0,0,0]=1 404 B16R1.3316 CCN(C(=O)C=C(C)Cl)c1ccccc1C 1626a_100000211084_200042562850 [0,1,0,0,0,0|0,0,0]=1 405 B16R1.3316 CCN(C(=O)C=C(C)Cl)c1ccccc1C 22a_100000211084_200042562850 [0,1,0,0,0,0|0,0,0]=1 406 B16R1.3316 CCN(C(=O)C=C(C)Cl)c1ccccc1F 11a_100000220365_200042562850 [0,1,0,0,0,0|1,0,0]=2 407 B16R1.3316 CCN(C(=O)C=C(C)Cl)c1ccccc1F 1626a_100000220365_200042562850 [0,1,0,0,0,0|1,0,0]=2 408 B16R1.3316 CCN(C(=O)C=C(C)Cl)c1ccccc1O 22a_103624766699_200042562850 [0,1,0,0,0,0|1,0,0]=2 409 B16R1.3316 CCN(C(=O)C=C(C)I)c1ccccc1Br 11a_114873767003_100025716642 [0,1,0,0,0,0|1,0,0]=2 410 B16R1.3316 CCN(C(=O)C=C(C)I)c1ccccc1Br 1626a_114873767003_100025716642 [0,1,0,0,0,0|1,0,0]=2 411 B16R1.3316 CCN(C(=O)C=C(C)I)c1ccccc1C 11a_100000211084_100025716642 [0,1,0,0,0,0|0,0,0]=1 412 B16R1.3316 CCN(C(=O)C=C(C)I)c1ccccc1C 1626a_100000211084_100025716642 [0,1,0,0,0,0|0,0,0]=1 413 B16R1.3316 CCN(C(=O)C=C(C)I)c1ccccc1F 11a_100000220365_100025716642 [0,1,0,0,0,0|1,0,0]=2 414 B16R1.3316 CCN(C(=O)C=C(C)I)c1ccccc1F 1626a_100000220365_100025716642 [0,1,0,0,0,0|1,0,0]=2 415 B16R1.3316 CCN(C(=O)C=C(Cl)Cl)c1ccccc1Br 1626a_114873767003_100000137448 [0,1,0,0,0,0|2,0,0]=3 416 B16R1.3316 CCN(C(=O)C=C(Cl)Cl)c1ccccc1C 1626a_100000211084_100000137448 [0,1,0,0,0,0|1,0,0]=2 417 B16R1.3316 CCN(C(=O)C=C(Cl)Cl)c1ccccc1F 1626a_100000220365_100000137448 [0,1,0,0,0,0|2,0,0]=3 418 B16R1.3316 CCN(C(=O)CC(=O)C)c1ccccc1C 1458a_100000070787_100000239579 [0,1,0,0,0,0|0,0,1]=2 419 B16R1.3316 CCN(C(=O)CC(=O)N)c1ccccc1C 22a_100000211084_100134613110 [0,1,0,0,0,0|1,0,1]=3 420 B16R1.3316 CCN(C(=O)CC(=O)N)c1ccccc1O 22a_103624766699_100134613110 [0,1,0,0,0,0|2,0,1]=4 421 B16R1.3316 CCN(C(=O)CC(C)C)c1ccccc1Br 11a_114873767003_100000210554 [0,1,0,0,0,0|1,0,2]=4 422 B16R1.3316 CCN(C(=O)CC(C)C)c1ccccc1Br 1626a_114873767003_100000210554 [0,1,0,0,0,0|1,0,2]=4 423 B16R1.3316 CCN(C(=O)CC(C)C)c1ccccc1C 11a_100000211084_100000210554 [0,1,0,0,0,0|0,0,2]=3 424 B16R1.3316 CCN(C(=O)CC(C)C)c1ccccc1C 1626a_100000211084_100000210554 [0,1,0,0,0,0|0,0,2]=3 425 B16R1.3316 CCN(C(=O)CC(C)C)c1ccccc1C 22a_100000211084_100000210554 [0,1,0,0,0,0|0,0,2]=3 426 B16R1.3316 CCN(C(=O)CC(C)C)c1ccccc1F 11a_100000220365_100000210554 [0,1,0,0,0,0|1,0,2]=4 427 B16R1.3316 CCN(C(=O)CC(C)C)c1ccccc1F 1626a_100000220365_100000210554 [0,1,0,0,0,0|1,0,2]=4 428 B16R1.3316 CCN(C(=O)CC(C)C)c1ccccc1O 22a_103624766699_100000210554 [0,1,0,0,0,0|1,0,2]=4 429 B16R1.3316 CCN(C(=O)CN(C)C)c1ccccc1Br 11a_114873767003_100000750896 [0,1,0,0,0,0|2,0,1]=4 430 B16R1.3316 CCN(C(=O)CN(C)C)c1ccccc1C 11a_100000211084_100000750896 [0,1,0,0,0,0|1,0,1]=3 431 B16R1.3316 CCN(C(=O)CN(C)C)c1ccccc1C 2230a_100102631434_100000239579 [0,1,0,0,0,0|1,0,1]=3 432 B16R1.3316 CCN(C(=O)CN(C)C)c1ccccc1C 22a_100000211084_100000750896 [0,1,0,0,0,0|1,0,1]=3 433 B16R1.3316 CCN(C(=O)CN(C)C)c1ccccc1C 269982a_100102631434_100000239579 [0,1,0,0,0,0|1,0,1]=3 434 B16R1.3316 CCN(C(=O)CN(C)C)c1ccccc1F 11a_100000220365_100000750896 [0,1,0,0,0,0|2,0,1]=4 435 B16R1.3316 CCN(C(=O)CN(C)C)c1ccccc1O 22a_103624766699_100000750896 [0,1,0,0,0,0|2,0,1]=4 436 B16R1.3316 CCN(C(=O)C[C@@H](C)O)c1ccccc1C 22a_100000211084_100011933948 [0,1,0,0,0,0|0,0,2]=3 437 B16R1.3316 CCN(C(=O)C[C@@H](C)O)c1ccccc1O 22a_103624766699_100011933948 [0,1,0,0,0,0|1,0,2]=4 438 B16R1.3316 CCN(C(=O)C[S+](C)C)c1ccccc1Br 11a_114873767003_200159257847 [0,1,0,0,0,0|2,0,1]=4 439 B16R1.3316 CCN(C(=O)C[S+](C)C)c1ccccc1Br 1626a_114873767003_200159257847 [0,1,0,0,0,0|2,0,1]=4 440 B16R1.3316 CCN(C(=O)C[S+](C)C)c1ccccc1C 11a_100000211084_200159257847 [0,1,0,0,0,0|1,0,1]=3 441 B16R1.3316 CCN(C(=O)C[S+](C)C)c1ccccc1C 1626a_100000211084_200159257847 [0,1,0,0,0,0|1,0,1]=3 442 B16R1.3316 CCN(C(=O)C[S+](C)C)c1ccccc1C 22a_100000211084_200159257847 [0,1,0,0,0,0|1,0,1]=3 443 B16R1.3316 CCN(C(=O)C[S+](C)C)c1ccccc1F 11a_100000220365_200159257847 [0,1,0,0,0,0|2,0,1]=4 444 B16R1.3316 CCN(C(=O)C[S+](C)C)c1ccccc1F 1626a_100000220365_200159257847 [0,1,0,0,0,0|2,0,1]=4 445 B16R1.3316 CCN(C(=O)C[S+](C)C)c1ccccc1O 22a_103624766699_200159257847 [0,1,0,0,0,0|2,0,1]=4 446 B16R1.3316 CCN(C(=O)NC(C)C)c1ccccc1Br 512a_114873767003_100138425928 [0,1,0,0,0,0|2,0,1]=4 447 B16R1.3316 CCN(C(=O)NC(C)C)c1ccccc1C 512a_100000211084_100138425928 [0,1,0,0,0,0|1,0,1]=3 448 B16R1.3316 CCN(C(=O)NC(C)C)c1ccccc1C 512a_100138425928_100000211084 [0,1,0,0,0,0|1,0,1]=3 449 B16R1.3316 CCN(C(=O)NC(C)C)c1ccccc1F 512a_100000220365_100138425928 [0,1,0,0,0,0|2,0,1]=4 450 B16R1.3316 CCN(c1ccccc1C)C(C)OC(=O)C 269982a_100000211084_100009818208 [0,1,0,0,0,0|2,0,1]=4 451 B16R1.14052 C#CCC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100011220946 [0,1,0,0,0,0|0,0,3]=4 452 B16R1.14052 C=CCC(=O)C(c1ccccc1C)C(C)C 1458a_200011667393_100000210623 [0,1,0,0,0,0|1,0,2]=4 453 B16R1.14052 C=CCC(=O)N(c1ccccc1Br)C(C)C 1626a_100000219599_100000210193 [0,1,0,0,0,0|1,0,2]=4 454 B16R1.14052 C=CCC(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000210193 [0,1,0,0,0,0|0,0,2]=3 455 B16R1.14052 C=CCC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000210193 [0,1,0,0,0,0|0,0,2]=3 456 B16R1.14052 C=CCC(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100000210193 [0,1,0,0,0,0|1,0,2]=4 457 B16R1.14052 C=CCC(=O)N(c1ccccc1F)C(C)C 11a_100000220358_100000210193 [0,1,0,0,0,0|1,0,2]=4 458 B16R1.14052 C=CCC(=O)N(c1ccccc1F)C(C)C 1626a_100000220358_100000210193 [0,1,0,0,0,0|1,0,2]=4 459 B16R1.14052 CC(C)N(C(=O)C=CBr)c1ccccc1Br 1626a_100000219599_100016273825 [0,1,0,0,0,0|2,0,0]=3 460 B16R1.14052 CC(C)N(C(=O)C=CBr)c1ccccc1Cl 1626a_100000219376_100016273825 [0,1,0,0,0,0|2,0,0]=3 461 B16R1.14052 CC(C)N(C(=O)C=CBr)c1ccccc1F 1626a_100000220358_100016273825 [0,1,0,0,0,0|2,0,0]=3 462 B16R1.14052 CC(C)N(C(=O)C=CCl)c1ccccc1Br 1626a_100000219599_200016279998 [0,1,0,0,0,0|2,0,0]=3 463 B16R1.14052 CC(C)N(C(=O)C=CCl)c1ccccc1Cl 1626a_100000219376_200016279998 [0,1,0,0,0,0|2,0,0]=3 464 B16R1.14052 CC(C)N(C(=O)C=CCl)c1ccccc1F 11a_100000220358_200016279998 [0,1,0,0,0,0|2,0,0]=3 465 B16R1.14052 CC(C)N(C(=O)C=CCl)c1ccccc1F 1626a_100000220358_200016279998 [0,1,0,0,0,0|2,0,0]=3 466 B16R1.14052 CC(C)N(C(=O)C=CI)c1ccccc1Br 1626a_100000219599_100016256311 [0,1,0,0,0,0|2,0,0]=3 467 B16R1.14052 CC(C)N(C(=O)C=CI)c1ccccc1Cl 1626a_100000219376_100016256311 [0,1,0,0,0,0|2,0,0]=3 468 B16R1.14052 CC(C)N(C(=O)C=CI)c1ccccc1F 1626a_100000220358_100016256311 [0,1,0,0,0,0|2,0,0]=3 469 B16R1.14052 CC=CC(=O)N(c1ccccc1Br)C(C)C 1626a_100000219599_100000210699 [0,1,0,0,0,0|1,0,0]=2 470 B16R1.14052 CC=CC(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000210699 [0,1,0,0,0,0|0,0,0]=1 471 B16R1.14052 CC=CC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000210699 [0,1,0,0,0,0|0,0,0]=1 472 B16R1.14052 CC=CC(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100000210699 [0,1,0,0,0,0|1,0,0]=2 473 B16R1.14052 CC=CC(=O)N(c1ccccc1F)C(C)C 11a_100000220358_100000210699 [0,1,0,0,0,0|1,0,0]=2 474 B16R1.14052 CC=CC(=O)N(c1ccccc1F)C(C)C 1626a_100000220358_100000210699 [0,1,0,0,0,0|1,0,0]=2 475 B16R1.14052 CCCC(=O)C(c1ccccc1C)C(C)C 1458a_200011667393_100000210303 [0,1,0,0,0,0|1,0,2]=4 476 B16R1.14052 CCCC(=O)N(c1ccccc1Br)C(C)C 1626a_100000219599_100000211992 [0,1,0,0,0,0|1,0,2]=4 477 B16R1.14052 CCCC(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000211992 [0,1,0,0,0,0|0,0,2]=3 478 B16R1.14052 CCCC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000211992 [0,1,0,0,0,0|0,0,2]=3 479 B16R1.14052 CCCC(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100000211992 [0,1,0,0,0,0|1,0,2]=4 480 B16R1.14052 CCCC(=O)N(c1ccccc1F)C(C)C 11a_100000220358_100000211992 [0,1,0,0,0,0|1,0,2]=4 481 B16R1.14052 CCCC(=O)N(c1ccccc1F)C(C)C 1626a_100000220358_100000211992 [0,1,0,0,0,0|1,0,2]=4 482 B16R1.14052 CCNC(=O)C(c1ccccc1C)C(C)C 11a_100015525214_200011667393 [0,1,0,0,0,0|2,0,1]=4 483 B16R1.14052 CCNC(=O)C(c1ccccc1C)C(C)C 240690a_100015525214_200011667393 [0,1,0,0,0,0|2,0,1]=4 484 B16R1.14052 CCNC(=O)C(c1ccccc1C)C(C)C 527a_100015525214_200011667393 [0,1,0,0,0,0|2,0,1]=4 485 B16R1.14052 CCNC(=O)N(c1ccccc1Br)C(C)C 512a_100000219599_100015525214 [0,1,0,0,0,0|2,0,1]=4 486 B16R1.14052 CCNC(=O)N(c1ccccc1C)C(C)C 512a_100000219700_100015525214 [0,1,0,0,0,0|1,0,1]=3 487 B16R1.14052 CCNC(=O)N(c1ccccc1Cl)C(C)C 512a_100000219376_100015525214 [0,1,0,0,0,0|2,0,1]=4 488 B16R1.14052 CCNC(=O)N(c1ccccc1F)C(C)C 512a_100000220358_100015525214 [0,1,0,0,0,0|2,0,1]=4 489 B16R1.14052 CNNC(=O)C(c1ccccc1C)C(C)C 22a_100016993582_200011667393 [0,1,0,0,0,0|3,0,0]=4 490 B16R1.14052 CNNC(=O)N(c1ccccc1Br)C(C)C 512a_100000219599_100016993582 [0,1,0,0,0,0|3,0,0]=4 491 B16R1.14052 CNNC(=O)N(c1ccccc1C)C(C)C 512a_100000219700_100016993582 [0,1,0,0,0,0|2,0,0]=3 492 B16R1.14052 CNNC(=O)N(c1ccccc1Cl)C(C)C 512a_100000219376_100016993582 [0,1,0,0,0,0|3,0,0]=4 493 B16R1.14052 CNNC(=O)N(c1ccccc1F)C(C)C 512a_100000220358_100016993582 [0,1,0,0,0,0|3,0,0]=4 494 B16R1.14052 COCC(=O)N(c1ccccc1Br)C(C)C 1626a_100000219599_100000210968 [0,1,0,0,0,0|2,0,1]=4 495 B16R1.14052 COCC(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000210968 [0,1,0,0,0,0|1,0,1]=3 496 B16R1.14052 COCC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000210968 [0,1,0,0,0,0|1,0,1]=3 497 B16R1.14052 COCC(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100000210968 [0,1,0,0,0,0|2,0,1]=4 498 B16R1.14052 COCC(=O)N(c1ccccc1F)C(C)C 11a_100000220358_100000210968 [0,1,0,0,0,0|2,0,1]=4 499 B16R1.14052 COCC(=O)N(c1ccccc1F)C(C)C 1626a_100000220358_100000210968 [0,1,0,0,0,0|2,0,1]=4 500 B16R1.14052 CSCC(=O)N(c1ccccc1Br)C(C)C 1626a_100000219599_100000184570 [0,1,0,0,0,0|2,0,1]=4 501 B16R1.14052 CSCC(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000184570 [0,1,0,0,0,0|1,0,1]=3 502 B16R1.14052 CSCC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000184570 [0,1,0,0,0,0|1,0,1]=3 503 B16R1.14052 CSCC(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100000184570 [0,1,0,0,0,0|2,0,1]=4 504 B16R1.14052 CSCC(=O)N(c1ccccc1F)C(C)C 11a_100000220358_100000184570 [0,1,0,0,0,0|2,0,1]=4 505 B16R1.14052 CSCC(=O)N(c1ccccc1F)C(C)C 1626a_100000220358_100000184570 [0,1,0,0,0,0|2,0,1]=4 506 B16R1.14052 Cc1ccccc1N(C(=O)C=CBr)C(C)C 1626a_100000219700_100016273825 [0,1,0,0,0,0|1,0,0]=2 507 B16R1.14052 Cc1ccccc1N(C(=O)C=CCl)C(C)C 11a_100000219700_200016279998 [0,1,0,0,0,0|1,0,0]=2 508 B16R1.14052 Cc1ccccc1N(C(=O)C=CCl)C(C)C 1626a_100000219700_200016279998 [0,1,0,0,0,0|1,0,0]=2 509 B16R1.14052 Cc1ccccc1N(C(=O)C=CI)C(C)C 1626a_100000219700_100016256311 [0,1,0,0,0,0|1,0,0]=2 510 B16R1.14052 Cc1ccccc1N(C(=O)CC#N)C(C)C 1626a_100000219700_100051588842 [0,1,0,0,0,0|1,0,2]=4 511 B16R1.15094 C#CCC(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100011220946 [0,1,0,0,0,0|0,0,3]=4 512 B16R1.15094 C=CCC(=O)N(CC)c1cc(ccc1C)C 11a_100000743043_100000210193 [0,1,0,0,0,0|0,0,2]=3 513 B16R1.15094 C=CCC(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100000210193 [0,1,0,0,0,0|0,0,2]=3 514 B16R1.15094 C=CCC(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100000210193 [0,1,0,0,0,0|0,0,2]=3 515 B16R1.15094 CC#CC(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100000763181 [0,1,0,0,0,0|0,0,2]=3 516 B16R1.15094 CC=CC(=O)N(CC)c1cc(ccc1C)C 11a_100000743043_100000210699 [0,1,0,0,0,0|0,0,0]=1 517 B16R1.15094 CC=CC(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100000210699 [0,1,0,0,0,0|0,0,0]=1 518 B16R1.15094 CC=CC(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100000210699 [0,1,0,0,0,0|0,0,0]=1 519 B16R1.15094 CCCC(=O)N(CC)c1cc(ccc1C)C 11a_100000743043_100000211992 [0,1,0,0,0,0|0,0,2]=3 520 B16R1.15094 CCCC(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100000211992 [0,1,0,0,0,0|0,0,2]=3 521 B16R1.15094 CCCC(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100000211992 [0,1,0,0,0,0|0,0,2]=3 522 B16R1.15094 CCN(C(=O)C=CBr)c1cc(ccc1C)C 1626a_100000743043_100016273825 [0,1,0,0,0,0|1,0,0]=2 523 B16R1.15094 CCN(C(=O)C=CCl)c1cc(ccc1C)C 11a_100000743043_200016279998 [0,1,0,0,0,0|1,0,0]=2 524 B16R1.15094 CCN(C(=O)C=CCl)c1cc(ccc1C)C 1626a_100000743043_200016279998 [0,1,0,0,0,0|1,0,0]=2 525 B16R1.15094 CCN(C(=O)C=CI)c1cc(ccc1C)C 1626a_100000743043_100016256311 [0,1,0,0,0,0|1,0,0]=2 526 B16R1.15094 CCN(C(=O)CC#N)c1cc(ccc1C)C 1626a_100000743043_100051588842 [0,1,0,0,0,0|1,0,2]=4 527 B16R1.15094 CCN(C(=O)CC#N)c1cc(ccc1C)C 22a_100000743043_100051588842 [0,1,0,0,0,0|1,0,2]=4 528 B16R1.15094 CCN(C(=O)CCO)c1cc(ccc1C)C 22a_100000743043_100011216618 [0,1,0,0,0,0|1,0,2]=4 529 B16R1.15094 CCN(C(=O)COC)c1cc(ccc1C)C 11a_100000743043_100000210968 [0,1,0,0,0,0|1,0,1]=3 530 B16R1.15094 CCN(C(=O)COC)c1cc(ccc1C)C 1626a_100000743043_100000210968 [0,1,0,0,0,0|1,0,1]=3 531 B16R1.15094 CCN(C(=O)COC)c1cc(ccc1C)C 22a_100000743043_100000210968 [0,1,0,0,0,0|1,0,1]=3 532 B16R1.15094 CCN(C(=O)CSC)c1cc(ccc1C)C 11a_100000743043_100000184570 [0,1,0,0,0,0|1,0,1]=3 533 B16R1.15094 CCN(C(=O)CSC)c1cc(ccc1C)C 1626a_100000743043_100000184570 [0,1,0,0,0,0|1,0,1]=3 534 B16R1.15094 CCN(C(=O)CSC)c1cc(ccc1C)C 22a_100000743043_100000184570 [0,1,0,0,0,0|1,0,1]=3 535 B16R1.15094 CCN(C(=O)NNC)c1cc(ccc1C)C 512a_100000743043_100016993582 [0,1,0,0,0,0|2,0,0]=3 536 B16R1.15094 CCN(C(=O)NNC)c1cc(ccc1C)C 512a_100016993582_100000743043 [0,1,0,0,0,0|2,0,0]=3 537 B16R1.15094 CCN(C(=O)NNC)c1cc(ccc1C)O 512a_100000211784_100016993582 [0,1,0,0,0,0|2,0,0]=3 538 B16R1.15094 CCNC(=O)N(CC)c1cc(ccc1C)C 512a_100000743043_100015525214 [0,1,0,0,0,0|1,0,1]=3 539 B16R1.15094 CCNC(=O)N(CC)c1cc(ccc1C)C 512a_100015525214_100000743043 [0,1,0,0,0,0|1,0,1]=3 540 B16R1.15094 CCNC(=O)N(CC)c1cc(ccc1C)O 512a_100000211784_100015525214 [0,1,0,0,0,0|1,0,1]=3 541 B16R1.15111 C#CCC(=O)N(CC)c1ccccc1OC 1626a_100020603010_100011220946 [0,1,0,0,0,0|0,0,3]=4 542 B16R1.15111 C=CCC(=O)N(CC)c1ccccc1C#N 1626a_200000218880_100000210193 [0,1,0,0,0,0|0,0,3]=4 543 B16R1.15111 C=CCC(=O)N(CC)c1ccccc1OC 11a_100020603010_100000210193 [0,1,0,0,0,0|0,0,2]=3 544 B16R1.15111 C=CCC(=O)N(CC)c1ccccc1OC 1626a_100020603010_100000210193 [0,1,0,0,0,0|0,0,2]=3 545 B16R1.15111 C=CCC(=O)N(CC)c1ccccc1OC 22a_100020603010_100000210193 [0,1,0,0,0,0|0,0,2]=3 546 B16R1.15111 CC#CC(=O)N(CC)c1ccccc1OC 22a_100020603010_100000763181 [0,1,0,0,0,0|0,0,2]=3 547 B16R1.15111 CC=CC(=O)N(CC)c1ccccc1C#N 1626a_200000218880_100000210699 [0,1,0,0,0,0|0,0,1]=2 548 B16R1.15111 CC=CC(=O)N(CC)c1ccccc1OC 11a_100020603010_100000210699 [0,1,0,0,0,0|0,0,0]=1 549 B16R1.15111 CC=CC(=O)N(CC)c1ccccc1OC 1626a_100020603010_100000210699 [0,1,0,0,0,0|0,0,0]=1 550 B16R1.15111 CC=CC(=O)N(CC)c1ccccc1OC 22a_100020603010_100000210699 [0,1,0,0,0,0|0,0,0]=1 551 B16R1.15111 CCCC(=O)N(CC)c1ccccc1C#N 1626a_200000218880_100000211992 [0,1,0,0,0,0|0,0,3]=4 552 B16R1.15111 CCCC(=O)N(CC)c1ccccc1OC 11a_100020603010_100000211992 [0,1,0,0,0,0|0,0,2]=3 553 B16R1.15111 CCCC(=O)N(CC)c1ccccc1OC 1626a_100020603010_100000211992 [0,1,0,0,0,0|0,0,2]=3 554 B16R1.15111 CCCC(=O)N(CC)c1ccccc1OC 22a_100020603010_100000211992 [0,1,0,0,0,0|0,0,2]=3 555 B16R1.15111 CCN(C(=O)C=CBr)c1ccccc1C#N 1626a_200000218880_100016273825 [0,1,0,0,0,0|1,0,1]=3 556 B16R1.15111 CCN(C(=O)C=CBr)c1ccccc1OC 1626a_100020603010_100016273825 [0,1,0,0,0,0|1,0,0]=2 557 B16R1.15111 CCN(C(=O)C=CCl)c1ccccc1C#N 1626a_200000218880_200016279998 [0,1,0,0,0,0|1,0,1]=3 558 B16R1.15111 CCN(C(=O)C=CCl)c1ccccc1OC 11a_100020603010_200016279998 [0,1,0,0,0,0|1,0,0]=2 559 B16R1.15111 CCN(C(=O)C=CCl)c1ccccc1OC 1626a_100020603010_200016279998 [0,1,0,0,0,0|1,0,0]=2 560 B16R1.15111 CCN(C(=O)C=CI)c1ccccc1C#N 1626a_200000218880_100016256311 [0,1,0,0,0,0|1,0,1]=3 561 B16R1.15111 CCN(C(=O)C=CI)c1ccccc1OC 1626a_100020603010_100016256311 [0,1,0,0,0,0|1,0,0]=2 562 B16R1.15111 CCN(C(=O)CC#N)c1ccccc1OC 1626a_100020603010_100051588842 [0,1,0,0,0,0|1,0,2]=4 563 B16R1.15111 CCN(C(=O)CC#N)c1ccccc1OC 22a_100020603010_100051588842 [0,1,0,0,0,0|1,0,2]=4 564 B16R1.15111 CCN(C(=O)CCO)c1ccccc1OC 22a_100020603010_100011216618 [0,1,0,0,0,0|1,0,2]=4 565 B16R1.15111 CCN(C(=O)COC)c1ccccc1C#N 1626a_200000218880_100000210968 [0,1,0,0,0,0|1,0,2]=4 566 B16R1.15111 CCN(C(=O)COC)c1ccccc1OC 11a_100020603010_100000210968 [0,1,0,0,0,0|1,0,1]=3 567 B16R1.15111 CCN(C(=O)COC)c1ccccc1OC 1626a_100020603010_100000210968 [0,1,0,0,0,0|1,0,1]=3 568 B16R1.15111 CCN(C(=O)COC)c1ccccc1OC 22a_100020603010_100000210968 [0,1,0,0,0,0|1,0,1]=3 569 B16R1.15111 CCN(C(=O)CSC)c1ccccc1C#N 1626a_200000218880_100000184570 [0,1,0,0,0,0|1,0,2]=4 570 B16R1.15111 CCN(C(=O)CSC)c1ccccc1OC 11a_100020603010_100000184570 [0,1,0,0,0,0|1,0,1]=3 571 B16R1.15111 CCN(C(=O)CSC)c1ccccc1OC 1626a_100020603010_100000184570 [0,1,0,0,0,0|1,0,1]=3 572 B16R1.15111 CCN(C(=O)CSC)c1ccccc1OC 22a_100020603010_100000184570 [0,1,0,0,0,0|1,0,1]=3 573 B16R1.15111 CCN(C(=O)NNC)c1ccccc1C#N 512a_200000218880_100016993582 [0,1,0,0,0,0|2,0,1]=4 574 B16R1.15111 CCNC(=O)N(CC)c1ccccc1C#N 512a_200000218880_100015525214 [0,1,0,0,0,0|1,0,2]=4 575 B16R1.20764 C#CCCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000692101 [0,1,0,0,0,0|0,0,3]=4 576 B16R1.20764 C#CCCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000692101 [0,1,0,0,0,0|0,0,3]=4 577 B16R1.20764 C#CCCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000692101 [0,1,0,0,0,0|0,0,3]=4 578 B16R1.20764 C#CCNC(=O)N(CC)c1ccccc1C 512a_100000211084_100000212058 [0,1,0,0,0,0|0,0,3]=4 579 B16R1.20764 C#CCNC(=O)N(CC)c1ccccc1C 512a_100000212058_100000211084 [0,1,0,0,0,0|0,0,3]=4 580 B16R1.20764 C/C=C/CC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100102629194 [0,1,0,0,0,0|2,0,0]=3 581 B16R1.20764 C/C=C/CC(=O)C(OC)c1ccccc1C 1458a_100012277922_100102629194 [0,1,0,0,0,0|2,0,0]=3 582 B16R1.20764 C/C=C/CC(=O)C(OC)c1ccccc1F 1458a_100012277919_100102629194 [0,1,0,0,0,0|3,0,0]=4 583 B16R1.20764 C=CC=CC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100016291481 [0,1,0,0,0,0|1,0,1]=3 584 B16R1.20764 C=CC=CC(=O)N(CC)c1ccccc1C 1626a_100000211084_100016291481 [0,1,0,0,0,0|0,0,1]=2 585 B16R1.20764 C=CC=CC(=O)N(CC)c1ccccc1C 22a_100000211084_100016291481 [0,1,0,0,0,0|0,0,1]=2 586 B16R1.20764 C=CC=CC(=O)N(CC)c1ccccc1F 1626a_100000220365_100016291481 [0,1,0,0,0,0|1,0,1]=3 587 B16R1.20764 C=CC=CC(=O)N(CC)c1ccccc1O 22a_103624766699_100016291481 [0,1,0,0,0,0|1,0,1]=3 588 B16R1.20764 C=CCCC(=O)N(CC)c1ccccc1Br 11a_114873767003_100000749702 [0,1,0,0,0,0|1,0,2]=4 589 B16R1.20764 C=CCCC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000749702 [0,1,0,0,0,0|1,0,2]=4 590 B16R1.20764 C=CCCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000749702 [0,1,0,0,0,0|0,0,2]=3 591 B16R1.20764 C=CCCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000749702 [0,1,0,0,0,0|0,0,2]=3 592 B16R1.20764 C=CCCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000749702 [0,1,0,0,0,0|0,0,2]=3 593 B16R1.20764 C=CCCC(=O)N(CC)c1ccccc1F 11a_100000220365_100000749702 [0,1,0,0,0,0|1,0,2]=4 594 B16R1.20764 C=CCCC(=O)N(CC)c1ccccc1F 1626a_100000220365_100000749702 [0,1,0,0,0,0|1,0,2]=4 595 B16R1.20764 C=CCCC(=O)N(CC)c1ccccc1O 22a_103624766699_100000749702 [0,1,0,0,0,0|1,0,2]=4 596 B16R1.20764 C=CCNC(=O)N(CC)c1ccccc1Br 512a_114873767003_100020586998 [0,1,0,0,0,0|1,0,2]=4 597 B16R1.20764 C=CCNC(=O)N(CC)c1ccccc1C 512a_100000211084_100020586998 [0,1,0,0,0,0|0,0,2]=3 598 B16R1.20764 C=CCNC(=O)N(CC)c1ccccc1C 512a_100020586998_100000211084 [0,1,0,0,0,0|0,0,2]=3 599 B16R1.20764 C=CCNC(=O)N(CC)c1ccccc1F 512a_100000220365_100020586998 [0,1,0,0,0,0|1,0,2]=4 600 B16R1.20764 CC=CCC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000070051 [0,1,0,0,0,0|2,0,0]=3 601 B16R1.20764 CC=CCC(=O)C(OC)c1ccccc1C 1458a_100012277922_100000070051 [0,1,0,0,0,0|2,0,0]=3 602 B16R1.20764 CC=CCC(=O)C(OC)c1ccccc1F 1458a_100012277919_100000070051 [0,1,0,0,0,0|3,0,0]=4 603 B16R1.20764 CC=CCC(=O)N(CC)c1ccccc1Br 11a_114873767003_100121576822 [0,1,0,0,0,0|1,0,0]=2 604 B16R1.20764 CC=CCC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100121576822 [0,1,0,0,0,0|1,0,0]=2 605 B16R1.20764 CC=CCC(=O)N(CC)c1ccccc1C 11a_100000211084_100121576822 [0,1,0,0,0,0|0,0,0]=1 606 B16R1.20764 CC=CCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100121576822 [0,1,0,0,0,0|0,0,0]=1 607 B16R1.20764 CC=CCC(=O)N(CC)c1ccccc1C 22a_100000211084_100121576822 [0,1,0,0,0,0|0,0,0]=1 608 B16R1.20764 CC=CCC(=O)N(CC)c1ccccc1F 11a_100000220365_100121576822 [0,1,0,0,0,0|1,0,0]=2 609 B16R1.20764 CC=CCC(=O)N(CC)c1ccccc1F 1626a_100000220365_100121576822 [0,1,0,0,0,0|1,0,0]=2 610 B16R1.20764 CC=CCC(=O)N(CC)c1ccccc1O 22a_103624766699_100121576822 [0,1,0,0,0,0|1,0,0]=2 611 B16R1.20764 CCC#CC(=O)N(CC)c1ccccc1C 22a_100000211084_100011827653 [0,1,0,0,0,0|0,0,2]=3 612 B16R1.20764 CCC#CC(=O)N(CC)c1ccccc1O 22a_103624766699_100011827653 [0,1,0,0,0,0|1,0,2]=4 613 B16R1.20764 CCC=CC(=O)N(CC)c1ccccc1Br 11a_114873767003_100000212282 [0,1,0,0,0,0|1,0,0]=2 614 B16R1.20764 CCC=CC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000212282 [0,1,0,0,0,0|1,0,0]=2 615 B16R1.20764 CCC=CC(=O)N(CC)c1ccccc1C 11a_100000211084_100000212282 [0,1,0,0,0,0|0,0,0]=1 616 B16R1.20764 CCC=CC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000212282 [0,1,0,0,0,0|0,0,0]=1 617 B16R1.20764 CCC=CC(=O)N(CC)c1ccccc1C 22a_100000211084_100000212282 [0,1,0,0,0,0|0,0,0]=1 618 B16R1.20764 CCC=CC(=O)N(CC)c1ccccc1F 11a_100000220365_100000212282 [0,1,0,0,0,0|1,0,0]=2 619 B16R1.20764 CCC=CC(=O)N(CC)c1ccccc1F 1626a_100000220365_100000212282 [0,1,0,0,0,0|1,0,0]=2 620 B16R1.20764 CCC=CC(=O)N(CC)c1ccccc1O 22a_103624766699_100000212282 [0,1,0,0,0,0|1,0,0]=2 621 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1Br 11a_114873767003_100000210183 [0,1,0,0,0,0|1,0,2]=4 622 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000210183 [0,1,0,0,0,0|1,0,2]=4 623 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000210183 [0,1,0,0,0,0|0,0,2]=3 624 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000210183 [0,1,0,0,0,0|0,0,2]=3 625 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000210183 [0,1,0,0,0,0|0,0,2]=3 626 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1F 11a_100000220365_100000210183 [0,1,0,0,0,0|1,0,2]=4 627 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1F 1626a_100000220365_100000210183 [0,1,0,0,0,0|1,0,2]=4 628 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1O 22a_103624766699_100000210183 [0,1,0,0,0,0|1,0,2]=4 629 B16R1.20764 CCCNC(=O)N(CC)c1ccccc1Br 512a_114873767003_100020643023 [0,1,0,0,0,0|1,0,2]=4 630 B16R1.20764 CCCNC(=O)N(CC)c1ccccc1C 512a_100000211084_100020643023 [0,1,0,0,0,0|0,0,2]=3 631 B16R1.20764 CCCNC(=O)N(CC)c1ccccc1C 512a_100020643023_100000211084 [0,1,0,0,0,0|0,0,2]=3 632 B16R1.20764 CCCNC(=O)N(CC)c1ccccc1F 512a_100000220365_100020643023 [0,1,0,0,0,0|1,0,2]=4 633 B16R1.20764 CCN(C(=O)C=COC)c1ccccc1Br 1626a_114873767003_100016268678 [0,1,0,0,0,0|1,0,0]=2 634 B16R1.20764 CCN(C(=O)C=COC)c1ccccc1C 1626a_100000211084_100016268678 [0,1,0,0,0,0|0,0,0]=1 635 B16R1.20764 CCN(C(=O)C=COC)c1ccccc1C 22a_100000211084_100016268678 [0,1,0,0,0,0|0,0,0]=1 636 B16R1.20764 CCN(C(=O)C=COC)c1ccccc1F 1626a_100000220365_100016268678 [0,1,0,0,0,0|1,0,0]=2 637 B16R1.20764 CCN(C(=O)C=COC)c1ccccc1O 22a_103624766699_100016268678 [0,1,0,0,0,0|1,0,0]=2 638 B16R1.20764 CCN(C(=O)CCC#N)c1ccccc1C 11a_100000211084_100011934036 [0,1,0,0,0,0|0,0,3]=4 639 B16R1.20764 CCN(C(=O)CCC#N)c1ccccc1C 1626a_100000211084_100011934036 [0,1,0,0,0,0|0,0,3]=4 640 B16R1.20764 CCN(C(=O)CCC#N)c1ccccc1C 22a_100000211084_100011934036 [0,1,0,0,0,0|0,0,3]=4 641 B16R1.20764 CCN(C(=O)CCNC)c1ccccc1C 2230a_106832991635_200011208507 [0,1,0,0,0,0|0,0,2]=3 642 B16R1.20764 CCN(C(=O)CCNC)c1ccccc1C 34a_100102657272_200011208507 [0,1,0,0,0,0|0,0,2]=3 643 B16R1.20764 CCN(C(=O)CCNC)c1ccccc1C 7a_106832991635_200011208507 [0,1,0,0,0,0|0,0,2]=3 644 B16R1.20764 CCN(C(=O)CCOC)c1ccccc1Br 11a_114873767003_100000749529 [0,1,0,0,0,0|1,0,2]=4 645 B16R1.20764 CCN(C(=O)CCOC)c1ccccc1Br 1626a_114873767003_100000749529 [0,1,0,0,0,0|1,0,2]=4 646 B16R1.20764 CCN(C(=O)CCOC)c1ccccc1C 11a_100000211084_100000749529 [0,1,0,0,0,0|0,0,2]=3 647 B16R1.20764 CCN(C(=O)CCOC)c1ccccc1C 1626a_100000211084_100000749529 [0,1,0,0,0,0|0,0,2]=3 648 B16R1.20764 CCN(C(=O)CCOC)c1ccccc1C 22a_100000211084_100000749529 [0,1,0,0,0,0|0,0,2]=3 649 B16R1.20764 CCN(C(=O)CCOC)c1ccccc1C 34a_100138415774_200011208507 [0,1,0,0,0,0|0,0,2]=3 650 B16R1.20764 CCN(C(=O)CCOC)c1ccccc1F 11a_100000220365_100000749529 [0,1,0,0,0,0|1,0,2]=4 651 B16R1.20764 CCN(C(=O)CCOC)c1ccccc1F 1626a_100000220365_100000749529 [0,1,0,0,0,0|1,0,2]=4 652 B16R1.20764 CCN(C(=O)CCOC)c1ccccc1O 22a_103624766699_100000749529 [0,1,0,0,0,0|1,0,2]=4 653 B16R1.20764 CCN(C(=O)CCSC)c1ccccc1Br 11a_114873767003_100000174002 [0,1,0,0,0,0|1,0,2]=4 654 B16R1.20764 CCN(C(=O)CCSC)c1ccccc1Br 1626a_114873767003_100000174002 [0,1,0,0,0,0|1,0,2]=4 655 B16R1.20764 CCN(C(=O)CCSC)c1ccccc1C 11a_100000211084_100000174002 [0,1,0,0,0,0|0,0,2]=3 656 B16R1.20764 CCN(C(=O)CCSC)c1ccccc1C 1626a_100000211084_100000174002 [0,1,0,0,0,0|0,0,2]=3 657 B16R1.20764 CCN(C(=O)CCSC)c1ccccc1C 22a_100000211084_100000174002 [0,1,0,0,0,0|0,0,2]=3 658 B16R1.20764 CCN(C(=O)CCSC)c1ccccc1C 62a_200000210301_200011208507 [0,1,0,0,0,0|0,0,2]=3 659 B16R1.20764 CCN(C(=O)CCSC)c1ccccc1F 11a_100000220365_100000174002 [0,1,0,0,0,0|1,0,2]=4 660 B16R1.20764 CCN(C(=O)CCSC)c1ccccc1F 1626a_100000220365_100000174002 [0,1,0,0,0,0|1,0,2]=4 661 B16R1.20764 CCN(C(=O)CCSC)c1ccccc1O 22a_103624766699_100000174002 [0,1,0,0,0,0|1,0,2]=4 662 B16R1.20764 CCN(C(=O)CCS[13CH3])c1ccccc1C 62a_200025704644_200011208507 [0,1,0,0,0,0|0,0,2]=3 663 B16R1.20764 CCN(C(=O)CN=[N+]=[N-])c1ccccc1C 11a_100000211084_100000751907 [0,1,0,0,0,0|2,0,1]=4 664 B16R1.20764 CCN(C(=O)CN=[N+]=[N-])c1ccccc1C 22a_100000211084_100000751907 [0,1,0,0,0,0|2,0,1]=4 665 B16R1.20764 CCN(C(=O)CSCF)c1ccccc1C 62a_100015361967_100000239579 [0,1,0,0,0,0|1,0,1]=3 666 B16R1.20764 CCN(C(=O)NCC#N)c1ccccc1C 512a_100000211084_100000734998 [0,1,0,0,0,0|1,0,2]=4 667 B16R1.20764 CCN(C(=O)NCC#N)c1ccccc1C 512a_100000734998_100000211084 [0,1,0,0,0,0|1,0,2]=4 668 B16R1.20764 CCN(C(=O)NCCF)c1ccccc1Br 512a_114873767003_100000724931 [0,1,0,0,0,0|2,0,1]=4 669 B16R1.20764 CCN(C(=O)NCCF)c1ccccc1C 512a_100000211084_100000724931 [0,1,0,0,0,0|1,0,1]=3 670 B16R1.20764 CCN(C(=O)NCCF)c1ccccc1F 512a_100000220365_100000724931 [0,1,0,0,0,0|2,0,1]=4 671 B16R1.20764 CCN(C(=O)NCCO)c1ccccc1Br 512a_114873767003_100000210304 [0,1,0,0,0,0|2,0,1]=4 672 B16R1.20764 CCN(C(=O)NCCO)c1ccccc1C 512a_100000211084_100000210304 [0,1,0,0,0,0|1,0,1]=3 673 B16R1.20764 CCN(C(=O)NCCO)c1ccccc1F 512a_100000220365_100000210304 [0,1,0,0,0,0|2,0,1]=4 674 B16R1.20764 CCNCC(=O)N(CC)c1ccccc1C 2230a_100015525214_100000239579 [0,1,0,0,0,0|0,0,2]=3 675 B16R1.20764 CCNNC(=O)N(CC)c1ccccc1Br 512a_114873767003_100000756455 [0,1,0,0,0,0|2,0,1]=4 676 B16R1.20764 CCNNC(=O)N(CC)c1ccccc1C 512a_100000211084_100000756455 [0,1,0,0,0,0|1,0,1]=3 677 B16R1.20764 CCNNC(=O)N(CC)c1ccccc1C 512a_100000756455_100000211084 [0,1,0,0,0,0|1,0,1]=3 678 B16R1.20764 CCNNC(=O)N(CC)c1ccccc1F 512a_100000220365_100000756455 [0,1,0,0,0,0|2,0,1]=4 679 B16R1.20764 CCOCC(=O)N(CC)c1ccccc1Br 11a_114873767003_100000211967 [0,1,0,0,0,0|1,0,2]=4 680 B16R1.20764 CCOCC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000211967 [0,1,0,0,0,0|1,0,2]=4 681 B16R1.20764 CCOCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000211967 [0,1,0,0,0,0|0,0,2]=3 682 B16R1.20764 CCOCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000211967 [0,1,0,0,0,0|0,0,2]=3 683 B16R1.20764 CCOCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000211967 [0,1,0,0,0,0|0,0,2]=3 684 B16R1.20764 CCOCC(=O)N(CC)c1ccccc1C 34a_100121572206_100000239579 [0,1,0,0,0,0|0,0,2]=3 685 B16R1.20764 CCOCC(=O)N(CC)c1ccccc1F 11a_100000220365_100000211967 [0,1,0,0,0,0|1,0,2]=4 686 B16R1.20764 CCOCC(=O)N(CC)c1ccccc1F 1626a_100000220365_100000211967 [0,1,0,0,0,0|1,0,2]=4 687 B16R1.20764 CCOCC(=O)N(CC)c1ccccc1O 22a_103624766699_100000211967 [0,1,0,0,0,0|1,0,2]=4 688 B16R1.20764 CCSCC(=O)N(CC)c1ccccc1Br 11a_114873767003_100000230394 [0,1,0,0,0,0|1,0,2]=4 689 B16R1.20764 CCSCC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000230394 [0,1,0,0,0,0|1,0,2]=4 690 B16R1.20764 CCSCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000230394 [0,1,0,0,0,0|0,0,2]=3 691 B16R1.20764 CCSCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000230394 [0,1,0,0,0,0|0,0,2]=3 692 B16R1.20764 CCSCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000230394 [0,1,0,0,0,0|0,0,2]=3 693 B16R1.20764 CCSCC(=O)N(CC)c1ccccc1C 62a_100000210202_100000239579 [0,1,0,0,0,0|0,0,2]=3 694 B16R1.20764 CCSCC(=O)N(CC)c1ccccc1F 11a_100000220365_100000230394 [0,1,0,0,0,0|1,0,2]=4 695 B16R1.20764 CCSCC(=O)N(CC)c1ccccc1F 1626a_100000220365_100000230394 [0,1,0,0,0,0|1,0,2]=4 696 B16R1.20764 CCSCC(=O)N(CC)c1ccccc1O 22a_103624766699_100000230394 [0,1,0,0,0,0|1,0,2]=4 697 B16R1.27735 C=CCC(=O)N(CCC)c1ccccc1F 11a_100011231789_100000210193 [0,1,0,0,0,0|1,0,2]=4 698 B16R1.27735 C=CCC(=O)N(CCC)c1ccccc1F 1626a_100011231789_100000210193 [0,1,0,0,0,0|1,0,2]=4 699 B16R1.27735 CC=CC(=O)N(CCC)c1ccccc1F 11a_100011231789_100000210699 [0,1,0,0,0,0|1,0,0]=2 700 B16R1.27735 CC=CC(=O)N(CCC)c1ccccc1F 1626a_100011231789_100000210699 [0,1,0,0,0,0|1,0,0]=2 701 B16R1.27735 CCCC(=O)N(CCC)c1ccccc1F 11a_100011231789_100000211992 [0,1,0,0,0,0|1,0,2]=4 702 B16R1.27735 CCCC(=O)N(CCC)c1ccccc1F 1626a_100011231789_100000211992 [0,1,0,0,0,0|1,0,2]=4 703 B16R1.27735 CCCN(C(=O)C=CBr)c1ccccc1F 1626a_100011231789_100016273825 [0,1,0,0,0,0|2,0,0]=3 704 B16R1.27735 CCCN(C(=O)C=CCl)c1ccccc1F 11a_100011231789_200016279998 [0,1,0,0,0,0|2,0,0]=3 705 B16R1.27735 CCCN(C(=O)C=CCl)c1ccccc1F 1626a_100011231789_200016279998 [0,1,0,0,0,0|2,0,0]=3 706 B16R1.27735 CCCN(C(=O)C=CI)c1ccccc1F 1626a_100011231789_100016256311 [0,1,0,0,0,0|2,0,0]=3 707 B16R1.27735 CCCN(C(=O)COC)c1ccccc1F 11a_100011231789_100000210968 [0,1,0,0,0,0|2,0,1]=4 708 B16R1.27735 CCCN(C(=O)COC)c1ccccc1F 1626a_100011231789_100000210968 [0,1,0,0,0,0|2,0,1]=4 709 B16R1.27735 CCCN(C(=O)CSC)c1ccccc1F 11a_100011231789_100000184570 [0,1,0,0,0,0|2,0,1]=4 710 B16R1.27735 CCCN(C(=O)CSC)c1ccccc1F 1626a_100011231789_100000184570 [0,1,0,0,0,0|2,0,1]=4 711 B16R1.27735 CCCN(C(=O)NCC)c1ccccc1F 512a_100011231789_100015525214 [0,1,0,0,0,0|2,0,1]=4 712 B16R1.27735 CCCN(C(=O)NNC)c1ccccc1F 512a_100011231789_100016993582 [0,1,0,0,0,0|3,0,0]=4 713 B16R1.27735 CCNC(=O)N(CCO)c1ccccc1C 512a_100015525214_100011233185 [0,1,0,0,0,0|1,0,1]=3 714 B16R1.27735 CNNC(=O)N(CCO)c1ccccc1C 512a_100016993582_100011233185 [0,1,0,0,0,0|2,0,0]=3 715 B16R1.69654 C#CCC(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100011220946 [0,1,0,0,0,0|0,0,3]=4 716 B16R1.69654 C=CCC(=O)N(CC)c1ccc(cc1C)F 11a_100000221679_100000210193 [0,1,0,0,0,0|0,0,2]=3 717 B16R1.69654 C=CCC(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100000210193 [0,1,0,0,0,0|0,0,2]=3 718 B16R1.69654 C=CCC(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100000210193 [0,1,0,0,0,0|0,0,2]=3 719 B16R1.69654 C=CCC(=O)N(CC)c1ccc(cc1Cl)Cl 11a_100160557746_100000210193 [0,1,0,0,0,0|1,0,2]=4 720 B16R1.69654 C=CCC(=O)N(CC)c1ccc(cc1Cl)Cl 1626a_100160557746_100000210193 [0,1,0,0,0,0|1,0,2]=4 721 B16R1.69654 CC#CC(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100000763181 [0,1,0,0,0,0|0,0,2]=3 722 B16R1.69654 CC=CC(=O)N(CC)c1ccc(cc1C)F 11a_100000221679_100000210699 [0,1,0,0,0,0|0,0,0]=1 723 B16R1.69654 CC=CC(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100000210699 [0,1,0,0,0,0|0,0,0]=1 724 B16R1.69654 CC=CC(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100000210699 [0,1,0,0,0,0|0,0,0]=1 725 B16R1.69654 CC=CC(=O)N(CC)c1ccc(cc1Cl)Cl 11a_100160557746_100000210699 [0,1,0,0,0,0|1,0,0]=2 726 B16R1.69654 CC=CC(=O)N(CC)c1ccc(cc1Cl)Cl 1626a_100160557746_100000210699 [0,1,0,0,0,0|1,0,0]=2 727 B16R1.69654 CCCC(=O)N(CC)c1ccc(cc1C)F 11a_100000221679_100000211992 [0,1,0,0,0,0|0,0,2]=3 728 B16R1.69654 CCCC(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100000211992 [0,1,0,0,0,0|0,0,2]=3 729 B16R1.69654 CCCC(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100000211992 [0,1,0,0,0,0|0,0,2]=3 730 B16R1.69654 CCCC(=O)N(CC)c1ccc(cc1Cl)Cl 11a_100160557746_100000211992 [0,1,0,0,0,0|1,0,2]=4 731 B16R1.69654 CCCC(=O)N(CC)c1ccc(cc1Cl)Cl 1626a_100160557746_100000211992 [0,1,0,0,0,0|1,0,2]=4 732 B16R1.69654 CCN(C(=O)C=CBr)c1ccc(cc1C)F 1626a_100000221679_100016273825 [0,1,0,0,0,0|1,0,0]=2 733 B16R1.69654 CCN(C(=O)C=CBr)c1ccc(cc1Cl)Cl 1626a_100160557746_100016273825 [0,1,0,0,0,0|2,0,0]=3 734 B16R1.69654 CCN(C(=O)C=CCl)c1ccc(cc1C)F 11a_100000221679_200016279998 [0,1,0,0,0,0|1,0,0]=2 735 B16R1.69654 CCN(C(=O)C=CCl)c1ccc(cc1C)F 1626a_100000221679_200016279998 [0,1,0,0,0,0|1,0,0]=2 736 B16R1.69654 CCN(C(=O)C=CCl)c1ccc(cc1Cl)Cl 11a_100160557746_200016279998 [0,1,0,0,0,0|2,0,0]=3 737 B16R1.69654 CCN(C(=O)C=CCl)c1ccc(cc1Cl)Cl 1626a_100160557746_200016279998 [0,1,0,0,0,0|2,0,0]=3 738 B16R1.69654 CCN(C(=O)C=CI)c1ccc(cc1C)F 1626a_100000221679_100016256311 [0,1,0,0,0,0|1,0,0]=2 739 B16R1.69654 CCN(C(=O)C=CI)c1ccc(cc1Cl)Cl 1626a_100160557746_100016256311 [0,1,0,0,0,0|2,0,0]=3 740 B16R1.69654 CCN(C(=O)CC#N)c1ccc(cc1C)F 1626a_100000221679_100051588842 [0,1,0,0,0,0|1,0,2]=4 741 B16R1.69654 CCN(C(=O)CC#N)c1ccc(cc1C)F 22a_100000221679_100051588842 [0,1,0,0,0,0|1,0,2]=4 742 B16R1.69654 CCN(C(=O)CCO)c1ccc(cc1C)F 22a_100000221679_100011216618 [0,1,0,0,0,0|1,0,2]=4 743 B16R1.69654 CCN(C(=O)COC)c1ccc(cc1C)F 11a_100000221679_100000210968 [0,1,0,0,0,0|1,0,1]=3 744 B16R1.69654 CCN(C(=O)COC)c1ccc(cc1C)F 1626a_100000221679_100000210968 [0,1,0,0,0,0|1,0,1]=3 745 B16R1.69654 CCN(C(=O)COC)c1ccc(cc1C)F 22a_100000221679_100000210968 [0,1,0,0,0,0|1,0,1]=3 746 B16R1.69654 CCN(C(=O)COC)c1ccc(cc1Cl)Cl 11a_100160557746_100000210968 [0,1,0,0,0,0|2,0,1]=4 747 B16R1.69654 CCN(C(=O)COC)c1ccc(cc1Cl)Cl 1626a_100160557746_100000210968 [0,1,0,0,0,0|2,0,1]=4 748 B16R1.69654 CCN(C(=O)CSC)c1ccc(cc1C)F 11a_100000221679_100000184570 [0,1,0,0,0,0|1,0,1]=3 749 B16R1.69654 CCN(C(=O)CSC)c1ccc(cc1C)F 1626a_100000221679_100000184570 [0,1,0,0,0,0|1,0,1]=3 750 B16R1.69654 CCN(C(=O)CSC)c1ccc(cc1C)F 22a_100000221679_100000184570 [0,1,0,0,0,0|1,0,1]=3 751 B16R1.69654 CCN(C(=O)CSC)c1ccc(cc1Cl)Cl 11a_100160557746_100000184570 [0,1,0,0,0,0|2,0,1]=4 752 B16R1.69654 CCN(C(=O)CSC)c1ccc(cc1Cl)Cl 1626a_100160557746_100000184570 [0,1,0,0,0,0|2,0,1]=4 753 B16R1.69654 CCN(C(=O)NNC)c1ccc(cc1C)F 512a_100000221679_100016993582 [0,1,0,0,0,0|2,0,0]=3 754 B16R1.69654 CCN(C(=O)NNC)c1ccc(cc1C)F 512a_100016993582_100000221679 [0,1,0,0,0,0|2,0,0]=3 755 B16R1.69654 CCNC(=O)N(CC)c1ccc(cc1C)F 512a_100000221679_100015525214 [0,1,0,0,0,0|1,0,1]=3 756 B16R1.69654 CCNC(=O)N(CC)c1ccc(cc1C)F 512a_100015525214_100000221679 [0,1,0,0,0,0|1,0,1]=3 757 B16R2.5483 CCN(c1ncns1)c2ccccc2C 27a_100000211084_100000693119 [0,0,0,1,0,0|2,1,0]=4 758 B16R2.5483 CCN(c1nncs1)c2ccccc2C 27a_100000211084_100000739804 [0,0,0,1,0,0|3,0,0]=4 759 B16R2.5536 CCN(C(=O)C1CC1)c2ccccc2Br 11a_114873767003_100000210395 [0,0,0,1,0,0|1,0,2]=4 760 B16R2.5536 CCN(C(=O)C1CC1)c2ccccc2Br 1626a_114873767003_100000210395 [0,0,0,1,0,0|1,0,2]=4 761 B16R2.5536 CCN(C(=O)C1CC1)c2ccccc2C 11a_100000211084_100000210395 [0,0,0,1,0,0|0,0,2]=3 762 B16R2.5536 CCN(C(=O)C1CC1)c2ccccc2C 1626a_100000211084_100000210395 [0,0,0,1,0,0|0,0,2]=3 763 B16R2.5536 CCN(C(=O)C1CC1)c2ccccc2C 22a_100000211084_100000210395 [0,0,0,1,0,0|0,0,2]=3 764 B16R2.5536 CCN(C(=O)C1CC1)c2ccccc2F 11a_100000220365_100000210395 [0,0,0,1,0,0|1,0,2]=4 765 B16R2.5536 CCN(C(=O)C1CC1)c2ccccc2F 1626a_100000220365_100000210395 [0,0,0,1,0,0|1,0,2]=4 766 B16R2.5536 CCN(C(=O)C1CC1)c2ccccc2O 22a_103624766699_100000210395 [0,0,0,1,0,0|1,0,2]=4 767 B16R2.5536 CCN(C(=O)C1CO1)c2ccccc2Br 11a_114873767003_100000701028 [0,0,0,1,0,0|2,0,1]=4 768 B16R2.5536 CCN(C(=O)C1CO1)c2ccccc2Br 1626a_114873767003_100000701028 [0,0,0,1,0,0|2,0,1]=4 769 B16R2.5536 CCN(C(=O)C1CO1)c2ccccc2C 11a_100000211084_100000701028 [0,0,0,1,0,0|1,0,1]=3 770 B16R2.5536 CCN(C(=O)C1CO1)c2ccccc2C 1626a_100000211084_100000701028 [0,0,0,1,0,0|1,0,1]=3 771 B16R2.5536 CCN(C(=O)C1CO1)c2ccccc2C 22a_100000211084_100000701028 [0,0,0,1,0,0|1,0,1]=3 772 B16R2.5536 CCN(C(=O)C1CO1)c2ccccc2F 11a_100000220365_100000701028 [0,0,0,1,0,0|2,0,1]=4 773 B16R2.5536 CCN(C(=O)C1CO1)c2ccccc2F 1626a_100000220365_100000701028 [0,0,0,1,0,0|2,0,1]=4 774 B16R2.5536 CCN(C(=O)C1CO1)c2ccccc2O 22a_103624766699_100000701028 [0,0,0,1,0,0|2,0,1]=4 775 B16R2.29842 CC1Cc2ccccc2N1C(=O)CS[13CH3] 62a_100000183016_200025704644 [0,0,0,1,0,0|1,0,1]=3 776 B16R2.29842 CC1Cc2ccccc2N1C(=O)CS[13CH3] 62a_200025704644_100000183016 [0,0,0,1,0,0|1,0,1]=3 777 B16R2.29842 CNCC(=O)N1c2ccccc2CC1C 2230a_106832991635_100000183016 [0,0,0,1,0,0|1,0,1]=3 778 B16R2.29842 CNCC(=O)N1c2ccccc2CC1C 34a_100102657272_100000183016 [0,0,0,1,0,0|1,0,1]=3 779 B16R2.29842 CNCC(=O)N1c2ccccc2CC1C 7a_106832991635_100000183016 [0,0,0,1,0,0|1,0,1]=3 780 B16R2.29842 COCC(=O)N1c2ccccc2CC1C 34a_100138415774_100000183016 [0,0,0,1,0,0|1,0,1]=3 781 B16R2.29842 CSCC(=O)N1c2ccccc2CC1C 62a_100000183016_200000210301 [0,0,0,1,0,0|1,0,1]=3 782 B16R2.29842 CSCC(=O)N1c2ccccc2CC1C 62a_200000210301_100000183016 [0,0,0,1,0,0|1,0,1]=3 783 B16R2.160202 C=CCC(=O)C1CCCc2c1cccc2 1458a_100011198263_100000210623 [0,0,0,1,0,0|1,0,2]=4 784 B16R2.160202 CCCC(=O)C1CCCc2c1cccc2 1458a_100011198263_100000210303 [0,0,0,1,0,0|1,0,2]=4 785 B16R2.160202 CCNC(=O)C1CCCc2c1cccc2 11a_100015525214_100011198263 [0,0,0,1,0,0|2,0,1]=4 786 B16R2.160202 CCNC(=O)C1CCCc2c1cccc2 240690a_100015525214_100011198263 [0,0,0,1,0,0|2,0,1]=4 787 B16R2.160202 CCNC(=O)C1CCCc2c1cccc2 527a_100015525214_100011198263 [0,0,0,1,0,0|2,0,1]=4 788 B16R2.160202 CNCC(=O)N1CCCc2c1cccc2 2230a_100000744866_200000210301 [0,0,0,1,0,0|1,0,1]=3 789 B16R2.160202 CNCC(=O)N1CCCc2c1cccc2 2230a_106832991635_100000183537 [0,0,0,1,0,0|1,0,1]=3 790 B16R2.160202 CNCC(=O)N1CCCc2c1cccc2 34a_100102657272_100000183537 [0,0,0,1,0,0|1,0,1]=3 791 B16R2.160202 CNCC(=O)N1CCCc2c1cccc2 7a_106832991635_100000183537 [0,0,0,1,0,0|1,0,1]=3 792 B16R2.160202 CNCC(=O)N1CCOc2c1cccc2 2230a_106832991635_100011294157 [0,0,0,1,0,0|2,0,1]=4 793 B16R2.160202 CNCC(=O)N1CCOc2c1cccc2 34a_100102657272_100011294157 [0,0,0,1,0,0|2,0,1]=4 794 B16R2.160202 CNCC(=O)N1CCOc2c1cccc2 7a_106832991635_100011294157 [0,0,0,1,0,0|2,0,1]=4 795 B16R2.160202 CNCC(=O)N1CCSc2c1cccc2 2230a_106832991635_100000198521 [0,0,0,1,0,0|2,0,1]=4 796 B16R2.160202 CNCC(=O)N1CCSc2c1cccc2 7a_106832991635_100000198521 [0,0,0,1,0,0|2,0,1]=4 797 B16R2.160202 CNNC(=O)C1CCCc2c1cccc2 22a_100016993582_100011198263 [0,0,0,1,0,0|3,0,0]=4 798 B16R2.160202 COCC(=O)N1CCCc2c1cccc2 34a_100138415774_100000183537 [0,0,0,1,0,0|1,0,1]=3 799 B16R2.160202 COCC(=O)N1CCOc2c1cccc2 34a_100138415774_100011294157 [0,0,0,1,0,0|2,0,1]=4 800 B16R2.160202 CSCC(=O)N1CCCc2c1cccc2 62a_100000183537_200000210301 [0,0,0,1,0,0|1,0,1]=3 801 B16R2.160202 CSCC(=O)N1CCCc2c1cccc2 62a_200000210301_100000183537 [0,0,0,1,0,0|1,0,1]=3 802 B16R2.160202 CSCC(=O)N1CCOc2c1cccc2 62a_100011294157_200000210301 [0,0,0,1,0,0|2,0,1]=4 803 B16R2.160202 CSCC(=O)N1CCOc2c1cccc2 62a_200000210301_100011294157 [0,0,0,1,0,0|2,0,1]=4 804 B16R2.160202 CSCC(=O)N1CCSc2c1cccc2 62a_100000198521_200000210301 [0,0,0,1,0,0|2,0,1]=4 805 B16R2.160202 CSCC(=O)N1CCSc2c1cccc2 62a_200000210301_100000198521 [0,0,0,1,0,0|2,0,1]=4 806 B16R2.160202 [13CH3]NCC(=O)N1CCCc2c1cccc2 2230a_100000744866_200025704644 [0,0,0,1,0,0|1,0,1]=3 807 B16R2.160202 [13CH3]SCC(=O)N1CCCc2c1cccc2 62a_100000183537_200025704644 [0,0,0,1,0,0|1,0,1]=3 808 B16R2.160202 [13CH3]SCC(=O)N1CCCc2c1cccc2 62a_200025704644_100000183537 [0,0,0,1,0,0|1,0,1]=3 809 B16R2.160202 [13CH3]SCC(=O)N1CCOc2c1cccc2 62a_100011294157_200025704644 [0,0,0,1,0,0|2,0,1]=4 810 B16R2.160202 [13CH3]SCC(=O)N1CCOc2c1cccc2 62a_200025704644_100011294157 [0,0,0,1,0,0|2,0,1]=4 811 B16R2.160202 [13CH3]SCC(=O)N1CCSc2c1cccc2 62a_100000198521_200025704644 [0,0,0,1,0,0|2,0,1]=4 812 B16R2.160202 [13CH3]SCC(=O)N1CCSc2c1cccc2 62a_200025704644_100000198521 [0,0,0,1,0,0|2,0,1]=4 813 B16R1.2049 C=COC(=O)CN(CC)c1ccccc1Br 2230a_114873767003_100000036128 [0,0,0,0,0,1|2,0,1]=4 814 B16R1.2049 C=COC(=O)CN(CC)c1ccccc1Br 269982a_114873767003_100000036128 [0,0,0,0,0,1|2,0,1]=4 815 B16R1.2049 C=COC(=O)CN(CC)c1ccccc1Br 34a_114873767003_100000036128 [0,0,0,0,0,1|2,0,1]=4 816 B16R1.2049 C=COC(=O)CN(CC)c1ccccc1C 2230a_100000211084_100000036128 [0,0,0,0,0,1|1,0,1]=3 817 B16R1.2049 C=COC(=O)CN(CC)c1ccccc1C 269982a_100000211084_100000036128 [0,0,0,0,0,1|1,0,1]=3 818 B16R1.2049 C=COC(=O)CN(CC)c1ccccc1C 34a_100000211084_100000036128 [0,0,0,0,0,1|1,0,1]=3 819 B16R1.2049 C=COC(=O)CN(CC)c1ccccc1F 2230a_100000220365_100000036128 [0,0,0,0,0,1|2,0,1]=4 820 B16R1.2049 C=COC(=O)CN(CC)c1ccccc1F 269982a_100000220365_100000036128 [0,0,0,0,0,1|2,0,1]=4 821 B16R1.2049 C=COC(=O)CN(CC)c1ccccc1F 34a_100000220365_100000036128 [0,0,0,0,0,1|2,0,1]=4 822 B16R1.2049 C=COC(=O)CN(CC)c1ccccc1O 269982a_103624766699_100000036128 [0,0,0,0,0,1|2,0,1]=4 823 B16R1.2049 CC=CC(=O)NC(C#N)c1ccccc1C 1626a_102495364774_100000210699 [0,0,0,0,0,1|2,0,1]=4 824 B16R1.2049 CC=CC(=O)NC(C#N)c1ccccc1C 240690a_102495364774_100000210699 [0,0,0,0,0,1|2,0,1]=4 825 B16R1.2049 CC=CC(=O)NC(CC)c1ncccc1C 11a_200011536107_100000210699 [0,0,0,0,0,1|2,0,0]=3 826 B16R1.2049 CC=CC(=O)NC(CC)c1ncccc1C 1626a_200011536107_100000210699 [0,0,0,0,0,1|2,0,0]=3 827 B16R1.2049 CC=CC(=O)NC(CC)c1ncccc1C 240690a_200011536107_100000210699 [0,0,0,0,0,1|2,0,0]=3 828 B16R1.2049 CC=CC(=O)NC(CO)c1ccccc1Cl 240690a_100138412506_100000210699 [0,0,0,0,0,1|3,0,0]=4 829 B16R1.2049 CC=CC(=O)N[C@@H](CC)c1ccccc1Cl 11a_200016987949_100000210699 [0,0,0,0,0,1|2,0,0]=3 830 B16R1.2049 CC=CC(=O)N[C@@H](CC)c1ccccc1Cl 1626a_200016987949_100000210699 [0,0,0,0,0,1|2,0,0]=3 831 B16R1.2049 CC=CC(=O)N[C@@H](CC)c1ccccc1Cl 240690a_200016987949_100000210699 [0,0,0,0,0,1|2,0,0]=3 832 B16R1.2049 CC=CC(=O)N[C@@H](CC)c1ccccc1F 11a_100015190424_100000210699 [0,0,0,0,0,1|2,0,0]=3 833 B16R1.2049 CC=CC(=O)N[C@@H](CC)c1ccccc1F 1626a_100015190424_100000210699 [0,0,0,0,0,1|2,0,0]=3 834 B16R1.2049 CC=CC(=O)N[C@@H](CC)c1ccccc1F 240690a_100015190424_100000210699 [0,0,0,0,0,1|2,0,0]=3 835 B16R1.2049 CC=CC(=O)N[C@@H](CO)c1ccccc1F 240690a_100009818778_100000210699 [0,0,0,0,0,1|3,0,0]=4 836 B16R1.2049 CC=CC(=O)N[C@H](CO)c1ccccc1Br 240690a_100161155918_100000210699 [0,0,0,0,0,1|3,0,0]=4 837 B16R1.2049 CCC(NC(=O)C=CBr)c1ncccc1C 1626a_200011536107_100016273825 [0,0,0,0,0,1|3,0,0]=4 838 B16R1.2049 CCC(NC(=O)C=CBr)c1ncccc1C 240690a_200011536107_100016273825 [0,0,0,0,0,1|3,0,0]=4 839 B16R1.2049 CCC(NC(=O)C=CCl)c1ncccc1C 11a_200011536107_200016279998 [0,0,0,0,0,1|3,0,0]=4 840 B16R1.2049 CCC(NC(=O)C=CCl)c1ncccc1C 1626a_200011536107_200016279998 [0,0,0,0,0,1|3,0,0]=4 841 B16R1.2049 CCC(NC(=O)C=CCl)c1ncccc1C 240690a_200011536107_200016279998 [0,0,0,0,0,1|3,0,0]=4 842 B16R1.2049 CCC(NC(=O)C=CI)c1ncccc1C 1626a_200011536107_100016256311 [0,0,0,0,0,1|3,0,0]=4 843 B16R1.2049 CCCC(=O)CN(CC)c1ccccc1Br 2230a_114873767003_100000747444 [0,0,0,0,0,1|1,0,2]=4 844 B16R1.2049 CCCC(=O)CN(CC)c1ccccc1Br 269982a_114873767003_100000747444 [0,0,0,0,0,1|1,0,2]=4 845 B16R1.2049 CCCC(=O)CN(CC)c1ccccc1C 2230a_100000211084_100000747444 [0,0,0,0,0,1|0,0,2]=3 846 B16R1.2049 CCCC(=O)CN(CC)c1ccccc1C 269982a_100000211084_100000747444 [0,0,0,0,0,1|0,0,2]=3 847 B16R1.2049 CCCC(=O)CN(CC)c1ccccc1F 2230a_100000220365_100000747444 [0,0,0,0,0,1|1,0,2]=4 848 B16R1.2049 CCCC(=O)CN(CC)c1ccccc1F 269982a_100000220365_100000747444 [0,0,0,0,0,1|1,0,2]=4 849 B16R1.2049 CCCC(=O)CN(CC)c1ccccc1O 269982a_103624766699_100000747444 [0,0,0,0,0,1|1,0,2]=4 850 B16R1.2049 CCN(CC(=O)NCO)c1ccccc1C 2230a_100000211084_100000185155 [0,0,0,0,0,1|2,0,1]=4 851 B16R1.2049 CCN(CC(=O)NCO)c1ccccc1C 269982a_100000211084_100000185155 [0,0,0,0,0,1|2,0,1]=4 852 B16R1.2049 CCN(CC(=O)NCO)c1ccccc1C 34a_100000211084_100000185155 [0,0,0,0,0,1|2,0,1]=4 853 B16R1.2049 CCNC(=O)CN(CC)c1ccccc1Br 2230a_114873767003_100000183381 [0,0,0,0,0,1|2,0,1]=4 854 B16R1.2049 CCNC(=O)CN(CC)c1ccccc1Br 269982a_114873767003_100000183381 [0,0,0,0,0,1|2,0,1]=4 855 B16R1.2049 CCNC(=O)CN(CC)c1ccccc1Br 34a_114873767003_100000183381 [0,0,0,0,0,1|2,0,1]=4 856 B16R1.2049 CCNC(=O)CN(CC)c1ccccc1C 2230a_100000211084_100000183381 [0,0,0,0,0,1|1,0,1]=3 857 B16R1.2049 CCNC(=O)CN(CC)c1ccccc1C 269982a_100000211084_100000183381 [0,0,0,0,0,1|1,0,1]=3 858 B16R1.2049 CCNC(=O)CN(CC)c1ccccc1C 34a_100000211084_100000183381 [0,0,0,0,0,1|1,0,1]=3 859 B16R1.2049 CCNC(=O)CN(CC)c1ccccc1F 2230a_100000220365_100000183381 [0,0,0,0,0,1|2,0,1]=4 860 B16R1.2049 CCNC(=O)CN(CC)c1ccccc1F 269982a_100000220365_100000183381 [0,0,0,0,0,1|2,0,1]=4 861 B16R1.2049 CCNC(=O)CN(CC)c1ccccc1F 34a_100000220365_100000183381 [0,0,0,0,0,1|2,0,1]=4 862 B16R1.2049 CCNC(=O)CN(CC)c1ccccc1O 269982a_103624766699_100000183381 [0,0,0,0,0,1|2,0,1]=4 863 B16R1.2049 CCOC(=O)CN(CC)c1ccccc1Br 2230a_114873767003_100000188475 [0,0,0,0,0,1|2,0,1]=4 864 B16R1.2049 CCOC(=O)CN(CC)c1ccccc1Br 269982a_114873767003_100000188475 [0,0,0,0,0,1|2,0,1]=4 865 B16R1.2049 CCOC(=O)CN(CC)c1ccccc1Br 34a_114873767003_100000188475 [0,0,0,0,0,1|2,0,1]=4 866 B16R1.2049 CCOC(=O)CN(CC)c1ccccc1C 2230a_100000211084_100000188475 [0,0,0,0,0,1|1,0,1]=3 867 B16R1.2049 CCOC(=O)CN(CC)c1ccccc1C 2230a_200000219698_100000210202 [0,0,0,0,0,1|1,0,1]=3 868 B16R1.2049 CCOC(=O)CN(CC)c1ccccc1C 269982a_100000211084_100000188475 [0,0,0,0,0,1|1,0,1]=3 869 B16R1.2049 CCOC(=O)CN(CC)c1ccccc1C 269982a_200000219698_100000204670 [0,0,0,0,0,1|1,0,1]=3 870 B16R1.2049 CCOC(=O)CN(CC)c1ccccc1C 34a_100000211084_100000188475 [0,0,0,0,0,1|1,0,1]=3 871 B16R1.2049 CCOC(=O)CN(CC)c1ccccc1Cl 269982a_200000219373_100000204670 [0,0,0,0,0,1|2,0,1]=4 872 B16R1.2049 CCOC(=O)CN(CC)c1ccccc1F 2230a_100000220365_100000188475 [0,0,0,0,0,1|2,0,1]=4 873 B16R1.2049 CCOC(=O)CN(CC)c1ccccc1F 269982a_100000220356_100000204670 [0,0,0,0,0,1|2,0,1]=4 874 B16R1.2049 CCOC(=O)CN(CC)c1ccccc1F 269982a_100000220365_100000188475 [0,0,0,0,0,1|2,0,1]=4 875 B16R1.2049 CCOC(=O)CN(CC)c1ccccc1F 34a_100000220365_100000188475 [0,0,0,0,0,1|2,0,1]=4 876 B16R1.2049 CCOC(=O)CN(CC)c1ccccc1O 269982a_103624766699_100000188475 [0,0,0,0,0,1|2,0,1]=4 877 B16R1.2049 CCOC(=O)CN(CC)c1ccncc1C 27a_100000220607_100000765111 [0,0,0,0,0,1|2,0,1]=4 878 B16R1.2049 CCOC(=O)CN(CF)c1ccccc1C 269982a_200000219698_100015361967 [0,0,0,0,0,1|2,0,1]=4 879 B16R1.2049 CC[C@H](NC(=O)C=CBr)c1ccccc1Cl 1626a_200016987949_100016273825 [0,0,0,0,0,1|3,0,0]=4 880 B16R1.2049 CC[C@H](NC(=O)C=CBr)c1ccccc1Cl 240690a_200016987949_100016273825 [0,0,0,0,0,1|3,0,0]=4 881 B16R1.2049 CC[C@H](NC(=O)C=CBr)c1ccccc1F 1626a_100015190424_100016273825 [0,0,0,0,0,1|3,0,0]=4 882 B16R1.2049 CC[C@H](NC(=O)C=CBr)c1ccccc1F 240690a_100015190424_100016273825 [0,0,0,0,0,1|3,0,0]=4 883 B16R1.2049 CC[C@H](NC(=O)C=CCl)c1ccccc1Cl 11a_200016987949_200016279998 [0,0,0,0,0,1|3,0,0]=4 884 B16R1.2049 CC[C@H](NC(=O)C=CCl)c1ccccc1Cl 1626a_200016987949_200016279998 [0,0,0,0,0,1|3,0,0]=4 885 B16R1.2049 CC[C@H](NC(=O)C=CCl)c1ccccc1Cl 240690a_200016987949_200016279998 [0,0,0,0,0,1|3,0,0]=4 886 B16R1.2049 CC[C@H](NC(=O)C=CCl)c1ccccc1F 11a_100015190424_200016279998 [0,0,0,0,0,1|3,0,0]=4 887 B16R1.2049 CC[C@H](NC(=O)C=CCl)c1ccccc1F 1626a_100015190424_200016279998 [0,0,0,0,0,1|3,0,0]=4 888 B16R1.2049 CC[C@H](NC(=O)C=CCl)c1ccccc1F 240690a_100015190424_200016279998 [0,0,0,0,0,1|3,0,0]=4 889 B16R1.2049 CC[C@H](NC(=O)C=CI)c1ccccc1Cl 1626a_200016987949_100016256311 [0,0,0,0,0,1|3,0,0]=4 890 B16R1.2049 CC[C@H](NC(=O)C=CI)c1ccccc1F 1626a_100015190424_100016256311 [0,0,0,0,0,1|3,0,0]=4 891 B16R1.15117 C#CCC(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100011220946 [0,0,0,0,0,1|0,0,3]=4 892 B16R1.15117 C#CCC(=O)N(CC)Cc1ccccc1C 527a_100000201206_100011220946 [0,0,0,0,0,1|0,0,3]=4 893 B16R1.15117 C=CCC(=O)N(CC)Cc1ccccc1C 11a_100000201206_100000210193 [0,0,0,0,0,1|0,0,2]=3 894 B16R1.15117 C=CCC(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100000210193 [0,0,0,0,0,1|0,0,2]=3 895 B16R1.15117 C=CCC(=O)N(CC)Cc1ccccc1C 240690a_100000201206_100000210193 [0,0,0,0,0,1|0,0,2]=3 896 B16R1.15117 C=CCC(=O)N(CC)Cc1ccccc1C 527a_100000201206_100000210193 [0,0,0,0,0,1|0,0,2]=3 897 B16R1.15117 C=CCC(=O)N(CC)Cc1ccccc1Cl 11a_100000201176_100000210193 [0,0,0,0,0,1|1,0,2]=4 898 B16R1.15117 C=CCC(=O)N(CC)Cc1ccccc1Cl 1626a_100000201176_100000210193 [0,0,0,0,0,1|1,0,2]=4 899 B16R1.15117 C=CCC(=O)N(CC)Cc1ccccc1Cl 240690a_100000201176_100000210193 [0,0,0,0,0,1|1,0,2]=4 900 B16R1.15117 C=CCC(=O)N(CC)Cc1ccccc1Cl 527a_100000201176_100000210193 [0,0,0,0,0,1|1,0,2]=4 901 B16R1.15117 C=CCC(=O)N(CC)Cc1ccccc1F 11a_100015186831_100000210193 [0,0,0,0,0,1|1,0,2]=4 902 B16R1.15117 C=CCC(=O)N(CC)Cc1ccccc1F 1626a_100015186831_100000210193 [0,0,0,0,0,1|1,0,2]=4 903 B16R1.15117 C=CCC(=O)N(CC)Cc1ccccc1F 240690a_100015186831_100000210193 [0,0,0,0,0,1|1,0,2]=4 904 B16R1.15117 C=CCC(=O)N(CC)Cc1ccccc1F 527a_100015186831_100000210193 [0,0,0,0,0,1|1,0,2]=4 905 B16R1.15117 C=CCC(=O)N(CC)Cc1ccccc1O 240690a_100011223546_100000210193 [0,0,0,0,0,1|1,0,2]=4 906 B16R1.15117 C=CCC(=O)N(CC)Cc1ccccc1O 527a_100011223546_100000210193 [0,0,0,0,0,1|1,0,2]=4 907 B16R1.15117 CC=CC(=O)N(CC)Cc1ccccc1C 11a_100000201206_100000210699 [0,0,0,0,0,1|0,0,0]=1 908 B16R1.15117 CC=CC(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100000210699 [0,0,0,0,0,1|0,0,0]=1 909 B16R1.15117 CC=CC(=O)N(CC)Cc1ccccc1C 240690a_100000201206_100000210699 [0,0,0,0,0,1|0,0,0]=1 910 B16R1.15117 CC=CC(=O)N(CC)Cc1ccccc1Cl 11a_100000201176_100000210699 [0,0,0,0,0,1|1,0,0]=2 911 B16R1.15117 CC=CC(=O)N(CC)Cc1ccccc1Cl 1626a_100000201176_100000210699 [0,0,0,0,0,1|1,0,0]=2 912 B16R1.15117 CC=CC(=O)N(CC)Cc1ccccc1Cl 240690a_100000201176_100000210699 [0,0,0,0,0,1|1,0,0]=2 913 B16R1.15117 CC=CC(=O)N(CC)Cc1ccccc1F 11a_100015186831_100000210699 [0,0,0,0,0,1|1,0,0]=2 914 B16R1.15117 CC=CC(=O)N(CC)Cc1ccccc1F 1626a_100015186831_100000210699 [0,0,0,0,0,1|1,0,0]=2 915 B16R1.15117 CC=CC(=O)N(CC)Cc1ccccc1F 240690a_100015186831_100000210699 [0,0,0,0,0,1|1,0,0]=2 916 B16R1.15117 CC=CC(=O)N(CC)Cc1ccccc1O 240690a_100011223546_100000210699 [0,0,0,0,0,1|1,0,0]=2 917 B16R1.15117 CCCC(=O)N(CC)Cc1ccccc1C 11a_100000201206_100000211992 [0,0,0,0,0,1|0,0,2]=3 918 B16R1.15117 CCCC(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100000211992 [0,0,0,0,0,1|0,0,2]=3 919 B16R1.15117 CCCC(=O)N(CC)Cc1ccccc1C 240690a_100000201206_100000211992 [0,0,0,0,0,1|0,0,2]=3 920 B16R1.15117 CCCC(=O)N(CC)Cc1ccccc1C 527a_100000201206_100000211992 [0,0,0,0,0,1|0,0,2]=3 921 B16R1.15117 CCCC(=O)N(CC)Cc1ccccc1Cl 11a_100000201176_100000211992 [0,0,0,0,0,1|1,0,2]=4 922 B16R1.15117 CCCC(=O)N(CC)Cc1ccccc1Cl 1626a_100000201176_100000211992 [0,0,0,0,0,1|1,0,2]=4 923 B16R1.15117 CCCC(=O)N(CC)Cc1ccccc1Cl 240690a_100000201176_100000211992 [0,0,0,0,0,1|1,0,2]=4 924 B16R1.15117 CCCC(=O)N(CC)Cc1ccccc1Cl 527a_100000201176_100000211992 [0,0,0,0,0,1|1,0,2]=4 925 B16R1.15117 CCCC(=O)N(CC)Cc1ccccc1F 11a_100015186831_100000211992 [0,0,0,0,0,1|1,0,2]=4 926 B16R1.15117 CCCC(=O)N(CC)Cc1ccccc1F 1626a_100015186831_100000211992 [0,0,0,0,0,1|1,0,2]=4 927 B16R1.15117 CCCC(=O)N(CC)Cc1ccccc1F 240690a_100015186831_100000211992 [0,0,0,0,0,1|1,0,2]=4 928 B16R1.15117 CCCC(=O)N(CC)Cc1ccccc1F 527a_100015186831_100000211992 [0,0,0,0,0,1|1,0,2]=4 929 B16R1.15117 CCCC(=O)N(CC)Cc1ccccc1O 240690a_100011223546_100000211992 [0,0,0,0,0,1|1,0,2]=4 930 B16R1.15117 CCCC(=O)N(CC)Cc1ccccc1O 527a_100011223546_100000211992 [0,0,0,0,0,1|1,0,2]=4 931 B16R1.15117 CCN(Cc1ccccc1C)C(=O)C=CBr 1626a_100000201206_100016273825 [0,0,0,0,0,1|1,0,0]=2 932 B16R1.15117 CCN(Cc1ccccc1C)C(=O)C=CBr 240690a_100000201206_100016273825 [0,0,0,0,0,1|1,0,0]=2 933 B16R1.15117 CCN(Cc1ccccc1C)C(=O)C=CCl 11a_100000201206_200016279998 [0,0,0,0,0,1|1,0,0]=2 934 B16R1.15117 CCN(Cc1ccccc1C)C(=O)C=CCl 1626a_100000201206_200016279998 [0,0,0,0,0,1|1,0,0]=2 935 B16R1.15117 CCN(Cc1ccccc1C)C(=O)C=CCl 240690a_100000201206_200016279998 [0,0,0,0,0,1|1,0,0]=2 936 B16R1.15117 CCN(Cc1ccccc1C)C(=O)C=CI 1626a_100000201206_100016256311 [0,0,0,0,0,1|1,0,0]=2 937 B16R1.15117 CCN(Cc1ccccc1C)C(=O)CC#N 1626a_100000201206_100051588842 [0,0,0,0,0,1|1,0,2]=4 938 B16R1.15117 CCN(Cc1ccccc1C)C(=O)CC#N 240690a_100000201206_100051588842 [0,0,0,0,0,1|1,0,2]=4 939 B16R1.15117 CCN(Cc1ccccc1C)C(=O)CCO 240690a_100000201206_100011216618 [0,0,0,0,0,1|1,0,2]=4 940 B16R1.15117 CCN(Cc1ccccc1C)C(=O)COC 11a_100000201206_100000210968 [0,0,0,0,0,1|1,0,1]=3 941 B16R1.15117 CCN(Cc1ccccc1C)C(=O)COC 1626a_100000201206_100000210968 [0,0,0,0,0,1|1,0,1]=3 942 B16R1.15117 CCN(Cc1ccccc1C)C(=O)COC 240690a_100000201206_100000210968 [0,0,0,0,0,1|1,0,1]=3 943 B16R1.15117 CCN(Cc1ccccc1C)C(=O)COC 527a_100000201206_100000210968 [0,0,0,0,0,1|1,0,1]=3 944 B16R1.15117 CCN(Cc1ccccc1C)C(=O)CSC 11a_100000201206_100000184570 [0,0,0,0,0,1|1,0,1]=3 945 B16R1.15117 CCN(Cc1ccccc1C)C(=O)CSC 1626a_100000201206_100000184570 [0,0,0,0,0,1|1,0,1]=3 946 B16R1.15117 CCN(Cc1ccccc1C)C(=O)CSC 240690a_100000201206_100000184570 [0,0,0,0,0,1|1,0,1]=3 947 B16R1.15117 CCN(Cc1ccccc1C)C(=O)CSC 527a_100000201206_100000184570 [0,0,0,0,0,1|1,0,1]=3 948 B16R1.15117 CCN(Cc1ccccc1Cl)C(=O)C=CBr 1626a_100000201176_100016273825 [0,0,0,0,0,1|2,0,0]=3 949 B16R1.15117 CCN(Cc1ccccc1Cl)C(=O)C=CBr 240690a_100000201176_100016273825 [0,0,0,0,0,1|2,0,0]=3 950 B16R1.15117 CCN(Cc1ccccc1Cl)C(=O)C=CCl 11a_100000201176_200016279998 [0,0,0,0,0,1|2,0,0]=3 951 B16R1.15117 CCN(Cc1ccccc1Cl)C(=O)C=CCl 1626a_100000201176_200016279998 [0,0,0,0,0,1|2,0,0]=3 952 B16R1.15117 CCN(Cc1ccccc1Cl)C(=O)C=CCl 240690a_100000201176_200016279998 [0,0,0,0,0,1|2,0,0]=3 953 B16R1.15117 CCN(Cc1ccccc1Cl)C(=O)C=CI 1626a_100000201176_100016256311 [0,0,0,0,0,1|2,0,0]=3 954 B16R1.15117 CCN(Cc1ccccc1Cl)C(=O)COC 11a_100000201176_100000210968 [0,0,0,0,0,1|2,0,1]=4 955 B16R1.15117 CCN(Cc1ccccc1Cl)C(=O)COC 1626a_100000201176_100000210968 [0,0,0,0,0,1|2,0,1]=4 956 B16R1.15117 CCN(Cc1ccccc1Cl)C(=O)COC 240690a_100000201176_100000210968 [0,0,0,0,0,1|2,0,1]=4 957 B16R1.15117 CCN(Cc1ccccc1Cl)C(=O)COC 527a_100000201176_100000210968 [0,0,0,0,0,1|2,0,1]=4 958 B16R1.15117 CCN(Cc1ccccc1Cl)C(=O)CSC 11a_100000201176_100000184570 [0,0,0,0,0,1|2,0,1]=4 959 B16R1.15117 CCN(Cc1ccccc1Cl)C(=O)CSC 1626a_100000201176_100000184570 [0,0,0,0,0,1|2,0,1]=4 960 B16R1.15117 CCN(Cc1ccccc1Cl)C(=O)CSC 240690a_100000201176_100000184570 [0,0,0,0,0,1|2,0,1]=4 961 B16R1.15117 CCN(Cc1ccccc1Cl)C(=O)CSC 527a_100000201176_100000184570 [0,0,0,0,0,1|2,0,1]=4 962 B16R1.15117 CCN(Cc1ccccc1F)C(=O)C=CBr 1626a_100015186831_100016273825 [0,0,0,0,0,1|2,0,0]=3 963 B16R1.15117 CCN(Cc1ccccc1F)C(=O)C=CBr 240690a_100015186831_100016273825 [0,0,0,0,0,1|2,0,0]=3 964 B16R1.15117 CCN(Cc1ccccc1F)C(=O)C=CCl 11a_100015186831_200016279998 [0,0,0,0,0,1|2,0,0]=3 965 B16R1.15117 CCN(Cc1ccccc1F)C(=O)C=CCl 1626a_100015186831_200016279998 [0,0,0,0,0,1|2,0,0]=3 966 B16R1.15117 CCN(Cc1ccccc1F)C(=O)C=CCl 240690a_100015186831_200016279998 [0,0,0,0,0,1|2,0,0]=3 967 B16R1.15117 CCN(Cc1ccccc1F)C(=O)C=CI 1626a_100015186831_100016256311 [0,0,0,0,0,1|2,0,0]=3 968 B16R1.15117 CCN(Cc1ccccc1F)C(=O)COC 11a_100015186831_100000210968 [0,0,0,0,0,1|2,0,1]=4 969 B16R1.15117 CCN(Cc1ccccc1F)C(=O)COC 1626a_100015186831_100000210968 [0,0,0,0,0,1|2,0,1]=4 970 B16R1.15117 CCN(Cc1ccccc1F)C(=O)COC 240690a_100015186831_100000210968 [0,0,0,0,0,1|2,0,1]=4 971 B16R1.15117 CCN(Cc1ccccc1F)C(=O)COC 527a_100015186831_100000210968 [0,0,0,0,0,1|2,0,1]=4 972 B16R1.15117 CCN(Cc1ccccc1F)C(=O)CSC 11a_100015186831_100000184570 [0,0,0,0,0,1|2,0,1]=4 973 B16R1.15117 CCN(Cc1ccccc1F)C(=O)CSC 1626a_100015186831_100000184570 [0,0,0,0,0,1|2,0,1]=4 974 B16R1.15117 CCN(Cc1ccccc1F)C(=O)CSC 240690a_100015186831_100000184570 [0,0,0,0,0,1|2,0,1]=4 975 B16R1.15117 CCN(Cc1ccccc1F)C(=O)CSC 527a_100015186831_100000184570 [0,0,0,0,0,1|2,0,1]=4 976 B16R1.15117 CCN(Cc1ccccc1O)C(=O)C=CBr 240690a_100011223546_100016273825 [0,0,0,0,0,1|2,0,0]=3 977 B16R1.15117 CCN(Cc1ccccc1O)C(=O)C=CCl 240690a_100011223546_200016279998 [0,0,0,0,0,1|2,0,0]=3 978 B16R1.15117 CCN(Cc1ccccc1O)C(=O)COC 240690a_100011223546_100000210968 [0,0,0,0,0,1|2,0,1]=4 979 B16R1.15117 CCN(Cc1ccccc1O)C(=O)COC 527a_100011223546_100000210968 [0,0,0,0,0,1|2,0,1]=4 980 B16R1.15117 CCN(Cc1ccccc1O)C(=O)CSC 240690a_100011223546_100000184570 [0,0,0,0,0,1|2,0,1]=4 981 B16R1.15117 CCN(Cc1ccccc1O)C(=O)CSC 527a_100011223546_100000184570 [0,0,0,0,0,1|2,0,1]=4 982 B16R1.15117 CCNC(=O)N(CC)Cc1ccccc1C 2708a_100015525214_100000201206 [0,0,0,0,0,1|1,0,1]=3 983 B16R1.15117 CCNC(=O)N(CC)Cc1ccccc1C 273464a_100015525214_100000201206 [0,0,0,0,0,1|1,0,1]=3 984 B16R1.15117 CCNC(=O)N(CC)Cc1ccccc1Cl 2708a_100015525214_100000201176 [0,0,0,0,0,1|2,0,1]=4 985 B16R1.15117 CCNC(=O)N(CC)Cc1ccccc1Cl 273464a_100015525214_100000201176 [0,0,0,0,0,1|2,0,1]=4 986 B16R1.15117 CCNC(=O)N(CC)Cc1ccccc1F 2708a_100015525214_100015186831 [0,0,0,0,0,1|2,0,1]=4 987 B16R1.15117 CCNC(=O)N(CC)Cc1ccccc1F 273464a_100015525214_100015186831 [0,0,0,0,0,1|2,0,1]=4 988 B16R1.15117 CCNC(=O)N(CC)Cc1ccccc1O 2708a_100015525214_100011223546 [0,0,0,0,0,1|2,0,1]=4 989 B16R1.15117 CCNC(=O)N(CC)Cc1ccccc1O 273464a_100015525214_100011223546 [0,0,0,0,0,1|2,0,1]=4 990 B16R1.15117 CCOC(=O)C(CC)Nc1ccccc1C 34a_100015192222_100000212269 [0,0,0,0,0,1|2,0,1]=4 991 B16R1.15117 CCOC(=O)C(CC)Oc1ccccc1C 34a_100000210338_100000212269 [0,0,0,0,0,1|2,0,1]=4 992 B16R1.15117 CCOC(=O)C(CC)Oc1ccccc1C 7a_100000210338_100000212269 [0,0,0,0,0,1|2,0,1]=4 993 B16R1.15117 CCOC(=O)C(CC)Sc1ccccc1C 62a_100000210755_100000212269 [0,0,0,0,0,1|2,0,1]=4 994 B16R1.15117 CCOC(=O)C(CC)Sc1ccccc1C 62a_100000212269_100000210755 [0,0,0,0,0,1|2,0,1]=4 995 B13R1.26 C/C=C/CN(CC)c1ccccc1 269982a_100000210013_100102629194 [2,0,0,0,0,0|0,0,1]=3 996 B13R1.26 C/C=C/CN(CC)c1ccccc1 34a_100000210013_100102629194 [2,0,0,0,0,0|0,0,1]=3 997 B13R1.26 CC=CCN(CC)c1ccccc1 2230a_100000210013_100000070051 [2,0,0,0,0,0|0,0,1]=3 998 B13R1.26 CC=CCN(CC)c1ccccc1 34a_100000210013_100000070051 [2,0,0,0,0,0|0,0,1]=3 999 B13R1.47 C=CCC(=O)N(C)c1ccccc1 11a_100000210012_100000210193 [2,0,0,0,0,0|0,0,2]=4 1000 B13R1.47 C=CCC(=O)N(C)c1ccccc1 1626a_100000210012_100000210193 [2,0,0,0,0,0|0,0,2]=4 1001 B13R1.47 C=CCC(=O)N(C)c1ccccc1 22a_100000210012_100000210193 [2,0,0,0,0,0|0,0,2]=4 1002 B13R1.47 CC#CC(=O)N(C)c1ccccc1 22a_100000210012_100000763181 [2,0,0,0,0,0|0,0,2]=4 1003 B13R1.47 CC(C(=O)C=CBr)c1ccccc1 1458a_100016273825_100000230085 [2,0,0,0,0,0|2,0,0]=4 1004 B13R1.47 CC(C(=O)C=CCl)c1ccccc1 1458a_200016279998_100000230085 [2,0,0,0,0,0|2,0,0]=4 1005 B13R1.47 CC(C(=O)C=CI)c1ccccc1 1458a_100016256311_100000230085 [2,0,0,0,0,0|2,0,0]=4 1006 B13R1.47 CC=CC(=O)C(C)c1ccccc1 1458a_100000210699_100000230085 [2,0,0,0,0,0|1,0,0]=3 1007 B13R1.47 CC=CC(=O)N(C)c1ccccc1 11a_100000210012_100000210699 [2,0,0,0,0,0|0,0,0]=2 1008 B13R1.47 CC=CC(=O)N(C)c1ccccc1 1626a_100000210012_100000210699 [2,0,0,0,0,0|0,0,0]=2 1009 B13R1.47 CC=CC(=O)N(C)c1ccccc1 22a_100000210012_100000210699 [2,0,0,0,0,0|0,0,0]=2 1010 B13R1.47 CCCC(=O)N(C)c1ccccc1 11a_100000210012_100000211992 [2,0,0,0,0,0|0,0,2]=4 1011 B13R1.47 CCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000211992 [2,0,0,0,0,0|0,0,2]=4 1012 B13R1.47 CCCC(=O)N(C)c1ccccc1 22a_100000210012_100000211992 [2,0,0,0,0,0|0,0,2]=4 1013 B13R1.47 CCNC(=O)N(C)c1ccccc1 512a_100015525214_100000210012 [2,0,0,0,0,0|1,0,1]=4 1014 B13R1.47 CN(C(=O)C=CBr)c1ccccc1 1626a_100000210012_100016273825 [2,0,0,0,0,0|1,0,0]=3 1015 B13R1.47 CN(C(=O)C=CCl)c1ccccc1 11a_100000210012_200016279998 [2,0,0,0,0,0|1,0,0]=3 1016 B13R1.47 CN(C(=O)C=CCl)c1ccccc1 1626a_100000210012_200016279998 [2,0,0,0,0,0|1,0,0]=3 1017 B13R1.47 CN(C(=O)C=CI)c1ccccc1 1626a_100000210012_100016256311 [2,0,0,0,0,0|1,0,0]=3 1018 B13R1.47 CN(C(=O)CN[13CH3])c1ccccc1 2230a_200000174886_200025704644 [2,0,0,0,0,0|1,0,1]=4 1019 B13R1.47 CN(C(=O)CS[13CH3])c1ccccc1 62a_100000183487_200025704644 [2,0,0,0,0,0|1,0,1]=4 1020 B13R1.47 CN(C(=O)CS[13CH3])c1ccccc1 62a_200025704644_100000183487 [2,0,0,0,0,0|1,0,1]=4 1021 B13R1.47 CNCC(=O)N(C)c1ccccc1 2230a_106832991635_100000183487 [2,0,0,0,0,0|1,0,1]=4 1022 B13R1.47 CNCC(=O)N(C)c1ccccc1 2230a_200000174886_200000210301 [2,0,0,0,0,0|1,0,1]=4 1023 B13R1.47 CNCC(=O)N(C)c1ccccc1 34a_100102657272_100000183487 [2,0,0,0,0,0|1,0,1]=4 1024 B13R1.47 CNCC(=O)N(C)c1ccccc1 7a_106832991635_100000183487 [2,0,0,0,0,0|1,0,1]=4 1025 B13R1.47 CNNC(=O)N(C)c1ccccc1 512a_100016993582_100000210012 [2,0,0,0,0,0|2,0,0]=4 1026 B13R1.47 COCC(=O)N(C)c1ccccc1 11a_100000210012_100000210968 [2,0,0,0,0,0|1,0,1]=4 1027 B13R1.47 COCC(=O)N(C)c1ccccc1 1626a_100000210012_100000210968 [2,0,0,0,0,0|1,0,1]=4 1028 B13R1.47 COCC(=O)N(C)c1ccccc1 22a_100000210012_100000210968 [2,0,0,0,0,0|1,0,1]=4 1029 B13R1.47 COCC(=O)N(C)c1ccccc1 34a_100138415774_100000183487 [2,0,0,0,0,0|1,0,1]=4 1030 B13R1.47 CSCC(=O)N(C)c1ccccc1 11a_100000210012_100000184570 [2,0,0,0,0,0|1,0,1]=4 1031 B13R1.47 CSCC(=O)N(C)c1ccccc1 1626a_100000210012_100000184570 [2,0,0,0,0,0|1,0,1]=4 1032 B13R1.47 CSCC(=O)N(C)c1ccccc1 22a_100000210012_100000184570 [2,0,0,0,0,0|1,0,1]=4 1033 B13R1.47 CSCC(=O)N(C)c1ccccc1 62a_100000183487_200000210301 [2,0,0,0,0,0|1,0,1]=4 1034 B13R1.47 CSCC(=O)N(C)c1ccccc1 62a_200000210301_100000183487 [2,0,0,0,0,0|1,0,1]=4 1035 B13R1.532 C=CC(=O)N(CC)c1ccccc1 1626a_100000210013_100000185746 [2,0,0,0,0,0|0,0,0]=2 1036 B13R1.532 C=CC(=O)N(CC)c1ccccc1 22a_100000210013_100000185746 [2,0,0,0,0,0|0,0,0]=2 1037 B13R1.532 C=CC(C)N(CC)c1ccccc1 269982a_100000210013_100011215867 [2,0,0,0,0,0|1,0,1]=4 1038 B13R1.532 CCC(=O)C(CC)c1ccccc1 1458a_100000211302_100000210202 [2,0,0,0,0,0|1,0,1]=4 1039 B13R1.532 CCC(=O)N(CC)c1ccccc1 11a_100000210013_100000210414 [2,0,0,0,0,0|0,0,1]=3 1040 B13R1.532 CCC(=O)N(CC)c1ccccc1 1626a_100000210013_100000210414 [2,0,0,0,0,0|0,0,1]=3 1041 B13R1.532 CCC(=O)N(CC)c1ccccc1 22a_100000210013_100000210414 [2,0,0,0,0,0|0,0,1]=3 1042 B13R1.532 CCC(C(=O)NC)c1ccccc1 11a_106832991635_100000211302 [2,0,0,0,0,0|2,0,0]=4 1043 B13R1.532 CCC(C(=O)NC)c1ccccc1 1626a_100102657272_100000211302 [2,0,0,0,0,0|2,0,0]=4 1044 B13R1.532 CCC(C(=O)NC)c1ccccc1 240690a_100102657272_100000211302 [2,0,0,0,0,0|2,0,0]=4 1045 B13R1.532 CCC(C(=O)NC)c1ccccc1 527a_100102657272_100000211302 [2,0,0,0,0,0|2,0,0]=4 1046 B13R1.532 CCN(C(=O)CO)c1ccccc1 22a_100000210013_100000210174 [2,0,0,0,0,0|1,0,1]=4 1047 B13R1.173 C=CCN(CC)c1ccccc1Br 2230a_114873767003_100000210623 [2,0,0,0,0,0|1,0,1]=4 1048 B13R1.173 C=CCN(CC)c1ccccc1Br 269982a_114873767003_100000210623 [2,0,0,0,0,0|1,0,1]=4 1049 B13R1.173 C=CCN(CC)c1ccccc1Br 34a_114873767003_100015514636 [2,0,0,0,0,0|1,0,1]=4 1050 B13R1.173 C=CCN(CC)c1ccccc1C 2230a_100000211084_100000210623 [2,0,0,0,0,0|0,0,1]=3 1051 B13R1.173 C=CCN(CC)c1ccccc1C 269982a_100000211084_100000210623 [2,0,0,0,0,0|0,0,1]=3 1052 B13R1.173 C=CCN(CC)c1ccccc1C 34a_100000211084_100015514636 [2,0,0,0,0,0|0,0,1]=3 1053 B13R1.173 C=CCN(CC)c1ccccc1F 2230a_100000220365_100000210623 [2,0,0,0,0,0|1,0,1]=4 1054 B13R1.173 C=CCN(CC)c1ccccc1F 269982a_100000220365_100000210623 [2,0,0,0,0,0|1,0,1]=4 1055 B13R1.173 C=CCN(CC)c1ccccc1F 34a_100000220365_100015514636 [2,0,0,0,0,0|1,0,1]=4 1056 B13R1.173 C=CCN(CC)c1ccccc1O 269982a_103624766699_100000210623 [2,0,0,0,0,0|1,0,1]=4 1057 B13R1.173 CCCN(CC)c1ccccc1C 2230a_100000211084_100000210303 [2,0,0,0,0,0|0,0,2]=4 1058 B13R1.173 CCCN(CC)c1ccccc1C 269982a_100000211084_100000210303 [2,0,0,0,0,0|0,0,2]=4 1059 B13R1.173 CCCN(CC)c1ccccc1C 34a_100000211084_100000210303 [2,0,0,0,0,0|0,0,2]=4 1060 B13R1.173 CCN(CC=O)c1ccccc1C 2230a_100000211084_200015260668 [2,0,0,0,0,0|1,0,1]=4 1061 B13R1.173 CCN(CC=O)c1ccccc1C 269982a_100000211084_200015260668 [2,0,0,0,0,0|1,0,1]=4 1062 B13R1.173 CCN(CC=O)c1ccccc1C 34a_100000211084_200009817547 [2,0,0,0,0,0|1,0,1]=4 1063 B13R1.173 CCN(COC)c1ccccc1C 2230a_100000211084_100000766300 [2,0,0,0,0,0|1,0,1]=4 1064 B13R1.173 CCN(COC)c1ccccc1C 269982a_100000211084_100000766300 [2,0,0,0,0,0|1,0,1]=4 1065 B13R1.173 CCN(CSC)c1ccccc1C 2230a_100000211084_100011218213 [2,0,0,0,0,0|1,0,1]=4 1066 B13R1.173 CCN(CSC)c1ccccc1C 269982a_100000211084_100011218213 [2,0,0,0,0,0|1,0,1]=4 1067 B13R1.173 CCN(CSC)c1ccccc1C 34a_100000211084_100011218213 [2,0,0,0,0,0|1,0,1]=4 1068 B13R1.674 C/C=C/CN(C)c1ccccc1Br 269982a_100020606079_100102629194 [2,0,0,0,0,0|1,0,1]=4 1069 B13R1.674 C/C=C/CN(C)c1ccccc1Br 34a_100020606079_100102629194 [2,0,0,0,0,0|1,0,1]=4 1070 B13R1.674 C/C=C/CN(C)c1ccccc1C 269982a_100000219699_100102629194 [2,0,0,0,0,0|0,0,1]=3 1071 B13R1.674 C/C=C/CN(C)c1ccccc1C 34a_100000219699_100102629194 [2,0,0,0,0,0|0,0,1]=3 1072 B13R1.674 C/C=C/CN(C)c1ccccc1Cl 269982a_100000219374_100102629194 [2,0,0,0,0,0|1,0,1]=4 1073 B13R1.674 C/C=C/CN(C)c1ccccc1Cl 34a_100000219374_100102629194 [2,0,0,0,0,0|1,0,1]=4 1074 B13R1.674 C/C=C/CN(C)c1ccccc1F 269982a_100000220357_100102629194 [2,0,0,0,0,0|1,0,1]=4 1075 B13R1.674 C/C=C/CN(C)c1ccccc1F 34a_100000220357_100102629194 [2,0,0,0,0,0|1,0,1]=4 1076 B13R1.674 C/C=C/CN(C)c1ccccc1O 269982a_100000033821_100102629194 [2,0,0,0,0,0|1,0,1]=4 1077 B13R1.674 CC=CCN(C)c1ccccc1Br 2230a_100020606079_100000070051 [2,0,0,0,0,0|1,0,1]=4 1078 B13R1.674 CC=CCN(C)c1ccccc1Br 34a_100020606079_100000070051 [2,0,0,0,0,0|1,0,1]=4 1079 B13R1.674 CC=CCN(C)c1ccccc1C 2230a_100000219699_100000070051 [2,0,0,0,0,0|0,0,1]=3 1080 B13R1.674 CC=CCN(C)c1ccccc1C 34a_100000219699_100000070051 [2,0,0,0,0,0|0,0,1]=3 1081 B13R1.674 CC=CCN(C)c1ccccc1Cl 2230a_100000219374_100000070051 [2,0,0,0,0,0|1,0,1]=4 1082 B13R1.674 CC=CCN(C)c1ccccc1Cl 34a_100000219374_100000070051 [2,0,0,0,0,0|1,0,1]=4 1083 B13R1.674 CC=CCN(C)c1ccccc1F 2230a_100000220357_100000070051 [2,0,0,0,0,0|1,0,1]=4 1084 B13R1.674 CC=CCN(C)c1ccccc1F 34a_100000220357_100000070051 [2,0,0,0,0,0|1,0,1]=4 1085 B13R1.470 C=CCC(=O)Nc1ccccc1C 11a_100015192222_100000210193 [2,0,0,0,0,0|0,0,2]=4 1086 B13R1.470 C=CCC(=O)Nc1ccccc1C 1626a_100015192222_100000210193 [2,0,0,0,0,0|0,0,2]=4 1087 B13R1.470 C=CCC(=O)Nc1ccccc1C 22a_100015192222_100000210193 [2,0,0,0,0,0|0,0,2]=4 1088 B13R1.470 C=CCC(=O)Nc1ccccc1C 527a_100015192222_100000210193 [2,0,0,0,0,0|0,0,2]=4 1089 B13R1.470 CC#CC(=O)Nc1ccccc1C 22a_100015192222_100000763181 [2,0,0,0,0,0|0,0,2]=4 1090 B13R1.470 CC=CC(=O)Cc1ccccc1Br 1458a_100000210699_100000184730 [2,0,0,0,0,0|2,0,0]=4 1091 B13R1.470 CC=CC(=O)Cc1ccccc1C 1458a_100000210699_100000211839 [2,0,0,0,0,0|1,0,0]=3 1092 B13R1.470 CC=CC(=O)Cc1ccccc1Cl 1458a_100000210699_100000187162 [2,0,0,0,0,0|2,0,0]=4 1093 B13R1.470 CC=CC(=O)Cc1ccccc1F 1458a_100000210699_100000187165 [2,0,0,0,0,0|2,0,0]=4 1094 B13R1.470 CC=CC(=O)Cc1ccccc1I 1458a_100000210699_100011216222 [2,0,0,0,0,0|2,0,0]=4 1095 B13R1.470 CC=CC(=O)Cc1cccnc1C 1458a_100000210699_100000732876 [2,0,0,0,0,0|2,0,0]=4 1096 B13R1.470 CC=CC(=O)Cc1ccncc1C 1458a_100000210699_100020672808 [2,0,0,0,0,0|2,0,0]=4 1097 B13R1.470 CC=CC(=O)Cc1cnccc1C 1458a_100000210699_100000690890 [2,0,0,0,0,0|2,0,0]=4 1098 B13R1.470 CC=CC(=O)Cc1ncccc1C 1458a_100000210699_100000696600 [2,0,0,0,0,0|2,0,0]=4 1099 B13R1.470 CC=CC(=O)Nc1ccccc1Br 11a_100000210017_100000210699 [2,0,0,0,0,0|1,0,0]=3 1100 B13R1.470 CC=CC(=O)Nc1ccccc1Br 1626a_100000210017_100000210699 [2,0,0,0,0,0|1,0,0]=3 1101 B13R1.470 CC=CC(=O)Nc1ccccc1C 11a_100015192222_100000210699 [2,0,0,0,0,0|0,0,0]=2 1102 B13R1.470 CC=CC(=O)Nc1ccccc1C 1626a_100015192222_100000210699 [2,0,0,0,0,0|0,0,0]=2 1103 B13R1.470 CC=CC(=O)Nc1ccccc1C 22a_100015192222_100000210699 [2,0,0,0,0,0|0,0,0]=2 1104 B13R1.470 CC=CC(=O)Nc1ccccc1Cl 11a_100000185783_100000210699 [2,0,0,0,0,0|1,0,0]=3 1105 B13R1.470 CC=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000210699 [2,0,0,0,0,0|1,0,0]=3 1106 B13R1.470 CC=CC(=O)Nc1ccccc1Cl 22a_100000185783_100000210699 [2,0,0,0,0,0|1,0,0]=3 1107 B13R1.470 CC=CC(=O)Nc1ccccc1F 11a_100000210422_100000210699 [2,0,0,0,0,0|1,0,0]=3 1108 B13R1.470 CC=CC(=O)Nc1ccccc1F 1626a_100000210422_100000210699 [2,0,0,0,0,0|1,0,0]=3 1109 B13R1.470 CC=CC(=O)Nc1ccccc1F 22a_100000210422_100000210699 [2,0,0,0,0,0|1,0,0]=3 1110 B13R1.470 CC=CC(=O)Nc1ccccc1I 11a_100000210053_100000210699 [2,0,0,0,0,0|1,0,0]=3 1111 B13R1.470 CC=CC(=O)Nc1ccccc1I 1626a_100000210053_100000210699 [2,0,0,0,0,0|1,0,0]=3 1112 B13R1.470 CC=CC(=O)Nc1ccccc1O 22a_100000185747_100000210699 [2,0,0,0,0,0|1,0,0]=3 1113 B13R1.470 CCCC(=O)Nc1ccccc1C 11a_100015192222_100000211992 [2,0,0,0,0,0|0,0,2]=4 1114 B13R1.470 CCCC(=O)Nc1ccccc1C 1626a_100015192222_100000211992 [2,0,0,0,0,0|0,0,2]=4 1115 B13R1.470 CCCC(=O)Nc1ccccc1C 22a_100015192222_100000211992 [2,0,0,0,0,0|0,0,2]=4 1116 B13R1.470 CCCC(=O)Nc1ccccc1C 527a_100015192222_100000211992 [2,0,0,0,0,0|0,0,2]=4 1117 B13R1.470 CCNC(=O)Nc1ccccc1C 2430a_100015192222_100015525214 [2,0,0,0,0,0|1,0,1]=4 1118 B13R1.470 CNCC(=O)Nc1ccccc1C 2230a_100015186652_200000210301 [2,0,0,0,0,0|1,0,1]=4 1119 B13R1.470 CNCC(=O)Nc1ccccc1C 2230a_106832991635_100000183529 [2,0,0,0,0,0|1,0,1]=4 1120 B13R1.470 CNCC(=O)Nc1ccccc1C 34a_100102657272_100000183529 [2,0,0,0,0,0|1,0,1]=4 1121 B13R1.470 CNCC(=O)Nc1ccccc1C 7a_106832991635_100000183529 [2,0,0,0,0,0|1,0,1]=4 1122 B13R1.470 COCC(=O)Nc1ccccc1C 11a_100015192222_100000210968 [2,0,0,0,0,0|1,0,1]=4 1123 B13R1.470 COCC(=O)Nc1ccccc1C 1626a_100015192222_100000210968 [2,0,0,0,0,0|1,0,1]=4 1124 B13R1.470 COCC(=O)Nc1ccccc1C 22a_100015192222_100000210968 [2,0,0,0,0,0|1,0,1]=4 1125 B13R1.470 COCC(=O)Nc1ccccc1C 34a_100138415774_100000183529 [2,0,0,0,0,0|1,0,1]=4 1126 B13R1.470 COCC(=O)Nc1ccccc1C 527a_100015192222_100000210968 [2,0,0,0,0,0|1,0,1]=4 1127 B13R1.470 CSCC(=O)Nc1ccccc1C 11a_100015192222_100000184570 [2,0,0,0,0,0|1,0,1]=4 1128 B13R1.470 CSCC(=O)Nc1ccccc1C 1626a_100015192222_100000184570 [2,0,0,0,0,0|1,0,1]=4 1129 B13R1.470 CSCC(=O)Nc1ccccc1C 22a_100015192222_100000184570 [2,0,0,0,0,0|1,0,1]=4 1130 B13R1.470 CSCC(=O)Nc1ccccc1C 527a_100015192222_100000184570 [2,0,0,0,0,0|1,0,1]=4 1131 B13R1.470 CSCC(=O)Nc1ccccc1C 62a_200000210301_100000183529 [2,0,0,0,0,0|1,0,1]=4 1132 B13R1.470 Cc1ccccc1CC(=O)C=CBr 1458a_100016273825_100000211839 [2,0,0,0,0,0|2,0,0]=4 1133 B13R1.470 Cc1ccccc1CC(=O)C=CCl 1458a_200016279998_100000211839 [2,0,0,0,0,0|2,0,0]=4 1134 B13R1.470 Cc1ccccc1CC(=O)C=CI 1458a_100016256311_100000211839 [2,0,0,0,0,0|2,0,0]=4 1135 B13R1.470 Cc1ccccc1NC(=O)C=CBr 1626a_100015192222_100016273825 [2,0,0,0,0,0|1,0,0]=3 1136 B13R1.470 Cc1ccccc1NC(=O)C=CCl 11a_100015192222_200016279998 [2,0,0,0,0,0|1,0,0]=3 1137 B13R1.470 Cc1ccccc1NC(=O)C=CCl 1626a_100015192222_200016279998 [2,0,0,0,0,0|1,0,0]=3 1138 B13R1.470 Cc1ccccc1NC(=O)C=CI 1626a_100015192222_100016256311 [2,0,0,0,0,0|1,0,0]=3 1139 B13R1.470 Cc1ccccc1NC(=O)CN[13CH3] 2230a_100015186652_200025704644 [2,0,0,0,0,0|1,0,1]=4 1140 B13R1.470 Cc1ccccc1NC(=O)CS[13CH3] 62a_200025704644_100000183529 [2,0,0,0,0,0|1,0,1]=4 1141 B13R1.470 O=C(C=CBr)Nc1ccccc1Br 1626a_100000210017_100016273825 [2,0,0,0,0,0|2,0,0]=4 1142 B13R1.470 O=C(C=CBr)Nc1ccccc1Cl 1626a_100000185783_100016273825 [2,0,0,0,0,0|2,0,0]=4 1143 B13R1.470 O=C(C=CBr)Nc1ccccc1F 1626a_100000210422_100016273825 [2,0,0,0,0,0|2,0,0]=4 1144 B13R1.470 O=C(C=CBr)Nc1ccccc1I 1626a_100000210053_100016273825 [2,0,0,0,0,0|2,0,0]=4 1145 B13R1.470 O=C(C=CCl)Nc1ccccc1Br 11a_100000210017_200016279998 [2,0,0,0,0,0|2,0,0]=4 1146 B13R1.470 O=C(C=CCl)Nc1ccccc1Br 1626a_100000210017_200016279998 [2,0,0,0,0,0|2,0,0]=4 1147 B13R1.470 O=C(C=CCl)Nc1ccccc1Cl 11a_100000185783_200016279998 [2,0,0,0,0,0|2,0,0]=4 1148 B13R1.470 O=C(C=CCl)Nc1ccccc1Cl 1626a_100000185783_200016279998 [2,0,0,0,0,0|2,0,0]=4 1149 B13R1.470 O=C(C=CCl)Nc1ccccc1F 11a_100000210422_200016279998 [2,0,0,0,0,0|2,0,0]=4 1150 B13R1.470 O=C(C=CCl)Nc1ccccc1F 1626a_100000210422_200016279998 [2,0,0,0,0,0|2,0,0]=4 1151 B13R1.470 O=C(C=CCl)Nc1ccccc1I 11a_100000210053_200016279998 [2,0,0,0,0,0|2,0,0]=4 1152 B13R1.470 O=C(C=CCl)Nc1ccccc1I 1626a_100000210053_200016279998 [2,0,0,0,0,0|2,0,0]=4 1153 B13R1.470 O=C(C=CI)Nc1ccccc1Br 1626a_100000210017_100016256311 [2,0,0,0,0,0|2,0,0]=4 1154 B13R1.470 O=C(C=CI)Nc1ccccc1Cl 1626a_100000185783_100016256311 [2,0,0,0,0,0|2,0,0]=4 1155 B13R1.470 O=C(C=CI)Nc1ccccc1F 1626a_100000210422_100016256311 [2,0,0,0,0,0|2,0,0]=4 1156 B13R1.470 O=C(C=CI)Nc1ccccc1I 1626a_100000210053_100016256311 [2,0,0,0,0,0|2,0,0]=4 1157 B13R1.696 C=CC(=O)C(C)c1ccccc1Cl 1458a_100000185746_100000181259 [2,0,0,0,0,0|2,0,0]=4 1158 B13R1.696 C=CC(=O)C(C)c1ccccc1F 1458a_100000185746_200000741388 [2,0,0,0,0,0|2,0,0]=4 1159 B13R1.696 C=CC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000185746 [2,0,0,0,0,0|1,0,0]=3 1160 B13R1.696 C=CC(=O)N(C)c1ccccc1C 1626a_100000219699_100000185746 [2,0,0,0,0,0|0,0,0]=2 1161 B13R1.696 C=CC(=O)N(C)c1ccccc1C 22a_100000219699_100000185746 [2,0,0,0,0,0|0,0,0]=2 1162 B13R1.696 C=CC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000185746 [2,0,0,0,0,0|1,0,0]=3 1163 B13R1.696 C=CC(=O)N(C)c1ccccc1F 1626a_100000220357_100000185746 [2,0,0,0,0,0|1,0,0]=3 1164 B13R1.696 C=CC(=O)N(C)c1ccccc1F 22a_100000220357_100000185746 [2,0,0,0,0,0|1,0,0]=3 1165 B13R1.696 C=CC(=O)N(C)c1ccccc1O 22a_100000033821_100000185746 [2,0,0,0,0,0|1,0,0]=3 1166 B13R1.696 C=CC(C)N(C)c1ccccc1C 269982a_100000219699_100011215867 [2,0,0,0,0,0|1,0,1]=4 1167 B13R1.696 CCC(=O)N(C)c1ccccc1Br 11a_100020606079_100000210414 [2,0,0,0,0,0|1,0,1]=4 1168 B13R1.696 CCC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000210414 [2,0,0,0,0,0|1,0,1]=4 1169 B13R1.696 CCC(=O)N(C)c1ccccc1C 11a_100000219699_100000210414 [2,0,0,0,0,0|0,0,1]=3 1170 B13R1.696 CCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000210414 [2,0,0,0,0,0|0,0,1]=3 1171 B13R1.696 CCC(=O)N(C)c1ccccc1C 22a_100000219699_100000210414 [2,0,0,0,0,0|0,0,1]=3 1172 B13R1.696 CCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000210414 [2,0,0,0,0,0|1,0,1]=4 1173 B13R1.696 CCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000210414 [2,0,0,0,0,0|1,0,1]=4 1174 B13R1.696 CCC(=O)N(C)c1ccccc1F 11a_100000220357_100000210414 [2,0,0,0,0,0|1,0,1]=4 1175 B13R1.696 CCC(=O)N(C)c1ccccc1F 1626a_100000220357_100000210414 [2,0,0,0,0,0|1,0,1]=4 1176 B13R1.696 CCC(=O)N(C)c1ccccc1F 22a_100000220357_100000210414 [2,0,0,0,0,0|1,0,1]=4 1177 B13R1.696 CCC(=O)N(C)c1ccccc1O 22a_100000033821_100000210414 [2,0,0,0,0,0|1,0,1]=4 1178 B13R1.696 CCC(=O)N(C)c1ccccc1O 527a_100000033821_100000210414 [2,0,0,0,0,0|1,0,1]=4 1179 B13R1.696 CNC(=O)N(C)c1ccccc1Br 512a_106832991638_100020606079 [2,0,0,0,0,0|2,0,0]=4 1180 B13R1.696 CNC(=O)N(C)c1ccccc1C 512a_106832991638_100000219699 [2,0,0,0,0,0|1,0,0]=3 1181 B13R1.696 CNC(=O)N(C)c1ccccc1Cl 512a_106832991638_100000219374 [2,0,0,0,0,0|2,0,0]=4 1182 B13R1.696 Cc1ccccc1N(C)C(=O)CO 22a_100000219699_100000210174 [2,0,0,0,0,0|1,0,1]=4 1183 B13R1.720 CCC(C(=O)C)c1ccccc1Cl 1458a_100011667493_200000210301 [2,0,0,0,0,0|2,0,0]=4 1184 B13R1.720 CCC(C(=O)[13CH3])c1ccccc1Cl 1458a_100011667493_200025704644 [2,0,0,0,0,0|2,0,0]=4 1185 B13R1.720 CCN(C(=O)C)c1ccccc1Br 11a_114873767003_100015343762 [2,0,0,0,0,0|1,0,0]=3 1186 B13R1.720 CCN(C(=O)C)c1ccccc1Br 1626a_114873767003_100015343762 [2,0,0,0,0,0|1,0,0]=3 1187 B13R1.720 CCN(C(=O)C)c1ccccc1C 11a_100000211084_100015343762 [2,0,0,0,0,0|0,0,0]=2 1188 B13R1.720 CCN(C(=O)C)c1ccccc1C 1626a_100000211084_100015343762 [2,0,0,0,0,0|0,0,0]=2 1189 B13R1.720 CCN(C(=O)C)c1ccccc1C 22a_100000211084_100000070787 [2,0,0,0,0,0|0,0,0]=2 1190 B13R1.720 CCN(C(=O)C)c1ccccc1F 11a_100000220365_100015343762 [2,0,0,0,0,0|1,0,0]=3 1191 B13R1.720 CCN(C(=O)C)c1ccccc1F 1626a_100000220365_100015343762 [2,0,0,0,0,0|1,0,0]=3 1192 B13R1.720 CCN(C(=O)C)c1ccccc1O 22a_103624766699_100000070787 [2,0,0,0,0,0|1,0,0]=3 1193 B13R1.720 CCN(c1ccccc1C)C(C)C 2230a_100000211084_100000210206 [2,0,0,0,0,0|1,0,1]=4 1194 B13R1.720 CCN(c1ccccc1C)C(C)C 2230a_100000219700_100000210202 [2,0,0,0,0,0|1,0,1]=4 1195 B13R1.720 CCN(c1ccccc1C)C(C)C 269982a_100000211084_100000210206 [2,0,0,0,0,0|1,0,1]=4 1196 B13R1.720 CCN(c1ccccc1C)C(C)C 269982a_100000219700_100000204670 [2,0,0,0,0,0|1,0,1]=4 1197 B13R1.720 CCN(c1ccccc1C)C(C)C 34a_100000211084_100000210206 [2,0,0,0,0,0|1,0,1]=4 1198 B13R1.720 CCN(c1ccccc1C)C(C)C 34a_100000219700_100000210202 [2,0,0,0,0,0|1,0,1]=4 1199 B13R1.720 CCN(c1ccccc1C)C(C)C 7a_100000219700_100000210202 [2,0,0,0,0,0|1,0,1]=4 1200 B13R1.720 COC(C(=O)C)c1ccccc1C 1458a_100012277922_200000210301 [2,0,0,0,0,0|2,0,0]=4 1201 B13R1.720 COC(C(=O)[13CH3])c1ccccc1C 1458a_100012277922_200025704644 [2,0,0,0,0,0|2,0,0]=4 1202 B15R1.769 C=CCC(=O)N(CC)c1ccc(cc1)Br 11a_100000219632_100000210193 [1,1,0,0,0,0|0,0,2]=4 1203 B15R1.769 C=CCC(=O)N(CC)c1ccc(cc1)Br 1626a_100000219632_100000210193 [1,1,0,0,0,0|0,0,2]=4 1204 B15R1.769 C=CCC(=O)N(CC)c1ccc(cc1)Br 22a_100000219632_100000210193 [1,1,0,0,0,0|0,0,2]=4 1205 B15R1.769 C=CCC(=O)N(CC)c1ccc(cc1)C 11a_100000219985_100000210193 [1,1,0,0,0,0|0,0,2]=4 1206 B15R1.769 C=CCC(=O)N(CC)c1ccc(cc1)C 1626a_100000219985_100000210193 [1,1,0,0,0,0|0,0,2]=4 1207 B15R1.769 C=CCC(=O)N(CC)c1ccc(cc1)C 22a_100000219985_100000210193 [1,1,0,0,0,0|0,0,2]=4 1208 B15R1.769 C=CCC(=O)N(CC)c1ccc(cc1)Cl 11a_100000220165_100000210193 [1,1,0,0,0,0|0,0,2]=4 1209 B15R1.769 C=CCC(=O)N(CC)c1ccc(cc1)Cl 1626a_100000220165_100000210193 [1,1,0,0,0,0|0,0,2]=4 1210 B15R1.769 C=CCC(=O)N(CC)c1ccc(cc1)Cl 22a_100000220165_100000210193 [1,1,0,0,0,0|0,0,2]=4 1211 B15R1.769 C=CCC(=O)N(CC)c1ccc(cc1)F 11a_100102640331_100000210193 [1,1,0,0,0,0|0,0,2]=4 1212 B15R1.769 C=CCC(=O)N(CC)c1ccc(cc1)F 1626a_100102640331_100000210193 [1,1,0,0,0,0|0,0,2]=4 1213 B15R1.769 C=CCC(=O)N(CC)c1ccc(cc1)F 22a_100102640331_100000210193 [1,1,0,0,0,0|0,0,2]=4 1214 B15R1.769 C=CCC(=O)N(CC)c1ccc(cc1)O 22a_100011337800_100000210193 [1,1,0,0,0,0|0,0,2]=4 1215 B15R1.769 CC#CC(=O)N(CC)c1ccc(cc1)Br 22a_100000219632_100000763181 [1,1,0,0,0,0|0,0,2]=4 1216 B15R1.769 CC#CC(=O)N(CC)c1ccc(cc1)C 22a_100000219985_100000763181 [1,1,0,0,0,0|0,0,2]=4 1217 B15R1.769 CC#CC(=O)N(CC)c1ccc(cc1)Cl 22a_100000220165_100000763181 [1,1,0,0,0,0|0,0,2]=4 1218 B15R1.769 CC#CC(=O)N(CC)c1ccc(cc1)F 22a_100102640331_100000763181 [1,1,0,0,0,0|0,0,2]=4 1219 B15R1.769 CC#CC(=O)N(CC)c1ccc(cc1)O 22a_100011337800_100000763181 [1,1,0,0,0,0|0,0,2]=4 1220 B15R1.769 CC=CC(=O)N(CC)c1ccc(cc1)Br 11a_100000219632_100000210699 [1,1,0,0,0,0|0,0,0]=2 1221 B15R1.769 CC=CC(=O)N(CC)c1ccc(cc1)Br 1626a_100000219632_100000210699 [1,1,0,0,0,0|0,0,0]=2 1222 B15R1.769 CC=CC(=O)N(CC)c1ccc(cc1)Br 22a_100000219632_100000210699 [1,1,0,0,0,0|0,0,0]=2 1223 B15R1.769 CC=CC(=O)N(CC)c1ccc(cc1)C 11a_100000219985_100000210699 [1,1,0,0,0,0|0,0,0]=2 1224 B15R1.769 CC=CC(=O)N(CC)c1ccc(cc1)C 1626a_100000219985_100000210699 [1,1,0,0,0,0|0,0,0]=2 1225 B15R1.769 CC=CC(=O)N(CC)c1ccc(cc1)C 22a_100000219985_100000210699 [1,1,0,0,0,0|0,0,0]=2 1226 B15R1.769 CC=CC(=O)N(CC)c1ccc(cc1)Cl 11a_100000220165_100000210699 [1,1,0,0,0,0|0,0,0]=2 1227 B15R1.769 CC=CC(=O)N(CC)c1ccc(cc1)Cl 1626a_100000220165_100000210699 [1,1,0,0,0,0|0,0,0]=2 1228 B15R1.769 CC=CC(=O)N(CC)c1ccc(cc1)Cl 22a_100000220165_100000210699 [1,1,0,0,0,0|0,0,0]=2 1229 B15R1.769 CC=CC(=O)N(CC)c1ccc(cc1)F 11a_100102640331_100000210699 [1,1,0,0,0,0|0,0,0]=2 1230 B15R1.769 CC=CC(=O)N(CC)c1ccc(cc1)F 1626a_100102640331_100000210699 [1,1,0,0,0,0|0,0,0]=2 1231 B15R1.769 CC=CC(=O)N(CC)c1ccc(cc1)F 22a_100102640331_100000210699 [1,1,0,0,0,0|0,0,0]=2 1232 B15R1.769 CC=CC(=O)N(CC)c1ccc(cc1)O 22a_100011337800_100000210699 [1,1,0,0,0,0|0,0,0]=2 1233 B15R1.769 CCCC(=O)N(CC)c1ccc(cc1)Br 11a_100000219632_100000211992 [1,1,0,0,0,0|0,0,2]=4 1234 B15R1.769 CCCC(=O)N(CC)c1ccc(cc1)Br 1626a_100000219632_100000211992 [1,1,0,0,0,0|0,0,2]=4 1235 B15R1.769 CCCC(=O)N(CC)c1ccc(cc1)Br 22a_100000219632_100000211992 [1,1,0,0,0,0|0,0,2]=4 1236 B15R1.769 CCCC(=O)N(CC)c1ccc(cc1)C 11a_100000219985_100000211992 [1,1,0,0,0,0|0,0,2]=4 1237 B15R1.769 CCCC(=O)N(CC)c1ccc(cc1)C 1626a_100000219985_100000211992 [1,1,0,0,0,0|0,0,2]=4 1238 B15R1.769 CCCC(=O)N(CC)c1ccc(cc1)C 22a_100000219985_100000211992 [1,1,0,0,0,0|0,0,2]=4 1239 B15R1.769 CCCC(=O)N(CC)c1ccc(cc1)Cl 11a_100000220165_100000211992 [1,1,0,0,0,0|0,0,2]=4 1240 B15R1.769 CCCC(=O)N(CC)c1ccc(cc1)Cl 1626a_100000220165_100000211992 [1,1,0,0,0,0|0,0,2]=4 1241 B15R1.769 CCCC(=O)N(CC)c1ccc(cc1)Cl 22a_100000220165_100000211992 [1,1,0,0,0,0|0,0,2]=4 1242 B15R1.769 CCCC(=O)N(CC)c1ccc(cc1)F 11a_100102640331_100000211992 [1,1,0,0,0,0|0,0,2]=4 1243 B15R1.769 CCCC(=O)N(CC)c1ccc(cc1)F 1626a_100102640331_100000211992 [1,1,0,0,0,0|0,0,2]=4 1244 B15R1.769 CCCC(=O)N(CC)c1ccc(cc1)F 22a_100102640331_100000211992 [1,1,0,0,0,0|0,0,2]=4 1245 B15R1.769 CCCC(=O)N(CC)c1ccc(cc1)O 22a_100011337800_100000211992 [1,1,0,0,0,0|0,0,2]=4 1246 B15R1.769 CCN(C(=O)C=CBr)c1ccc(cc1)Br 1626a_100000219632_100016273825 [1,1,0,0,0,0|1,0,0]=3 1247 B15R1.769 CCN(C(=O)C=CBr)c1ccc(cc1)C 1626a_100000219985_100016273825 [1,1,0,0,0,0|1,0,0]=3 1248 B15R1.769 CCN(C(=O)C=CBr)c1ccc(cc1)Cl 1626a_100000220165_100016273825 [1,1,0,0,0,0|1,0,0]=3 1249 B15R1.769 CCN(C(=O)C=CBr)c1ccc(cc1)F 1626a_100102640331_100016273825 [1,1,0,0,0,0|1,0,0]=3 1250 B15R1.769 CCN(C(=O)C=CCl)c1ccc(cc1)Br 11a_100000219632_200016279998 [1,1,0,0,0,0|1,0,0]=3 1251 B15R1.769 CCN(C(=O)C=CCl)c1ccc(cc1)Br 1626a_100000219632_200016279998 [1,1,0,0,0,0|1,0,0]=3 1252 B15R1.769 CCN(C(=O)C=CCl)c1ccc(cc1)C 11a_100000219985_200016279998 [1,1,0,0,0,0|1,0,0]=3 1253 B15R1.769 CCN(C(=O)C=CCl)c1ccc(cc1)C 1626a_100000219985_200016279998 [1,1,0,0,0,0|1,0,0]=3 1254 B15R1.769 CCN(C(=O)C=CCl)c1ccc(cc1)Cl 11a_100000220165_200016279998 [1,1,0,0,0,0|1,0,0]=3 1255 B15R1.769 CCN(C(=O)C=CCl)c1ccc(cc1)Cl 1626a_100000220165_200016279998 [1,1,0,0,0,0|1,0,0]=3 1256 B15R1.769 CCN(C(=O)C=CCl)c1ccc(cc1)F 11a_100102640331_200016279998 [1,1,0,0,0,0|1,0,0]=3 1257 B15R1.769 CCN(C(=O)C=CCl)c1ccc(cc1)F 1626a_100102640331_200016279998 [1,1,0,0,0,0|1,0,0]=3 1258 B15R1.769 CCN(C(=O)C=CI)c1ccc(cc1)Br 1626a_100000219632_100016256311 [1,1,0,0,0,0|1,0,0]=3 1259 B15R1.769 CCN(C(=O)C=CI)c1ccc(cc1)C 1626a_100000219985_100016256311 [1,1,0,0,0,0|1,0,0]=3 1260 B15R1.769 CCN(C(=O)C=CI)c1ccc(cc1)Cl 1626a_100000220165_100016256311 [1,1,0,0,0,0|1,0,0]=3 1261 B15R1.769 CCN(C(=O)C=CI)c1ccc(cc1)F 1626a_100102640331_100016256311 [1,1,0,0,0,0|1,0,0]=3 1262 B15R1.769 CCN(C(=O)COC)c1ccc(cc1)Br 11a_100000219632_100000210968 [1,1,0,0,0,0|1,0,1]=4 1263 B15R1.769 CCN(C(=O)COC)c1ccc(cc1)Br 1626a_100000219632_100000210968 [1,1,0,0,0,0|1,0,1]=4 1264 B15R1.769 CCN(C(=O)COC)c1ccc(cc1)Br 22a_100000219632_100000210968 [1,1,0,0,0,0|1,0,1]=4 1265 B15R1.769 CCN(C(=O)COC)c1ccc(cc1)C 11a_100000219985_100000210968 [1,1,0,0,0,0|1,0,1]=4 1266 B15R1.769 CCN(C(=O)COC)c1ccc(cc1)C 1626a_100000219985_100000210968 [1,1,0,0,0,0|1,0,1]=4 1267 B15R1.769 CCN(C(=O)COC)c1ccc(cc1)C 22a_100000219985_100000210968 [1,1,0,0,0,0|1,0,1]=4 1268 B15R1.769 CCN(C(=O)COC)c1ccc(cc1)Cl 11a_100000220165_100000210968 [1,1,0,0,0,0|1,0,1]=4 1269 B15R1.769 CCN(C(=O)COC)c1ccc(cc1)Cl 1626a_100000220165_100000210968 [1,1,0,0,0,0|1,0,1]=4 1270 B15R1.769 CCN(C(=O)COC)c1ccc(cc1)Cl 22a_100000220165_100000210968 [1,1,0,0,0,0|1,0,1]=4 1271 B15R1.769 CCN(C(=O)COC)c1ccc(cc1)F 11a_100102640331_100000210968 [1,1,0,0,0,0|1,0,1]=4 1272 B15R1.769 CCN(C(=O)COC)c1ccc(cc1)F 1626a_100102640331_100000210968 [1,1,0,0,0,0|1,0,1]=4 1273 B15R1.769 CCN(C(=O)COC)c1ccc(cc1)F 22a_100102640331_100000210968 [1,1,0,0,0,0|1,0,1]=4 1274 B15R1.769 CCN(C(=O)COC)c1ccc(cc1)O 22a_100011337800_100000210968 [1,1,0,0,0,0|1,0,1]=4 1275 B15R1.769 CCN(C(=O)CSC)c1ccc(cc1)Br 11a_100000219632_100000184570 [1,1,0,0,0,0|1,0,1]=4 1276 B15R1.769 CCN(C(=O)CSC)c1ccc(cc1)Br 1626a_100000219632_100000184570 [1,1,0,0,0,0|1,0,1]=4 1277 B15R1.769 CCN(C(=O)CSC)c1ccc(cc1)Br 22a_100000219632_100000184570 [1,1,0,0,0,0|1,0,1]=4 1278 B15R1.769 CCN(C(=O)CSC)c1ccc(cc1)C 11a_100000219985_100000184570 [1,1,0,0,0,0|1,0,1]=4 1279 B15R1.769 CCN(C(=O)CSC)c1ccc(cc1)C 1626a_100000219985_100000184570 [1,1,0,0,0,0|1,0,1]=4 1280 B15R1.769 CCN(C(=O)CSC)c1ccc(cc1)C 22a_100000219985_100000184570 [1,1,0,0,0,0|1,0,1]=4 1281 B15R1.769 CCN(C(=O)CSC)c1ccc(cc1)Cl 11a_100000220165_100000184570 [1,1,0,0,0,0|1,0,1]=4 1282 B15R1.769 CCN(C(=O)CSC)c1ccc(cc1)Cl 1626a_100000220165_100000184570 [1,1,0,0,0,0|1,0,1]=4 1283 B15R1.769 CCN(C(=O)CSC)c1ccc(cc1)Cl 22a_100000220165_100000184570 [1,1,0,0,0,0|1,0,1]=4 1284 B15R1.769 CCN(C(=O)CSC)c1ccc(cc1)F 11a_100102640331_100000184570 [1,1,0,0,0,0|1,0,1]=4 1285 B15R1.769 CCN(C(=O)CSC)c1ccc(cc1)F 1626a_100102640331_100000184570 [1,1,0,0,0,0|1,0,1]=4 1286 B15R1.769 CCN(C(=O)CSC)c1ccc(cc1)F 22a_100102640331_100000184570 [1,1,0,0,0,0|1,0,1]=4 1287 B15R1.769 CCN(C(=O)CSC)c1ccc(cc1)O 22a_100011337800_100000184570 [1,1,0,0,0,0|1,0,1]=4 1288 B15R1.769 CCN(C(=O)NNC)c1ccc(cc1)Br 512a_100000219632_100016993582 [1,1,0,0,0,0|2,0,0]=4 1289 B15R1.769 CCNC(=O)N(CC)c1ccc(cc1)Br 512a_100000219632_100015525214 [1,1,0,0,0,0|1,0,1]=4 1290 B15R1.770 C=CCC(=O)N(CC)c1cccc(c1)Br 11a_100000738899_100000210193 [1,1,0,0,0,0|0,0,2]=4 1291 B15R1.770 C=CCC(=O)N(CC)c1cccc(c1)Br 1626a_100000738899_100000210193 [1,1,0,0,0,0|0,0,2]=4 1292 B15R1.770 C=CCC(=O)N(CC)c1cccc(c1)Br 22a_100000738899_100000210193 [1,1,0,0,0,0|0,0,2]=4 1293 B15R1.770 C=CCC(=O)N(CC)c1cccc(c1)C 11a_100000182157_100000210193 [1,1,0,0,0,0|0,0,2]=4 1294 B15R1.770 C=CCC(=O)N(CC)c1cccc(c1)C 1626a_100000182157_100000210193 [1,1,0,0,0,0|0,0,2]=4 1295 B15R1.770 C=CCC(=O)N(CC)c1cccc(c1)C 22a_100000182157_100000210193 [1,1,0,0,0,0|0,0,2]=4 1296 B15R1.770 C=CCC(=O)N(CC)c1cccc(c1)O 1626a_100000717746_100000210193 [1,1,0,0,0,0|0,0,2]=4 1297 B15R1.770 CC#CC(=O)N(CC)c1cccc(c1)Br 22a_100000738899_100000763181 [1,1,0,0,0,0|0,0,2]=4 1298 B15R1.770 CC#CC(=O)N(CC)c1cccc(c1)C 22a_100000182157_100000763181 [1,1,0,0,0,0|0,0,2]=4 1299 B15R1.770 CC=CC(=O)N(CC)c1cccc(c1)Br 11a_100000738899_100000210699 [1,1,0,0,0,0|0,0,0]=2 1300 B15R1.770 CC=CC(=O)N(CC)c1cccc(c1)Br 1626a_100000738899_100000210699 [1,1,0,0,0,0|0,0,0]=2 1301 B15R1.770 CC=CC(=O)N(CC)c1cccc(c1)Br 22a_100000738899_100000210699 [1,1,0,0,0,0|0,0,0]=2 1302 B15R1.770 CC=CC(=O)N(CC)c1cccc(c1)C 11a_100000182157_100000210699 [1,1,0,0,0,0|0,0,0]=2 1303 B15R1.770 CC=CC(=O)N(CC)c1cccc(c1)C 1626a_100000182157_100000210699 [1,1,0,0,0,0|0,0,0]=2 1304 B15R1.770 CC=CC(=O)N(CC)c1cccc(c1)C 22a_100000182157_100000210699 [1,1,0,0,0,0|0,0,0]=2 1305 B15R1.770 CC=CC(=O)N(CC)c1cccc(c1)O 1626a_100000717746_100000210699 [1,1,0,0,0,0|0,0,0]=2 1306 B15R1.770 CCCC(=O)N(CC)c1cccc(c1)Br 11a_100000738899_100000211992 [1,1,0,0,0,0|0,0,2]=4 1307 B15R1.770 CCCC(=O)N(CC)c1cccc(c1)Br 1626a_100000738899_100000211992 [1,1,0,0,0,0|0,0,2]=4 1308 B15R1.770 CCCC(=O)N(CC)c1cccc(c1)Br 22a_100000738899_100000211992 [1,1,0,0,0,0|0,0,2]=4 1309 B15R1.770 CCCC(=O)N(CC)c1cccc(c1)C 11a_100000182157_100000211992 [1,1,0,0,0,0|0,0,2]=4 1310 B15R1.770 CCCC(=O)N(CC)c1cccc(c1)C 1626a_100000182157_100000211992 [1,1,0,0,0,0|0,0,2]=4 1311 B15R1.770 CCCC(=O)N(CC)c1cccc(c1)C 22a_100000182157_100000211992 [1,1,0,0,0,0|0,0,2]=4 1312 B15R1.770 CCCC(=O)N(CC)c1cccc(c1)O 1626a_100000717746_100000211992 [1,1,0,0,0,0|0,0,2]=4 1313 B15R1.770 CCN(C(=O)C=CBr)c1cccc(c1)Br 1626a_100000738899_100016273825 [1,1,0,0,0,0|1,0,0]=3 1314 B15R1.770 CCN(C(=O)C=CBr)c1cccc(c1)C 1626a_100000182157_100016273825 [1,1,0,0,0,0|1,0,0]=3 1315 B15R1.770 CCN(C(=O)C=CBr)c1cccc(c1)O 1626a_100000717746_100016273825 [1,1,0,0,0,0|1,0,0]=3 1316 B15R1.770 CCN(C(=O)C=CCl)c1cccc(c1)Br 11a_100000738899_200016279998 [1,1,0,0,0,0|1,0,0]=3 1317 B15R1.770 CCN(C(=O)C=CCl)c1cccc(c1)Br 1626a_100000738899_200016279998 [1,1,0,0,0,0|1,0,0]=3 1318 B15R1.770 CCN(C(=O)C=CCl)c1cccc(c1)C 11a_100000182157_200016279998 [1,1,0,0,0,0|1,0,0]=3 1319 B15R1.770 CCN(C(=O)C=CCl)c1cccc(c1)C 1626a_100000182157_200016279998 [1,1,0,0,0,0|1,0,0]=3 1320 B15R1.770 CCN(C(=O)C=CCl)c1cccc(c1)O 1626a_100000717746_200016279998 [1,1,0,0,0,0|1,0,0]=3 1321 B15R1.770 CCN(C(=O)C=CI)c1cccc(c1)Br 1626a_100000738899_100016256311 [1,1,0,0,0,0|1,0,0]=3 1322 B15R1.770 CCN(C(=O)C=CI)c1cccc(c1)C 1626a_100000182157_100016256311 [1,1,0,0,0,0|1,0,0]=3 1323 B15R1.770 CCN(C(=O)C=CI)c1cccc(c1)O 1626a_100000717746_100016256311 [1,1,0,0,0,0|1,0,0]=3 1324 B15R1.770 CCN(C(=O)COC)c1cccc(c1)Br 11a_100000738899_100000210968 [1,1,0,0,0,0|1,0,1]=4 1325 B15R1.770 CCN(C(=O)COC)c1cccc(c1)Br 1626a_100000738899_100000210968 [1,1,0,0,0,0|1,0,1]=4 1326 B15R1.770 CCN(C(=O)COC)c1cccc(c1)Br 22a_100000738899_100000210968 [1,1,0,0,0,0|1,0,1]=4 1327 B15R1.770 CCN(C(=O)COC)c1cccc(c1)C 11a_100000182157_100000210968 [1,1,0,0,0,0|1,0,1]=4 1328 B15R1.770 CCN(C(=O)COC)c1cccc(c1)C 1626a_100000182157_100000210968 [1,1,0,0,0,0|1,0,1]=4 1329 B15R1.770 CCN(C(=O)COC)c1cccc(c1)C 22a_100000182157_100000210968 [1,1,0,0,0,0|1,0,1]=4 1330 B15R1.770 CCN(C(=O)COC)c1cccc(c1)O 1626a_100000717746_100000210968 [1,1,0,0,0,0|1,0,1]=4 1331 B15R1.770 CCN(C(=O)CSC)c1cccc(c1)Br 11a_100000738899_100000184570 [1,1,0,0,0,0|1,0,1]=4 1332 B15R1.770 CCN(C(=O)CSC)c1cccc(c1)Br 1626a_100000738899_100000184570 [1,1,0,0,0,0|1,0,1]=4 1333 B15R1.770 CCN(C(=O)CSC)c1cccc(c1)Br 22a_100000738899_100000184570 [1,1,0,0,0,0|1,0,1]=4 1334 B15R1.770 CCN(C(=O)CSC)c1cccc(c1)C 11a_100000182157_100000184570 [1,1,0,0,0,0|1,0,1]=4 1335 B15R1.770 CCN(C(=O)CSC)c1cccc(c1)C 1626a_100000182157_100000184570 [1,1,0,0,0,0|1,0,1]=4 1336 B15R1.770 CCN(C(=O)CSC)c1cccc(c1)C 22a_100000182157_100000184570 [1,1,0,0,0,0|1,0,1]=4 1337 B15R1.770 CCN(C(=O)CSC)c1cccc(c1)O 1626a_100000717746_100000184570 [1,1,0,0,0,0|1,0,1]=4 1338 B15R1.770 CCN(C(=O)NNC)c1cccc(c1)Br 512a_100000738899_100016993582 [1,1,0,0,0,0|2,0,0]=4 1339 B15R1.770 CCN(C(=O)NNC)c1cccc(c1)C 512a_100000182157_100016993582 [1,1,0,0,0,0|2,0,0]=4 1340 B15R1.770 CCN(C(=O)NNC)c1cccc(c1)O 512a_100000717746_100016993582 [1,1,0,0,0,0|2,0,0]=4 1341 B15R1.770 CCNC(=O)N(CC)c1cccc(c1)Br 512a_100000738899_100015525214 [1,1,0,0,0,0|1,0,1]=4 1342 B15R1.770 CCNC(=O)N(CC)c1cccc(c1)C 512a_100000182157_100015525214 [1,1,0,0,0,0|1,0,1]=4 1343 B15R1.770 CCNC(=O)N(CC)c1cccc(c1)O 512a_100000717746_100015525214 [1,1,0,0,0,0|1,0,1]=4 1344 B15R1.1215 C/C=C/CC(=O)C(CC)c1ccccc1 1458a_100000211302_100102629194 [1,1,0,0,0,0|1,0,0]=3 1345 B15R1.1215 C/C=C/CC(=O)C(CO)c1ccccc1 1458a_100011218805_100102629194 [1,1,0,0,0,0|2,0,0]=4 1346 B15R1.1215 C/C=C/CC(=O)[C@H](OC)c1ccccc1 1458a_100000698336_100102629194 [1,1,0,0,0,0|2,0,0]=4 1347 B15R1.1215 C=CC=CC(=O)N(CC)c1ccccc1 1626a_100000210013_100016291481 [1,1,0,0,0,0|0,0,1]=3 1348 B15R1.1215 C=CC=CC(=O)N(CC)c1ccccc1 22a_100000210013_100016291481 [1,1,0,0,0,0|0,0,1]=3 1349 B15R1.1215 C=CCCC(=O)N(CC)c1ccccc1 11a_100000210013_100000749702 [1,1,0,0,0,0|0,0,2]=4 1350 B15R1.1215 C=CCCC(=O)N(CC)c1ccccc1 1626a_100000210013_100000749702 [1,1,0,0,0,0|0,0,2]=4 1351 B15R1.1215 C=CCCC(=O)N(CC)c1ccccc1 22a_100000210013_100000749702 [1,1,0,0,0,0|0,0,2]=4 1352 B15R1.1215 CC=CCC(=O)C(CC)c1ccccc1 1458a_100000211302_100000070051 [1,1,0,0,0,0|1,0,0]=3 1353 B15R1.1215 CC=CCC(=O)C(CO)c1ccccc1 1458a_100011218805_100000070051 [1,1,0,0,0,0|2,0,0]=4 1354 B15R1.1215 CC=CCC(=O)N(CC)c1ccccc1 11a_100000210013_100121576822 [1,1,0,0,0,0|0,0,0]=2 1355 B15R1.1215 CC=CCC(=O)N(CC)c1ccccc1 1626a_100000210013_100121576822 [1,1,0,0,0,0|0,0,0]=2 1356 B15R1.1215 CC=CCC(=O)N(CC)c1ccccc1 22a_100000210013_100121576822 [1,1,0,0,0,0|0,0,0]=2 1357 B15R1.1215 CC=CCC(=O)[C@H](OC)c1ccccc1 1458a_100000698336_100000070051 [1,1,0,0,0,0|2,0,0]=4 1358 B15R1.1215 CC=NNC(=O)C(CC)c1ccccc1 4a_100000189840_200000210099 [1,1,0,0,0,0|2,0,0]=4 1359 B15R1.1215 CCC#CC(=O)N(CC)c1ccccc1 22a_100000210013_100011827653 [1,1,0,0,0,0|0,0,2]=4 1360 B15R1.1215 CCC=CC(=O)N(CC)c1ccccc1 11a_100000210013_100000212282 [1,1,0,0,0,0|0,0,0]=2 1361 B15R1.1215 CCC=CC(=O)N(CC)c1ccccc1 1626a_100000210013_100000212282 [1,1,0,0,0,0|0,0,0]=2 1362 B15R1.1215 CCC=CC(=O)N(CC)c1ccccc1 22a_100000210013_100000212282 [1,1,0,0,0,0|0,0,0]=2 1363 B15R1.1215 CCCCC(=O)N(CC)c1ccccc1 11a_100000210013_100000210183 [1,1,0,0,0,0|0,0,2]=4 1364 B15R1.1215 CCCCC(=O)N(CC)c1ccccc1 1626a_100000210013_100000210183 [1,1,0,0,0,0|0,0,2]=4 1365 B15R1.1215 CCCCC(=O)N(CC)c1ccccc1 22a_100000210013_100000210183 [1,1,0,0,0,0|0,0,2]=4 1366 B15R1.1215 CCN(C(=O)C=COC)c1ccccc1 1626a_100000210013_100016268678 [1,1,0,0,0,0|0,0,0]=2 1367 B15R1.1215 CCN(C(=O)C=COC)c1ccccc1 22a_100000210013_100016268678 [1,1,0,0,0,0|0,0,0]=2 1368 B15R1.1215 CCN(C(=O)CCNC)c1ccccc1 2230a_106832991635_200011194832 [1,1,0,0,0,0|0,0,2]=4 1369 B15R1.1215 CCN(C(=O)CCNC)c1ccccc1 7a_106832991635_200011194832 [1,1,0,0,0,0|0,0,2]=4 1370 B15R1.1215 CCN(C(=O)CCOC)c1ccccc1 11a_100000210013_100000749529 [1,1,0,0,0,0|0,0,2]=4 1371 B15R1.1215 CCN(C(=O)CCOC)c1ccccc1 1626a_100000210013_100000749529 [1,1,0,0,0,0|0,0,2]=4 1372 B15R1.1215 CCN(C(=O)CCOC)c1ccccc1 22a_100000210013_100000749529 [1,1,0,0,0,0|0,0,2]=4 1373 B15R1.1215 CCN(C(=O)CCSC)c1ccccc1 11a_100000210013_100000174002 [1,1,0,0,0,0|0,0,2]=4 1374 B15R1.1215 CCN(C(=O)CCSC)c1ccccc1 1626a_100000210013_100000174002 [1,1,0,0,0,0|0,0,2]=4 1375 B15R1.1215 CCN(C(=O)CCSC)c1ccccc1 22a_100000210013_100000174002 [1,1,0,0,0,0|0,0,2]=4 1376 B15R1.1215 CCN(C(=O)CCSC)c1ccccc1 62a_200000210301_200011194832 [1,1,0,0,0,0|0,0,2]=4 1377 B15R1.1215 CCN(C(=O)CCS[13CH3])c1ccccc1 62a_200025704644_200011194832 [1,1,0,0,0,0|0,0,2]=4 1378 B15R1.1215 CCN(C(=O)CSCF)c1ccccc1 62a_100015361967_100000183513 [1,1,0,0,0,0|1,0,1]=4 1379 B15R1.1215 CCNCC(=O)N(CC)c1ccccc1 2230a_100015525214_100000183513 [1,1,0,0,0,0|0,0,2]=4 1380 B15R1.1215 CCOCC(=O)N(CC)c1ccccc1 11a_100000210013_100000211967 [1,1,0,0,0,0|0,0,2]=4 1381 B15R1.1215 CCOCC(=O)N(CC)c1ccccc1 1626a_100000210013_100000211967 [1,1,0,0,0,0|0,0,2]=4 1382 B15R1.1215 CCOCC(=O)N(CC)c1ccccc1 22a_100000210013_100000211967 [1,1,0,0,0,0|0,0,2]=4 1383 B15R1.1215 CCOCC(=O)N(CC)c1ccccc1 34a_100121572206_100000183513 [1,1,0,0,0,0|0,0,2]=4 1384 B15R1.1215 CCSCC(=O)N(CC)c1ccccc1 11a_100000210013_100000230394 [1,1,0,0,0,0|0,0,2]=4 1385 B15R1.1215 CCSCC(=O)N(CC)c1ccccc1 1626a_100000210013_100000230394 [1,1,0,0,0,0|0,0,2]=4 1386 B15R1.1215 CCSCC(=O)N(CC)c1ccccc1 22a_100000210013_100000230394 [1,1,0,0,0,0|0,0,2]=4 1387 B15R1.1215 CCSCC(=O)N(CC)c1ccccc1 62a_100000210202_100000183513 [1,1,0,0,0,0|0,0,2]=4 1388 B15R1.1329 C/C=C(\C)/C(=O)N(CC)c1ccccc1 11a_100000210013_100020587367 [1,1,0,0,0,0|0,0,0]=2 1389 B15R1.1329 C/C=C(\C)/C(=O)N(CC)c1ccccc1 1626a_100000210013_100020587367 [1,1,0,0,0,0|0,0,0]=2 1390 B15R1.1329 C/C=C(\C)/C(=O)N(CC)c1ccccc1 22a_100000210013_100020587367 [1,1,0,0,0,0|0,0,0]=2 1391 B15R1.1329 C=C(CO)C(=O)N(CC)c1ccccc1 22a_100000210013_200000705526 [1,1,0,0,0,0|1,0,1]=4 1392 B15R1.1329 C=CC(C)C(=O)N(CC)c1ccccc1 11a_100000210013_100011216780 [1,1,0,0,0,0|0,0,2]=4 1393 B15R1.1329 C=CC(C)C(=O)N(CC)c1ccccc1 1626a_100000210013_100011216780 [1,1,0,0,0,0|0,0,2]=4 1394 B15R1.1329 C=CC(C)C(=O)N(CC)c1ccccc1 22a_100000210013_100011216780 [1,1,0,0,0,0|0,0,2]=4 1395 B15R1.1329 CCC(C)C(=O)N(CC)c1ccccc1 11a_100000210013_100011192722 [1,1,0,0,0,0|0,0,2]=4 1396 B15R1.1329 CCC(C)C(=O)N(CC)c1ccccc1 1626a_100000210013_100011192722 [1,1,0,0,0,0|0,0,2]=4 1397 B15R1.1329 CCC(C)C(=O)N(CC)c1ccccc1 22a_100000210013_100011192722 [1,1,0,0,0,0|0,0,2]=4 1398 B15R1.1329 CCC(O)C(=O)N(CC)c1ccccc1 22a_100000210013_100011196387 [1,1,0,0,0,0|0,0,2]=4 1399 B15R1.1329 CCN(C(=O)C(=O)NC)c1ccccc1 1626a_100000210013_100011218921 [1,1,0,0,0,0|1,0,0]=3 1400 B15R1.1329 CCN(C(=O)C(=O)NC)c1ccccc1 22a_100000210013_100011218921 [1,1,0,0,0,0|1,0,0]=3 1401 B15R1.1329 CCN(C(=O)C(=O)OC)c1ccccc1 11a_100000210013_100000024059 [1,1,0,0,0,0|1,0,0]=3 1402 B15R1.1329 CCN(C(=O)C(=O)OC)c1ccccc1 1626a_100000210013_100000024059 [1,1,0,0,0,0|1,0,0]=3 1403 B15R1.1329 CCN(C(=O)C(C)NC)c1ccccc1 2230a_106832991635_100000181168 [1,1,0,0,0,0|1,0,1]=4 1404 B15R1.1329 CCN(C(=O)C(C)NC)c1ccccc1 34a_100102657272_100000181168 [1,1,0,0,0,0|1,0,1]=4 1405 B15R1.1329 CCN(C(=O)C(C)NC)c1ccccc1 7a_106832991635_100000181168 [1,1,0,0,0,0|1,0,1]=4 1406 B15R1.1329 CCN(C(=O)C(C)OC)c1ccccc1 11a_100000210013_100000743197 [1,1,0,0,0,0|1,0,1]=4 1407 B15R1.1329 CCN(C(=O)C(C)OC)c1ccccc1 1626a_100000210013_100000743197 [1,1,0,0,0,0|1,0,1]=4 1408 B15R1.1329 CCN(C(=O)C(C)OC)c1ccccc1 22a_100000210013_100000743197 [1,1,0,0,0,0|1,0,1]=4 1409 B15R1.1329 CCN(C(=O)C(C)OC)c1ccccc1 34a_100138415774_100000181168 [1,1,0,0,0,0|1,0,1]=4 1410 B15R1.1329 CCN(C(=O)C(C)SC)c1ccccc1 11a_100000210013_100000149566 [1,1,0,0,0,0|1,0,1]=4 1411 B15R1.1329 CCN(C(=O)C(C)SC)c1ccccc1 1626a_100000210013_100000149566 [1,1,0,0,0,0|1,0,1]=4 1412 B15R1.1329 CCN(C(=O)C(C)SC)c1ccccc1 22a_100000210013_100000149566 [1,1,0,0,0,0|1,0,1]=4 1413 B15R1.1329 CCN(C(=O)C(C)SC)c1ccccc1 62a_100000181168_200000210301 [1,1,0,0,0,0|1,0,1]=4 1414 B15R1.1329 CCN(C(=O)C(C)SC)c1ccccc1 62a_200000210301_100000181168 [1,1,0,0,0,0|1,0,1]=4 1415 B15R1.1329 CCN(C(=O)C(C)S[13CH3])c1ccccc1 62a_100000181168_200025704644 [1,1,0,0,0,0|1,0,1]=4 1416 B15R1.1329 CCN(C(=O)C(C)S[13CH3])c1ccccc1 62a_200025704644_100000181168 [1,1,0,0,0,0|1,0,1]=4 1417 B15R1.1350 C=C(C)CC(=O)C(CC)c1ccccc1 1458a_100000211302_100000748629 [1,1,0,0,0,0|1,0,1]=4 1418 B15R1.1350 CCN(C(=O)C=C(C)C)c1ccccc1 11a_100000210013_100000211388 [1,1,0,0,0,0|0,0,0]=2 1419 B15R1.1350 CCN(C(=O)C=C(C)C)c1ccccc1 1626a_100000210013_100000211388 [1,1,0,0,0,0|0,0,0]=2 1420 B15R1.1350 CCN(C(=O)C=C(C)C)c1ccccc1 22a_100000210013_100000211388 [1,1,0,0,0,0|0,0,0]=2 1421 B15R1.1350 CCN(C(=O)C=C(C)Cl)c1ccccc1 11a_100000210013_200042562850 [1,1,0,0,0,0|0,0,0]=2 1422 B15R1.1350 CCN(C(=O)C=C(C)Cl)c1ccccc1 1626a_100000210013_200042562850 [1,1,0,0,0,0|0,0,0]=2 1423 B15R1.1350 CCN(C(=O)C=C(C)Cl)c1ccccc1 22a_100000210013_200042562850 [1,1,0,0,0,0|0,0,0]=2 1424 B15R1.1350 CCN(C(=O)C=C(C)I)c1ccccc1 11a_100000210013_100025716642 [1,1,0,0,0,0|0,0,0]=2 1425 B15R1.1350 CCN(C(=O)C=C(C)I)c1ccccc1 1626a_100000210013_100025716642 [1,1,0,0,0,0|0,0,0]=2 1426 B15R1.1350 CCN(C(=O)C=C(Cl)Cl)c1ccccc1 1626a_100000210013_100000137448 [1,1,0,0,0,0|1,0,0]=3 1427 B15R1.1350 CCN(C(=O)CC(=O)C)c1ccccc1 1458a_100000070787_100000183513 [1,1,0,0,0,0|0,0,1]=3 1428 B15R1.1350 CCN(C(=O)CC(=O)N)c1ccccc1 22a_100000210013_100134613110 [1,1,0,0,0,0|1,0,1]=4 1429 B15R1.1350 CCN(C(=O)CC(C)C)c1ccccc1 11a_100000210013_100000210554 [1,1,0,0,0,0|0,0,2]=4 1430 B15R1.1350 CCN(C(=O)CC(C)C)c1ccccc1 1626a_100000210013_100000210554 [1,1,0,0,0,0|0,0,2]=4 1431 B15R1.1350 CCN(C(=O)CC(C)C)c1ccccc1 22a_100000210013_100000210554 [1,1,0,0,0,0|0,0,2]=4 1432 B15R1.1350 CCN(C(=O)CN(C)C)c1ccccc1 11a_100000210013_100000750896 [1,1,0,0,0,0|1,0,1]=4 1433 B15R1.1350 CCN(C(=O)CN(C)C)c1ccccc1 2230a_100102631434_100000183513 [1,1,0,0,0,0|1,0,1]=4 1434 B15R1.1350 CCN(C(=O)CN(C)C)c1ccccc1 22a_100000210013_100000750896 [1,1,0,0,0,0|1,0,1]=4 1435 B15R1.1350 CCN(C(=O)CN(C)C)c1ccccc1 269982a_100102631434_100000183513 [1,1,0,0,0,0|1,0,1]=4 1436 B15R1.1350 CCN(C(=O)C[C@@H](C)O)c1ccccc1 22a_100000210013_100011933948 [1,1,0,0,0,0|0,0,2]=4 1437 B15R1.1350 CCN(C(=O)C[S+](C)C)c1ccccc1 11a_100000210013_200159257847 [1,1,0,0,0,0|1,0,1]=4 1438 B15R1.1350 CCN(C(=O)C[S+](C)C)c1ccccc1 1626a_100000210013_200159257847 [1,1,0,0,0,0|1,0,1]=4 1439 B15R1.1350 CCN(C(=O)C[S+](C)C)c1ccccc1 22a_100000210013_200159257847 [1,1,0,0,0,0|1,0,1]=4 1440 B15R1.9917 C=CCC(=O)N(CCC)c1ccccc1 11a_200011218496_100000210193 [1,1,0,0,0,0|0,0,2]=4 1441 B15R1.9917 C=CCC(=O)N(CCC)c1ccccc1 1626a_200011218496_100000210193 [1,1,0,0,0,0|0,0,2]=4 1442 B15R1.9917 C=CCC(=O)N(CCC)c1ccccc1 22a_200011218496_100000210193 [1,1,0,0,0,0|0,0,2]=4 1443 B15R1.9917 C=CCC(=O)N(CCO)c1ccccc1 22a_100000211345_100000210193 [1,1,0,0,0,0|0,0,2]=4 1444 B15R1.9917 C=CCN(C(=O)C=CBr)c1ccccc1 1626a_100000211662_100016273825 [1,1,0,0,0,0|1,0,1]=4 1445 B15R1.9917 C=CCN(C(=O)C=CC)c1ccccc1 11a_100000211662_100000210699 [1,1,0,0,0,0|0,0,1]=3 1446 B15R1.9917 C=CCN(C(=O)C=CC)c1ccccc1 1626a_100000211662_100000210699 [1,1,0,0,0,0|0,0,1]=3 1447 B15R1.9917 C=CCN(C(=O)C=CC)c1ccccc1 22a_100000211662_100000210699 [1,1,0,0,0,0|0,0,1]=3 1448 B15R1.9917 C=CCN(C(=O)C=CCl)c1ccccc1 11a_100000211662_200016279998 [1,1,0,0,0,0|1,0,1]=4 1449 B15R1.9917 C=CCN(C(=O)C=CCl)c1ccccc1 1626a_100000211662_200016279998 [1,1,0,0,0,0|1,0,1]=4 1450 B15R1.9917 C=CCN(C(=O)C=CI)c1ccccc1 1626a_100000211662_100016256311 [1,1,0,0,0,0|1,0,1]=4 1451 B15R1.9917 CC#CC(=O)N(CCC)c1ccccc1 22a_200011218496_100000763181 [1,1,0,0,0,0|0,0,2]=4 1452 B15R1.9917 CC#CC(=O)N(CCO)c1ccccc1 22a_100000211345_100000763181 [1,1,0,0,0,0|0,0,2]=4 1453 B15R1.9917 CC=CC(=O)C(CCCl)c1ccccc1 1458a_100000210699_200010132975 [1,1,0,0,0,0|1,0,0]=3 1454 B15R1.9917 CC=CC(=O)N(CC#N)c1ccccc1 11a_100000181372_100000210699 [1,1,0,0,0,0|0,0,1]=3 1455 B15R1.9917 CC=CC(=O)N(CC#N)c1ccccc1 1626a_100000181372_100000210699 [1,1,0,0,0,0|0,0,1]=3 1456 B15R1.9917 CC=CC(=O)N(CCC)c1ccccc1 11a_200011218496_100000210699 [1,1,0,0,0,0|0,0,0]=2 1457 B15R1.9917 CC=CC(=O)N(CCC)c1ccccc1 1626a_200011218496_100000210699 [1,1,0,0,0,0|0,0,0]=2 1458 B15R1.9917 CC=CC(=O)N(CCC)c1ccccc1 22a_200011218496_100000210699 [1,1,0,0,0,0|0,0,0]=2 1459 B15R1.9917 CC=CC(=O)N(CCO)c1ccccc1 22a_100000211345_100000210699 [1,1,0,0,0,0|0,0,0]=2 1460 B15R1.9917 CCCC(=O)N(CCC)c1ccccc1 11a_200011218496_100000211992 [1,1,0,0,0,0|0,0,2]=4 1461 B15R1.9917 CCCC(=O)N(CCC)c1ccccc1 1626a_200011218496_100000211992 [1,1,0,0,0,0|0,0,2]=4 1462 B15R1.9917 CCCC(=O)N(CCC)c1ccccc1 22a_200011218496_100000211992 [1,1,0,0,0,0|0,0,2]=4 1463 B15R1.9917 CCCC(=O)N(CCO)c1ccccc1 22a_100000211345_100000211992 [1,1,0,0,0,0|0,0,2]=4 1464 B15R1.9917 CCCN(C(=O)C=CBr)c1ccccc1 1626a_200011218496_100016273825 [1,1,0,0,0,0|1,0,0]=3 1465 B15R1.9917 CCCN(C(=O)C=CCl)c1ccccc1 11a_200011218496_200016279998 [1,1,0,0,0,0|1,0,0]=3 1466 B15R1.9917 CCCN(C(=O)C=CCl)c1ccccc1 1626a_200011218496_200016279998 [1,1,0,0,0,0|1,0,0]=3 1467 B15R1.9917 CCCN(C(=O)C=CI)c1ccccc1 1626a_200011218496_100016256311 [1,1,0,0,0,0|1,0,0]=3 1468 B15R1.9917 CCCN(C(=O)COC)c1ccccc1 11a_200011218496_100000210968 [1,1,0,0,0,0|1,0,1]=4 1469 B15R1.9917 CCCN(C(=O)COC)c1ccccc1 1626a_200011218496_100000210968 [1,1,0,0,0,0|1,0,1]=4 1470 B15R1.9917 CCCN(C(=O)COC)c1ccccc1 22a_200011218496_100000210968 [1,1,0,0,0,0|1,0,1]=4 1471 B15R1.9917 CCCN(C(=O)CSC)c1ccccc1 11a_200011218496_100000184570 [1,1,0,0,0,0|1,0,1]=4 1472 B15R1.9917 CCCN(C(=O)CSC)c1ccccc1 1626a_200011218496_100000184570 [1,1,0,0,0,0|1,0,1]=4 1473 B15R1.9917 CCCN(C(=O)CSC)c1ccccc1 22a_200011218496_100000184570 [1,1,0,0,0,0|1,0,1]=4 1474 B15R1.9917 CNCC(=O)N(CCO)c1ccccc1 2230a_106832991635_200000048808 [1,1,0,0,0,0|1,0,1]=4 1475 B15R1.9917 CNCC(=O)N(CCO)c1ccccc1 34a_100102657272_200000048808 [1,1,0,0,0,0|1,0,1]=4 1476 B15R1.9917 CNCC(=O)N(CCO)c1ccccc1 7a_106832991635_200000048808 [1,1,0,0,0,0|1,0,1]=4 1477 B15R1.9917 COCC(=O)N(CCO)c1ccccc1 22a_100000211345_100000210968 [1,1,0,0,0,0|1,0,1]=4 1478 B15R1.9917 COCC(=O)N(CCO)c1ccccc1 34a_100138415774_200000048808 [1,1,0,0,0,0|1,0,1]=4 1479 B15R1.9917 CSCC(=O)N(CCO)c1ccccc1 22a_100000211345_100000184570 [1,1,0,0,0,0|1,0,1]=4 1480 B15R1.9917 CSCC(=O)N(CCO)c1ccccc1 62a_200000048808_200000210301 [1,1,0,0,0,0|1,0,1]=4 1481 B15R1.9917 CSCC(=O)N(CCO)c1ccccc1 62a_200000210301_200000048808 [1,1,0,0,0,0|1,0,1]=4 1482 B15R1.9917 N#CCN(C(=O)C=CBr)c1ccccc1 1626a_100000181372_100016273825 [1,1,0,0,0,0|1,0,1]=4 1483 B15R1.9917 N#CCN(C(=O)C=CCl)c1ccccc1 11a_100000181372_200016279998 [1,1,0,0,0,0|1,0,1]=4 1484 B15R1.9917 N#CCN(C(=O)C=CCl)c1ccccc1 1626a_100000181372_200016279998 [1,1,0,0,0,0|1,0,1]=4 1485 B15R1.9917 N#CCN(C(=O)C=CI)c1ccccc1 1626a_100000181372_100016256311 [1,1,0,0,0,0|1,0,1]=4 1486 B15R1.9917 O=C(C=CBr)C(CCCl)c1ccccc1 1458a_100016273825_200010132975 [1,1,0,0,0,0|2,0,0]=4 1487 B15R1.9917 O=C(C=CCl)C(CCCl)c1ccccc1 1458a_200016279998_200010132975 [1,1,0,0,0,0|2,0,0]=4 1488 B15R1.9917 O=C(C=CI)C(CCCl)c1ccccc1 1458a_100016256311_200010132975 [1,1,0,0,0,0|2,0,0]=4 1489 B15R1.9917 [13CH3]SCC(=O)N(CCO)c1ccccc1 62a_200000048808_200025704644 [1,1,0,0,0,0|1,0,1]=4 1490 B15R1.9917 [13CH3]SCC(=O)N(CCO)c1ccccc1 62a_200025704644_200000048808 [1,1,0,0,0,0|1,0,1]=4 1491 B15R1.9922 C=CCC(=O)N(c1ccccc1)C(C)C 11a_100000210572_100000210193 [1,1,0,0,0,0|0,0,2]=4 1492 B15R1.9922 C=CCC(=O)N(c1ccccc1)C(C)C 1626a_100000210572_100000210193 [1,1,0,0,0,0|0,0,2]=4 1493 B15R1.9922 CC(C)N(C(=O)C=CBr)c1ccccc1 1626a_100000210572_100016273825 [1,1,0,0,0,0|1,0,0]=3 1494 B15R1.9922 CC(C)N(C(=O)C=CCl)c1ccccc1 11a_100000210572_200016279998 [1,1,0,0,0,0|1,0,0]=3 1495 B15R1.9922 CC(C)N(C(=O)C=CCl)c1ccccc1 1626a_100000210572_200016279998 [1,1,0,0,0,0|1,0,0]=3 1496 B15R1.9922 CC(C)N(C(=O)C=CI)c1ccccc1 1626a_100000210572_100016256311 [1,1,0,0,0,0|1,0,0]=3 1497 B15R1.9922 CC(C)N(C(=O)CS[13CH3])c1ccccc1 62a_100000009621_200025704644 [1,1,0,0,0,0|1,0,1]=4 1498 B15R1.9922 CC(C)N(C(=O)CS[13CH3])c1ccccc1 62a_200025704644_100000009621 [1,1,0,0,0,0|1,0,1]=4 1499 B15R1.9922 CC=CC(=O)C(C(=O)C)c1ccccc1 1458a_100000210699_100009888967 [1,1,0,0,0,0|1,0,1]=4 1500 B15R1.9922 CC=CC(=O)N(c1ccccc1)C(C)C 11a_100000210572_100000210699 [1,1,0,0,0,0|0,0,0]=2 1501 B15R1.9922 CC=CC(=O)N(c1ccccc1)C(C)C 1626a_100000210572_100000210699 [1,1,0,0,0,0|0,0,0]=2 1502 B15R1.9922 CCCC(=O)N(c1ccccc1)C(C)C 11a_100000210572_100000211992 [1,1,0,0,0,0|0,0,2]=4 1503 B15R1.9922 CCCC(=O)N(c1ccccc1)C(C)C 1626a_100000210572_100000211992 [1,1,0,0,0,0|0,0,2]=4 1504 B15R1.9922 CCNC(=O)N(c1ccccc1)C(C)C 512a_100000210572_100015525214 [1,1,0,0,0,0|1,0,1]=4 1505 B15R1.9922 CNCC(=O)N(c1ccccc1)C(C)C 2230a_106832991635_100000009621 [1,1,0,0,0,0|1,0,1]=4 1506 B15R1.9922 CNCC(=O)N(c1ccccc1)C(C)C 34a_100102657272_100000009621 [1,1,0,0,0,0|1,0,1]=4 1507 B15R1.9922 CNCC(=O)N(c1ccccc1)C(C)C 7a_106832991635_100000009621 [1,1,0,0,0,0|1,0,1]=4 1508 B15R1.9922 CNNC(=O)N(c1ccccc1)C(C)C 512a_100000210572_100016993582 [1,1,0,0,0,0|2,0,0]=4 1509 B15R1.9922 COCC(=O)N(c1ccccc1)C(C)C 11a_100000210572_100000210968 [1,1,0,0,0,0|1,0,1]=4 1510 B15R1.9922 COCC(=O)N(c1ccccc1)C(C)C 1626a_100000210572_100000210968 [1,1,0,0,0,0|1,0,1]=4 1511 B15R1.9922 COCC(=O)N(c1ccccc1)C(C)C 34a_100138415774_100000009621 [1,1,0,0,0,0|1,0,1]=4 1512 B15R1.9922 CSCC(=O)N(c1ccccc1)C(C)C 11a_100000210572_100000184570 [1,1,0,0,0,0|1,0,1]=4 1513 B15R1.9922 CSCC(=O)N(c1ccccc1)C(C)C 1626a_100000210572_100000184570 [1,1,0,0,0,0|1,0,1]=4 1514 B15R1.9922 CSCC(=O)N(c1ccccc1)C(C)C 62a_100000009621_200000210301 [1,1,0,0,0,0|1,0,1]=4 1515 B15R1.9922 CSCC(=O)N(c1ccccc1)C(C)C 62a_200000210301_100000009621 [1,1,0,0,0,0|1,0,1]=4 1516 B15R1.14 C/C=C/CN(CC)c1cccc(c1C)C 269982a_100000219776_100102629194 [1,1,0,0,0,0|0,0,1]=3 1517 B15R1.14 C/C=C/CN(CC)c1cccc(c1C)C 34a_100000219776_100102629194 [1,1,0,0,0,0|0,0,1]=3 1518 B15R1.14 C/C=C/CN(CC)c1cccc(c1C)C 7a_100000219776_100102629194 [1,1,0,0,0,0|0,0,1]=3 1519 B15R1.14 CC=CCN(CC)c1cccc(c1C)C 2230a_100000219776_100000070051 [1,1,0,0,0,0|0,0,1]=3 1520 B15R1.14 CC=CCN(CC)c1cccc(c1C)C 34a_100000219776_100000070051 [1,1,0,0,0,0|0,0,1]=3 1521 B15R1.14 CC=CCN(CC)c1cccc(c1C)C 7a_100000219776_100000070051 [1,1,0,0,0,0|0,0,1]=3 1522 B15R1.160 C/C=C/CN(c1ccccc1Br)C(C)C 269982a_100000219599_100102629194 [1,1,0,0,0,0|1,0,1]=4 1523 B15R1.160 C/C=C/CN(c1ccccc1Br)C(C)C 34a_100000219599_100102629194 [1,1,0,0,0,0|1,0,1]=4 1524 B15R1.160 C/C=C/CN(c1ccccc1Br)C(C)C 7a_100000219599_100102629194 [1,1,0,0,0,0|1,0,1]=4 1525 B15R1.160 C/C=C/CN(c1ccccc1C)C(C)C 269982a_100000219700_100102629194 [1,1,0,0,0,0|0,0,1]=3 1526 B15R1.160 C/C=C/CN(c1ccccc1C)C(C)C 34a_100000219700_100102629194 [1,1,0,0,0,0|0,0,1]=3 1527 B15R1.160 C/C=C/CN(c1ccccc1C)C(C)C 7a_100000219700_100102629194 [1,1,0,0,0,0|0,0,1]=3 1528 B15R1.160 C/C=C/CN(c1ccccc1Cl)C(C)C 269982a_100000219376_100102629194 [1,1,0,0,0,0|1,0,1]=4 1529 B15R1.160 C/C=C/CN(c1ccccc1Cl)C(C)C 34a_100000219376_100102629194 [1,1,0,0,0,0|1,0,1]=4 1530 B15R1.160 C/C=C/CN(c1ccccc1Cl)C(C)C 7a_100000219376_100102629194 [1,1,0,0,0,0|1,0,1]=4 1531 B15R1.160 C/C=C/CN(c1ccccc1F)C(C)C 269982a_100000220358_100102629194 [1,1,0,0,0,0|1,0,1]=4 1532 B15R1.160 C/C=C/CN(c1ccccc1F)C(C)C 34a_100000220358_100102629194 [1,1,0,0,0,0|1,0,1]=4 1533 B15R1.160 C/C=C/CN(c1ccccc1F)C(C)C 7a_100000220358_100102629194 [1,1,0,0,0,0|1,0,1]=4 1534 B15R1.160 CC=CCN(c1ccccc1Br)C(C)C 34a_100000219599_100000070051 [1,1,0,0,0,0|1,0,1]=4 1535 B15R1.160 CC=CCN(c1ccccc1Br)C(C)C 7a_100000219599_100000070051 [1,1,0,0,0,0|1,0,1]=4 1536 B15R1.160 CC=CCN(c1ccccc1C)C(C)C 2230a_100000219700_100000070051 [1,1,0,0,0,0|0,0,1]=3 1537 B15R1.160 CC=CCN(c1ccccc1C)C(C)C 34a_100000219700_100000070051 [1,1,0,0,0,0|0,0,1]=3 1538 B15R1.160 CC=CCN(c1ccccc1C)C(C)C 7a_100000219700_100000070051 [1,1,0,0,0,0|0,0,1]=3 1539 B15R1.160 CC=CCN(c1ccccc1Cl)C(C)C 34a_100000219376_100000070051 [1,1,0,0,0,0|1,0,1]=4 1540 B15R1.160 CC=CCN(c1ccccc1Cl)C(C)C 7a_100000219376_100000070051 [1,1,0,0,0,0|1,0,1]=4 1541 B15R1.160 CC=CCN(c1ccccc1F)C(C)C 34a_100000220358_100000070051 [1,1,0,0,0,0|1,0,1]=4 1542 B15R1.160 CC=CCN(c1ccccc1F)C(C)C 7a_100000220358_100000070051 [1,1,0,0,0,0|1,0,1]=4 1543 B15R1.3402 CC/C=C\CN(CC)c1ccccc1Br 2230a_114873767003_100103147603 [1,1,0,0,0,0|1,0,1]=4 1544 B15R1.3402 CC/C=C\CN(CC)c1ccccc1Br 269982a_114873767003_100103147603 [1,1,0,0,0,0|1,0,1]=4 1545 B15R1.3402 CC/C=C\CN(CC)c1ccccc1Br 34a_114873767003_100103147603 [1,1,0,0,0,0|1,0,1]=4 1546 B15R1.3402 CC/C=C\CN(CC)c1ccccc1C 2230a_100000211084_100103147603 [1,1,0,0,0,0|0,0,1]=3 1547 B15R1.3402 CC/C=C\CN(CC)c1ccccc1C 269982a_100000211084_100103147603 [1,1,0,0,0,0|0,0,1]=3 1548 B15R1.3402 CC/C=C\CN(CC)c1ccccc1C 34a_100000211084_100103147603 [1,1,0,0,0,0|0,0,1]=3 1549 B15R1.3402 CC/C=C\CN(CC)c1ccccc1F 2230a_100000220365_100103147603 [1,1,0,0,0,0|1,0,1]=4 1550 B15R1.3402 CC/C=C\CN(CC)c1ccccc1F 269982a_100000220365_100103147603 [1,1,0,0,0,0|1,0,1]=4 1551 B15R1.3402 CC/C=C\CN(CC)c1ccccc1F 34a_100000220365_100103147603 [1,1,0,0,0,0|1,0,1]=4 1552 B15R1.3402 CC/C=C\CN(CC)c1ccccc1O 269982a_103624766699_100103147603 [1,1,0,0,0,0|1,0,1]=4 1553 B15R1.3482 C/C=C/CN(CC)c1cc(ccc1C)C 269982a_100000743043_100102629194 [1,1,0,0,0,0|0,0,1]=3 1554 B15R1.3482 C/C=C/CN(CC)c1cc(ccc1C)C 34a_100000743043_100102629194 [1,1,0,0,0,0|0,0,1]=3 1555 B15R1.3482 C/C=C/CN(CC)c1cc(ccc1C)C 7a_100000743043_100102629194 [1,1,0,0,0,0|0,0,1]=3 1556 B15R1.3482 C/C=C/CN(CC)c1cc(ccc1C)O 269982a_100000211784_100102629194 [1,1,0,0,0,0|0,0,1]=3 1557 B15R1.3482 C/C=C/CN(CC)c1cc(ccc1C)O 34a_100000211784_100102629194 [1,1,0,0,0,0|0,0,1]=3 1558 B15R1.3482 CC=CCN(CC)c1cc(ccc1C)C 2230a_100000743043_100000070051 [1,1,0,0,0,0|0,0,1]=3 1559 B15R1.3482 CC=CCN(CC)c1cc(ccc1C)C 34a_100000743043_100000070051 [1,1,0,0,0,0|0,0,1]=3 1560 B15R1.3482 CC=CCN(CC)c1cc(ccc1C)C 7a_100000743043_100000070051 [1,1,0,0,0,0|0,0,1]=3 1561 B15R1.3482 CC=CCN(CC)c1cc(ccc1C)O 34a_100000211784_100000070051 [1,1,0,0,0,0|0,0,1]=3 1562 B15R1.3502 C/C=C/CN(CC)c1ccccc1C#N 269982a_200000218880_100102629194 [1,1,0,0,0,0|0,0,2]=4 1563 B15R1.3502 C/C=C/CN(CC)c1ccccc1OC 269982a_100020603010_100102629194 [1,1,0,0,0,0|0,0,1]=3 1564 B15R1.3502 CC=CCN(CC)c1ccccc1C#N 2230a_200000218880_100000070051 [1,1,0,0,0,0|0,0,2]=4 1565 B15R1.3502 CC=CCN(CC)c1ccccc1OC 2230a_100020603010_100000070051 [1,1,0,0,0,0|0,0,1]=3 1566 B15R1.5962 C/C=C/CN(CCC)c1ccccc1F 269982a_100011231789_100102629194 [1,1,0,0,0,0|1,0,1]=4 1567 B15R1.5962 C/C=C/CN(CCC)c1ccccc1F 34a_100011231789_100102629194 [1,1,0,0,0,0|1,0,1]=4 1568 B15R1.5962 C/C=C/CN(CCO)c1ccccc1C 269982a_100011233185_100102629194 [1,1,0,0,0,0|0,0,1]=3 1569 B15R1.5962 C/C=C/CN(CCO)c1ccccc1C 34a_100011233185_100102629194 [1,1,0,0,0,0|0,0,1]=3 1570 B15R1.5962 CC=CCN(CCC)c1ccccc1F 2230a_100011231789_100000070051 [1,1,0,0,0,0|1,0,1]=4 1571 B15R1.5962 CC=CCN(CCC)c1ccccc1F 34a_100011231789_100000070051 [1,1,0,0,0,0|1,0,1]=4 1572 B15R1.5962 CC=CCN(CCO)c1ccccc1C 34a_100011233185_100000070051 [1,1,0,0,0,0|0,0,1]=3 1573 B15R1.10019 C=C(C)CCN(CC)c1ccccc1C 2230a_100000211084_100000730704 [1,1,0,0,0,0|0,0,2]=4 1574 B15R1.10019 C=C(C)CCN(CC)c1ccccc1C 269982a_100000211084_100000730704 [1,1,0,0,0,0|0,0,2]=4 1575 B15R1.10019 C=C(C)CCN(CC)c1ccccc1C 34a_100000211084_100000730704 [1,1,0,0,0,0|0,0,2]=4 1576 B15R1.10019 CCN(CC=C(C)C)c1ccccc1Br 2230a_114873767003_100000761012 [1,1,0,0,0,0|1,0,1]=4 1577 B15R1.10019 CCN(CC=C(C)C)c1ccccc1Br 269982a_114873767003_100000761012 [1,1,0,0,0,0|1,0,1]=4 1578 B15R1.10019 CCN(CC=C(C)C)c1ccccc1Br 34a_114873767003_100000761012 [1,1,0,0,0,0|1,0,1]=4 1579 B15R1.10019 CCN(CC=C(C)C)c1ccccc1C 2230a_100000211084_100000761012 [1,1,0,0,0,0|0,0,1]=3 1580 B15R1.10019 CCN(CC=C(C)C)c1ccccc1C 269982a_100000211084_100000761012 [1,1,0,0,0,0|0,0,1]=3 1581 B15R1.10019 CCN(CC=C(C)C)c1ccccc1C 34a_100000211084_100000761012 [1,1,0,0,0,0|0,0,1]=3 1582 B15R1.10019 CCN(CC=C(C)C)c1ccccc1F 2230a_100000220365_100000761012 [1,1,0,0,0,0|1,0,1]=4 1583 B15R1.10019 CCN(CC=C(C)C)c1ccccc1F 269982a_100000220365_100000761012 [1,1,0,0,0,0|1,0,1]=4 1584 B15R1.10019 CCN(CC=C(C)C)c1ccccc1F 34a_100000220365_100000761012 [1,1,0,0,0,0|1,0,1]=4 1585 B15R1.10019 CCN(CC=C(C)C)c1ccccc1O 269982a_103624766699_100000761012 [1,1,0,0,0,0|1,0,1]=4 1586 B15R1.10019 CCN(CCC(=O)C)c1ccccc1C 269982a_100000211084_100000053229 [1,1,0,0,0,0|0,0,2]=4 1587 B15R1.10019 CCN(COC(=O)C)c1ccccc1C 269982a_100000211084_100000076356 [1,1,0,0,0,0|1,0,1]=4 1588 B15R1.10019 CCN(COC(=O)C)c1ccccc1C 34a_100000211084_100009813279 [1,1,0,0,0,0|1,0,1]=4 1589 B15R1.15224 C/C=C/CN(CC)c1ccc(cc1C)F 269982a_100000221679_100102629194 [1,1,0,0,0,0|0,0,1]=3 1590 B15R1.15224 C/C=C/CN(CC)c1ccc(cc1C)F 34a_100000221679_100102629194 [1,1,0,0,0,0|0,0,1]=3 1591 B15R1.15224 C/C=C/CN(CC)c1ccc(cc1C)F 7a_100000221679_100102629194 [1,1,0,0,0,0|0,0,1]=3 1592 B15R1.15224 C/C=C/CN(CC)c1ccc(cc1Cl)Cl 269982a_100160557746_100102629194 [1,1,0,0,0,0|1,0,1]=4 1593 B15R1.15224 C/C=C/CN(CC)c1ccc(cc1Cl)Cl 34a_100160557746_100102629194 [1,1,0,0,0,0|1,0,1]=4 1594 B15R1.15224 CC=CCN(CC)c1ccc(cc1C)F 2230a_100000221679_100000070051 [1,1,0,0,0,0|0,0,1]=3 1595 B15R1.15224 CC=CCN(CC)c1ccc(cc1C)F 34a_100000221679_100000070051 [1,1,0,0,0,0|0,0,1]=3 1596 B15R1.15224 CC=CCN(CC)c1ccc(cc1C)F 7a_100000221679_100000070051 [1,1,0,0,0,0|0,0,1]=3 1597 B15R1.15224 CC=CCN(CC)c1ccc(cc1Cl)Cl 34a_100160557746_100000070051 [1,1,0,0,0,0|1,0,1]=4 1598 B15R1.22295 CCC(=O)CN(CC)c1ccccc1C 269982a_100000211084_100000747405 [1,1,0,0,0,0|0,0,2]=4 1599 B15R1.22295 CCN(CC(=O)NC)c1ccccc1C 2230a_100000211084_100000183359 [1,1,0,0,0,0|1,0,1]=4 1600 B15R1.22295 CCN(CC(=O)NC)c1ccccc1C 269982a_100000211084_100000183359 [1,1,0,0,0,0|1,0,1]=4 1601 B15R1.22295 CCN(CC(=O)NC)c1ccccc1C 34a_100000211084_100000183359 [1,1,0,0,0,0|1,0,1]=4 1602 B15R1.22295 CCN(CC(=O)OC)c1ccccc1C 2230a_100000211084_100000747449 [1,1,0,0,0,0|1,0,1]=4 1603 B15R1.22295 CCN(CC(=O)OC)c1ccccc1C 269982a_100000211084_100000747449 [1,1,0,0,0,0|1,0,1]=4 1604 B15R1.22295 CCN(CC(=O)OC)c1ccccc1C 34a_100000211084_100000747449 [1,1,0,0,0,0|1,0,1]=4 1605 B15R1.29 C=CCC(=O)N(C)c1cccc(c1C)Cl 11a_100020606106_100000210193 [1,1,0,0,0,0|0,0,2]=4 1606 B15R1.29 C=CCC(=O)N(C)c1cccc(c1C)Cl 1626a_100020606106_100000210193 [1,1,0,0,0,0|0,0,2]=4 1607 B15R1.29 C=CCC(=O)N(C)c1cccc(c1C)Cl 22a_100020606106_100000210193 [1,1,0,0,0,0|0,0,2]=4 1608 B15R1.29 CC#CC(=O)N(C)c1cccc(c1C)Cl 22a_100020606106_100000763181 [1,1,0,0,0,0|0,0,2]=4 1609 B15R1.29 CC=CC(=O)C(C)c1cccc(c1C)C 1458a_100000210699_100012183177 [1,1,0,0,0,0|1,0,0]=3 1610 B15R1.29 CC=CC(=O)N(C)c1cccc(c1C)Cl 11a_100020606106_100000210699 [1,1,0,0,0,0|0,0,0]=2 1611 B15R1.29 CC=CC(=O)N(C)c1cccc(c1C)Cl 1626a_100020606106_100000210699 [1,1,0,0,0,0|0,0,0]=2 1612 B15R1.29 CC=CC(=O)N(C)c1cccc(c1C)Cl 22a_100020606106_100000210699 [1,1,0,0,0,0|0,0,0]=2 1613 B15R1.29 CC=CC(=O)N(C)c1cccc(c1Cl)Cl 11a_100000742713_100000210699 [1,1,0,0,0,0|1,0,0]=3 1614 B15R1.29 CC=CC(=O)N(C)c1cccc(c1Cl)Cl 1626a_100000742713_100000210699 [1,1,0,0,0,0|1,0,0]=3 1615 B15R1.29 CC=CC(=O)N(C)c1cccc(c1F)Cl 11a_100020633735_100000210699 [1,1,0,0,0,0|1,0,0]=3 1616 B15R1.29 CC=CC(=O)N(C)c1cccc(c1F)Cl 1626a_100020633735_100000210699 [1,1,0,0,0,0|1,0,0]=3 1617 B15R1.29 CCCC(=O)N(C)c1cccc(c1C)Cl 11a_100020606106_100000211992 [1,1,0,0,0,0|0,0,2]=4 1618 B15R1.29 CCCC(=O)N(C)c1cccc(c1C)Cl 1626a_100020606106_100000211992 [1,1,0,0,0,0|0,0,2]=4 1619 B15R1.29 CCCC(=O)N(C)c1cccc(c1C)Cl 22a_100020606106_100000211992 [1,1,0,0,0,0|0,0,2]=4 1620 B15R1.29 CCNC(=O)N(C)c1cccc(c1C)Cl 512a_100015525214_100020606106 [1,1,0,0,0,0|1,0,1]=4 1621 B15R1.29 CN(C(=O)C=CBr)c1cccc(c1Cl)Cl 1626a_100000742713_100016273825 [1,1,0,0,0,0|2,0,0]=4 1622 B15R1.29 CN(C(=O)C=CBr)c1cccc(c1F)Cl 1626a_100020633735_100016273825 [1,1,0,0,0,0|2,0,0]=4 1623 B15R1.29 CN(C(=O)C=CCl)c1cccc(c1Cl)Cl 11a_100000742713_200016279998 [1,1,0,0,0,0|2,0,0]=4 1624 B15R1.29 CN(C(=O)C=CCl)c1cccc(c1Cl)Cl 1626a_100000742713_200016279998 [1,1,0,0,0,0|2,0,0]=4 1625 B15R1.29 CN(C(=O)C=CCl)c1cccc(c1F)Cl 11a_100020633735_200016279998 [1,1,0,0,0,0|2,0,0]=4 1626 B15R1.29 CN(C(=O)C=CCl)c1cccc(c1F)Cl 1626a_100020633735_200016279998 [1,1,0,0,0,0|2,0,0]=4 1627 B15R1.29 CN(C(=O)C=CI)c1cccc(c1Cl)Cl 1626a_100000742713_100016256311 [1,1,0,0,0,0|2,0,0]=4 1628 B15R1.29 CN(C(=O)C=CI)c1cccc(c1F)Cl 1626a_100020633735_100016256311 [1,1,0,0,0,0|2,0,0]=4 1629 B15R1.29 CNNC(=O)N(C)c1cccc(c1C)Cl 512a_100016993582_100020606106 [1,1,0,0,0,0|2,0,0]=4 1630 B15R1.29 COCC(=O)N(C)c1cccc(c1C)Cl 11a_100020606106_100000210968 [1,1,0,0,0,0|1,0,1]=4 1631 B15R1.29 COCC(=O)N(C)c1cccc(c1C)Cl 1626a_100020606106_100000210968 [1,1,0,0,0,0|1,0,1]=4 1632 B15R1.29 COCC(=O)N(C)c1cccc(c1C)Cl 22a_100020606106_100000210968 [1,1,0,0,0,0|1,0,1]=4 1633 B15R1.29 CSCC(=O)N(C)c1cccc(c1C)Cl 11a_100020606106_100000184570 [1,1,0,0,0,0|1,0,1]=4 1634 B15R1.29 CSCC(=O)N(C)c1cccc(c1C)Cl 1626a_100020606106_100000184570 [1,1,0,0,0,0|1,0,1]=4 1635 B15R1.29 CSCC(=O)N(C)c1cccc(c1C)Cl 22a_100020606106_100000184570 [1,1,0,0,0,0|1,0,1]=4 1636 B15R1.29 Cc1c(cccc1N(C)C(=O)C=CBr)Cl 1626a_100020606106_100016273825 [1,1,0,0,0,0|1,0,0]=3 1637 B15R1.29 Cc1c(cccc1N(C)C(=O)C=CCl)Cl 11a_100020606106_200016279998 [1,1,0,0,0,0|1,0,0]=3 1638 B15R1.29 Cc1c(cccc1N(C)C(=O)C=CCl)Cl 1626a_100020606106_200016279998 [1,1,0,0,0,0|1,0,0]=3 1639 B15R1.29 Cc1c(cccc1N(C)C(=O)C=CI)Cl 1626a_100020606106_100016256311 [1,1,0,0,0,0|1,0,0]=3 1640 B15R1.29 Cc1cccc(c1C)C(C)C(=O)C=CBr 1458a_100016273825_100012183177 [1,1,0,0,0,0|2,0,0]=4 1641 B15R1.29 Cc1cccc(c1C)C(C)C(=O)C=CCl 1458a_200016279998_100012183177 [1,1,0,0,0,0|2,0,0]=4 1642 B15R1.29 Cc1cccc(c1C)C(C)C(=O)C=CI 1458a_100016256311_100012183177 [1,1,0,0,0,0|2,0,0]=4 1643 B15R1.3937 C=CCC(=O)N(C)c1cc(ccc1C)Br 11a_100020629602_100000210193 [1,1,0,0,0,0|0,0,2]=4 1644 B15R1.3937 C=CCC(=O)N(C)c1cc(ccc1C)Br 1626a_100020629602_100000210193 [1,1,0,0,0,0|0,0,2]=4 1645 B15R1.3937 C=CCC(=O)N(C)c1cc(ccc1C)Br 527a_100020629602_100000210193 [1,1,0,0,0,0|0,0,2]=4 1646 B15R1.3937 C=CCC(=O)N(C)c1cc(ccc1C)Cl 11a_100000221440_100000210193 [1,1,0,0,0,0|0,0,2]=4 1647 B15R1.3937 C=CCC(=O)N(C)c1cc(ccc1C)Cl 1626a_100000221440_100000210193 [1,1,0,0,0,0|0,0,2]=4 1648 B15R1.3937 C=CCC(=O)N(C)c1cc(ccc1C)F 11a_114849113390_100000210193 [1,1,0,0,0,0|0,0,2]=4 1649 B15R1.3937 C=CCC(=O)N(C)c1cc(ccc1C)F 1626a_114849113390_100000210193 [1,1,0,0,0,0|0,0,2]=4 1650 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1Br)Cl 11a_100020633006_100000210699 [1,1,0,0,0,0|1,0,0]=3 1651 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1Br)Cl 1626a_100020633006_100000210699 [1,1,0,0,0,0|1,0,0]=3 1652 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1Br)F 11a_100020633008_100000210699 [1,1,0,0,0,0|1,0,0]=3 1653 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1Br)F 1626a_100020633008_100000210699 [1,1,0,0,0,0|1,0,0]=3 1654 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1C)Br 11a_100020629602_100000210699 [1,1,0,0,0,0|0,0,0]=2 1655 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1C)Br 1626a_100020629602_100000210699 [1,1,0,0,0,0|0,0,0]=2 1656 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1C)Cl 11a_100000221440_100000210699 [1,1,0,0,0,0|0,0,0]=2 1657 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1C)Cl 1626a_100000221440_100000210699 [1,1,0,0,0,0|0,0,0]=2 1658 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1C)F 11a_114849113390_100000210699 [1,1,0,0,0,0|0,0,0]=2 1659 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1C)F 1626a_114849113390_100000210699 [1,1,0,0,0,0|0,0,0]=2 1660 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1Cl)Br 11a_100011772073_100000210699 [1,1,0,0,0,0|1,0,0]=3 1661 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1Cl)Br 1626a_100011772073_100000210699 [1,1,0,0,0,0|1,0,0]=3 1662 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1Cl)Cl 11a_100000742562_100000210699 [1,1,0,0,0,0|1,0,0]=3 1663 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1Cl)Cl 1626a_100000742562_100000210699 [1,1,0,0,0,0|1,0,0]=3 1664 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1F)Br 11a_100011314990_100000210699 [1,1,0,0,0,0|1,0,0]=3 1665 B15R1.3937 CC=CC(=O)N(C)c1cc(ccc1F)Br 1626a_100011314990_100000210699 [1,1,0,0,0,0|1,0,0]=3 1666 B15R1.3937 CCCC(=O)N(C)c1cc(ccc1C)Br 11a_100020629602_100000211992 [1,1,0,0,0,0|0,0,2]=4 1667 B15R1.3937 CCCC(=O)N(C)c1cc(ccc1C)Br 1626a_100020629602_100000211992 [1,1,0,0,0,0|0,0,2]=4 1668 B15R1.3937 CCCC(=O)N(C)c1cc(ccc1C)Br 527a_100020629602_100000211992 [1,1,0,0,0,0|0,0,2]=4 1669 B15R1.3937 CCCC(=O)N(C)c1cc(ccc1C)Cl 11a_100000221440_100000211992 [1,1,0,0,0,0|0,0,2]=4 1670 B15R1.3937 CCCC(=O)N(C)c1cc(ccc1C)Cl 1626a_100000221440_100000211992 [1,1,0,0,0,0|0,0,2]=4 1671 B15R1.3937 CCCC(=O)N(C)c1cc(ccc1C)F 11a_114849113390_100000211992 [1,1,0,0,0,0|0,0,2]=4 1672 B15R1.3937 CCCC(=O)N(C)c1cc(ccc1C)F 1626a_114849113390_100000211992 [1,1,0,0,0,0|0,0,2]=4 1673 B15R1.3937 CCNC(=O)N(C)c1cc(ccc1C)Br 512a_100015525214_100020629602 [1,1,0,0,0,0|1,0,1]=4 1674 B15R1.3937 CCNC(=O)N(C)c1cc(ccc1C)Br 512a_100020629602_100015525214 [1,1,0,0,0,0|1,0,1]=4 1675 B15R1.3937 CCNC(=O)N(C)c1cc(ccc1C)Cl 512a_100015525214_100000221440 [1,1,0,0,0,0|1,0,1]=4 1676 B15R1.3937 CCNC(=O)N(C)c1cc(ccc1C)F 512a_100015525214_114849113390 [1,1,0,0,0,0|1,0,1]=4 1677 B15R1.3937 CCNC(=O)N(C)c1cc(ccc1C)F 512a_114849113390_100015525214 [1,1,0,0,0,0|1,0,1]=4 1678 B15R1.3937 CN(C(=O)C=CBr)c1cc(ccc1Br)Cl 1626a_100020633006_100016273825 [1,1,0,0,0,0|2,0,0]=4 1679 B15R1.3937 CN(C(=O)C=CBr)c1cc(ccc1Br)F 1626a_100020633008_100016273825 [1,1,0,0,0,0|2,0,0]=4 1680 B15R1.3937 CN(C(=O)C=CBr)c1cc(ccc1Cl)Br 1626a_100011772073_100016273825 [1,1,0,0,0,0|2,0,0]=4 1681 B15R1.3937 CN(C(=O)C=CBr)c1cc(ccc1Cl)Cl 1626a_100000742562_100016273825 [1,1,0,0,0,0|2,0,0]=4 1682 B15R1.3937 CN(C(=O)C=CBr)c1cc(ccc1F)Br 1626a_100011314990_100016273825 [1,1,0,0,0,0|2,0,0]=4 1683 B15R1.3937 CN(C(=O)C=CCl)c1cc(ccc1Br)Cl 11a_100020633006_200016279998 [1,1,0,0,0,0|2,0,0]=4 1684 B15R1.3937 CN(C(=O)C=CCl)c1cc(ccc1Br)Cl 1626a_100020633006_200016279998 [1,1,0,0,0,0|2,0,0]=4 1685 B15R1.3937 CN(C(=O)C=CCl)c1cc(ccc1Br)F 11a_100020633008_200016279998 [1,1,0,0,0,0|2,0,0]=4 1686 B15R1.3937 CN(C(=O)C=CCl)c1cc(ccc1Br)F 1626a_100020633008_200016279998 [1,1,0,0,0,0|2,0,0]=4 1687 B15R1.3937 CN(C(=O)C=CCl)c1cc(ccc1Cl)Br 11a_100011772073_200016279998 [1,1,0,0,0,0|2,0,0]=4 1688 B15R1.3937 CN(C(=O)C=CCl)c1cc(ccc1Cl)Br 1626a_100011772073_200016279998 [1,1,0,0,0,0|2,0,0]=4 1689 B15R1.3937 CN(C(=O)C=CCl)c1cc(ccc1Cl)Cl 11a_100000742562_200016279998 [1,1,0,0,0,0|2,0,0]=4 1690 B15R1.3937 CN(C(=O)C=CCl)c1cc(ccc1Cl)Cl 1626a_100000742562_200016279998 [1,1,0,0,0,0|2,0,0]=4 1691 B15R1.3937 CN(C(=O)C=CCl)c1cc(ccc1F)Br 11a_100011314990_200016279998 [1,1,0,0,0,0|2,0,0]=4 1692 B15R1.3937 CN(C(=O)C=CCl)c1cc(ccc1F)Br 1626a_100011314990_200016279998 [1,1,0,0,0,0|2,0,0]=4 1693 B15R1.3937 CN(C(=O)C=CI)c1cc(ccc1Br)Cl 1626a_100020633006_100016256311 [1,1,0,0,0,0|2,0,0]=4 1694 B15R1.3937 CN(C(=O)C=CI)c1cc(ccc1Br)F 1626a_100020633008_100016256311 [1,1,0,0,0,0|2,0,0]=4 1695 B15R1.3937 CN(C(=O)C=CI)c1cc(ccc1Cl)Br 1626a_100011772073_100016256311 [1,1,0,0,0,0|2,0,0]=4 1696 B15R1.3937 CN(C(=O)C=CI)c1cc(ccc1Cl)Cl 1626a_100000742562_100016256311 [1,1,0,0,0,0|2,0,0]=4 1697 B15R1.3937 CN(C(=O)C=CI)c1cc(ccc1F)Br 1626a_100011314990_100016256311 [1,1,0,0,0,0|2,0,0]=4 1698 B15R1.3937 CNNC(=O)N(C)c1cc(ccc1C)Br 512a_100016993582_100020629602 [1,1,0,0,0,0|2,0,0]=4 1699 B15R1.3937 CNNC(=O)N(C)c1cc(ccc1C)Br 512a_100020629602_100016993582 [1,1,0,0,0,0|2,0,0]=4 1700 B15R1.3937 CNNC(=O)N(C)c1cc(ccc1C)Cl 512a_100016993582_100000221440 [1,1,0,0,0,0|2,0,0]=4 1701 B15R1.3937 CNNC(=O)N(C)c1cc(ccc1C)F 512a_100016993582_114849113390 [1,1,0,0,0,0|2,0,0]=4 1702 B15R1.3937 CNNC(=O)N(C)c1cc(ccc1C)F 512a_114849113390_100016993582 [1,1,0,0,0,0|2,0,0]=4 1703 B15R1.3937 COCC(=O)N(C)c1cc(ccc1C)Br 11a_100020629602_100000210968 [1,1,0,0,0,0|1,0,1]=4 1704 B15R1.3937 COCC(=O)N(C)c1cc(ccc1C)Br 1626a_100020629602_100000210968 [1,1,0,0,0,0|1,0,1]=4 1705 B15R1.3937 COCC(=O)N(C)c1cc(ccc1C)Br 527a_100020629602_100000210968 [1,1,0,0,0,0|1,0,1]=4 1706 B15R1.3937 COCC(=O)N(C)c1cc(ccc1C)Cl 11a_100000221440_100000210968 [1,1,0,0,0,0|1,0,1]=4 1707 B15R1.3937 COCC(=O)N(C)c1cc(ccc1C)Cl 1626a_100000221440_100000210968 [1,1,0,0,0,0|1,0,1]=4 1708 B15R1.3937 COCC(=O)N(C)c1cc(ccc1C)F 11a_114849113390_100000210968 [1,1,0,0,0,0|1,0,1]=4 1709 B15R1.3937 COCC(=O)N(C)c1cc(ccc1C)F 1626a_114849113390_100000210968 [1,1,0,0,0,0|1,0,1]=4 1710 B15R1.3937 CSCC(=O)N(C)c1cc(ccc1C)Br 11a_100020629602_100000184570 [1,1,0,0,0,0|1,0,1]=4 1711 B15R1.3937 CSCC(=O)N(C)c1cc(ccc1C)Br 1626a_100020629602_100000184570 [1,1,0,0,0,0|1,0,1]=4 1712 B15R1.3937 CSCC(=O)N(C)c1cc(ccc1C)Br 527a_100020629602_100000184570 [1,1,0,0,0,0|1,0,1]=4 1713 B15R1.3937 CSCC(=O)N(C)c1cc(ccc1C)Cl 11a_100000221440_100000184570 [1,1,0,0,0,0|1,0,1]=4 1714 B15R1.3937 CSCC(=O)N(C)c1cc(ccc1C)Cl 1626a_100000221440_100000184570 [1,1,0,0,0,0|1,0,1]=4 1715 B15R1.3937 CSCC(=O)N(C)c1cc(ccc1C)F 11a_114849113390_100000184570 [1,1,0,0,0,0|1,0,1]=4 1716 B15R1.3937 CSCC(=O)N(C)c1cc(ccc1C)F 1626a_114849113390_100000184570 [1,1,0,0,0,0|1,0,1]=4 1717 B15R1.3937 Cc1ccc(cc1N(C)C(=O)C=CBr)Br 1626a_100020629602_100016273825 [1,1,0,0,0,0|1,0,0]=3 1718 B15R1.3937 Cc1ccc(cc1N(C)C(=O)C=CBr)Cl 1626a_100000221440_100016273825 [1,1,0,0,0,0|1,0,0]=3 1719 B15R1.3937 Cc1ccc(cc1N(C)C(=O)C=CBr)F 1626a_114849113390_100016273825 [1,1,0,0,0,0|1,0,0]=3 1720 B15R1.3937 Cc1ccc(cc1N(C)C(=O)C=CCl)Br 11a_100020629602_200016279998 [1,1,0,0,0,0|1,0,0]=3 1721 B15R1.3937 Cc1ccc(cc1N(C)C(=O)C=CCl)Br 1626a_100020629602_200016279998 [1,1,0,0,0,0|1,0,0]=3 1722 B15R1.3937 Cc1ccc(cc1N(C)C(=O)C=CCl)Cl 11a_100000221440_200016279998 [1,1,0,0,0,0|1,0,0]=3 1723 B15R1.3937 Cc1ccc(cc1N(C)C(=O)C=CCl)Cl 1626a_100000221440_200016279998 [1,1,0,0,0,0|1,0,0]=3 1724 B15R1.3937 Cc1ccc(cc1N(C)C(=O)C=CCl)F 11a_114849113390_200016279998 [1,1,0,0,0,0|1,0,0]=3 1725 B15R1.3937 Cc1ccc(cc1N(C)C(=O)C=CCl)F 1626a_114849113390_200016279998 [1,1,0,0,0,0|1,0,0]=3 1726 B15R1.3937 Cc1ccc(cc1N(C)C(=O)C=CI)Br 1626a_100020629602_100016256311 [1,1,0,0,0,0|1,0,0]=3 1727 B15R1.3937 Cc1ccc(cc1N(C)C(=O)C=CI)Cl 1626a_100000221440_100016256311 [1,1,0,0,0,0|1,0,0]=3 1728 B15R1.3937 Cc1ccc(cc1N(C)C(=O)C=CI)F 1626a_114849113390_100016256311 [1,1,0,0,0,0|1,0,0]=3 1729 B15R1.3954 C=CCC(=O)N(C)c1ccccc1OC 11a_100000219746_100000210193 [1,1,0,0,0,0|0,0,2]=4 1730 B15R1.3954 C=CCC(=O)N(C)c1ccccc1OC 1626a_100000219746_100000210193 [1,1,0,0,0,0|0,0,2]=4 1731 B15R1.3954 C=CCC(=O)N(C)c1ccccc1OC 22a_100000219746_100000210193 [1,1,0,0,0,0|0,0,2]=4 1732 B15R1.3954 CC#CC(=O)N(C)c1ccccc1OC 22a_100000219746_100000763181 [1,1,0,0,0,0|0,0,2]=4 1733 B15R1.3954 CC=CC(=O)N(C)c1ccccc1C#N 11a_100000744078_100000210699 [1,1,0,0,0,0|0,0,1]=3 1734 B15R1.3954 CC=CC(=O)N(C)c1ccccc1C#N 1626a_100000744078_100000210699 [1,1,0,0,0,0|0,0,1]=3 1735 B15R1.3954 CC=CC(=O)N(C)c1ccccc1OC 11a_100000219746_100000210699 [1,1,0,0,0,0|0,0,0]=2 1736 B15R1.3954 CC=CC(=O)N(C)c1ccccc1OC 1626a_100000219746_100000210699 [1,1,0,0,0,0|0,0,0]=2 1737 B15R1.3954 CC=CC(=O)N(C)c1ccccc1OC 22a_100000219746_100000210699 [1,1,0,0,0,0|0,0,0]=2 1738 B15R1.3954 CCCC(=O)N(C)c1ccccc1OC 11a_100000219746_100000211992 [1,1,0,0,0,0|0,0,2]=4 1739 B15R1.3954 CCCC(=O)N(C)c1ccccc1OC 1626a_100000219746_100000211992 [1,1,0,0,0,0|0,0,2]=4 1740 B15R1.3954 CCCC(=O)N(C)c1ccccc1OC 22a_100000219746_100000211992 [1,1,0,0,0,0|0,0,2]=4 1741 B15R1.3954 CCNC(=O)N(C)c1ccccc1OC 512a_100015525214_100000219746 [1,1,0,0,0,0|1,0,1]=4 1742 B15R1.3954 CN(C(=O)C=CBr)c1ccccc1C#N 1626a_100000744078_100016273825 [1,1,0,0,0,0|1,0,1]=4 1743 B15R1.3954 CN(C(=O)C=CCl)c1ccccc1C#N 11a_100000744078_200016279998 [1,1,0,0,0,0|1,0,1]=4 1744 B15R1.3954 CN(C(=O)C=CCl)c1ccccc1C#N 1626a_100000744078_200016279998 [1,1,0,0,0,0|1,0,1]=4 1745 B15R1.3954 CN(C(=O)C=CI)c1ccccc1C#N 1626a_100000744078_100016256311 [1,1,0,0,0,0|1,0,1]=4 1746 B15R1.3954 CNNC(=O)N(C)c1ccccc1OC 512a_100016993582_100000219746 [1,1,0,0,0,0|2,0,0]=4 1747 B15R1.3954 COCC(=O)N(C)c1ccccc1OC 11a_100000219746_100000210968 [1,1,0,0,0,0|1,0,1]=4 1748 B15R1.3954 COCC(=O)N(C)c1ccccc1OC 1626a_100000219746_100000210968 [1,1,0,0,0,0|1,0,1]=4 1749 B15R1.3954 COCC(=O)N(C)c1ccccc1OC 22a_100000219746_100000210968 [1,1,0,0,0,0|1,0,1]=4 1750 B15R1.3954 COc1ccccc1N(C)C(=O)C=CBr 1626a_100000219746_100016273825 [1,1,0,0,0,0|1,0,0]=3 1751 B15R1.3954 COc1ccccc1N(C)C(=O)C=CCl 11a_100000219746_200016279998 [1,1,0,0,0,0|1,0,0]=3 1752 B15R1.3954 COc1ccccc1N(C)C(=O)C=CCl 1626a_100000219746_200016279998 [1,1,0,0,0,0|1,0,0]=3 1753 B15R1.3954 COc1ccccc1N(C)C(=O)C=CI 1626a_100000219746_100016256311 [1,1,0,0,0,0|1,0,0]=3 1754 B15R1.3954 COc1ccccc1N(C)C(=O)CSC 11a_100000219746_100000184570 [1,1,0,0,0,0|1,0,1]=4 1755 B15R1.3954 COc1ccccc1N(C)C(=O)CSC 1626a_100000219746_100000184570 [1,1,0,0,0,0|1,0,1]=4 1756 B15R1.3954 COc1ccccc1N(C)C(=O)CSC 22a_100000219746_100000184570 [1,1,0,0,0,0|1,0,1]=4 1757 B15R1.4434 C/C=C(\C)/C(=O)C(C)c1ccccc1Cl 1458a_100020587367_100000181259 [1,1,0,0,0,0|2,0,0]=4 1758 B15R1.4434 C/C=C(\C)/C(=O)C(C)c1ccccc1F 1458a_100020587367_200000741388 [1,1,0,0,0,0|2,0,0]=4 1759 B15R1.4434 C/C=C(\C)/C(=O)N(C)c1ccccc1Br 11a_100020606079_100020587367 [1,1,0,0,0,0|1,0,0]=3 1760 B15R1.4434 C/C=C(\C)/C(=O)N(C)c1ccccc1Br 1626a_100020606079_100020587367 [1,1,0,0,0,0|1,0,0]=3 1761 B15R1.4434 C/C=C(\C)/C(=O)N(C)c1ccccc1C 11a_100000219699_100020587367 [1,1,0,0,0,0|0,0,0]=2 1762 B15R1.4434 C/C=C(\C)/C(=O)N(C)c1ccccc1C 1626a_100000219699_100020587367 [1,1,0,0,0,0|0,0,0]=2 1763 B15R1.4434 C/C=C(\C)/C(=O)N(C)c1ccccc1C 22a_100000219699_100020587367 [1,1,0,0,0,0|0,0,0]=2 1764 B15R1.4434 C/C=C(\C)/C(=O)N(C)c1ccccc1Cl 11a_100000219374_100020587367 [1,1,0,0,0,0|1,0,0]=3 1765 B15R1.4434 C/C=C(\C)/C(=O)N(C)c1ccccc1Cl 1626a_100000219374_100020587367 [1,1,0,0,0,0|1,0,0]=3 1766 B15R1.4434 C/C=C(\C)/C(=O)N(C)c1ccccc1F 11a_100000220357_100020587367 [1,1,0,0,0,0|1,0,0]=3 1767 B15R1.4434 C/C=C(\C)/C(=O)N(C)c1ccccc1F 1626a_100000220357_100020587367 [1,1,0,0,0,0|1,0,0]=3 1768 B15R1.4434 C/C=C(\C)/C(=O)N(C)c1ccccc1F 22a_100000220357_100020587367 [1,1,0,0,0,0|1,0,0]=3 1769 B15R1.4434 C/C=C(\C)/C(=O)N(C)c1ccccc1O 22a_100000033821_100020587367 [1,1,0,0,0,0|1,0,0]=3 1770 B15R1.4434 C=C(CO)C(=O)N(C)c1ccccc1C 22a_100000219699_200000705526 [1,1,0,0,0,0|1,0,1]=4 1771 B15R1.4434 C=CC(C)C(=O)N(C)c1ccccc1C 11a_100000219699_100011216780 [1,1,0,0,0,0|0,0,2]=4 1772 B15R1.4434 C=CC(C)C(=O)N(C)c1ccccc1C 1626a_100000219699_100011216780 [1,1,0,0,0,0|0,0,2]=4 1773 B15R1.4434 C=CC(C)C(=O)N(C)c1ccccc1C 22a_100000219699_100011216780 [1,1,0,0,0,0|0,0,2]=4 1774 B15R1.4434 CCC(C)C(=O)N(C)c1ccccc1C 11a_100000219699_100011192722 [1,1,0,0,0,0|0,0,2]=4 1775 B15R1.4434 CCC(C)C(=O)N(C)c1ccccc1C 1626a_100000219699_100011192722 [1,1,0,0,0,0|0,0,2]=4 1776 B15R1.4434 CCC(C)C(=O)N(C)c1ccccc1C 22a_100000219699_100011192722 [1,1,0,0,0,0|0,0,2]=4 1777 B15R1.4434 CCC(O)C(=O)N(C)c1ccccc1C 22a_100000219699_100011196387 [1,1,0,0,0,0|0,0,2]=4 1778 B15R1.4434 CNC(=O)C(=O)N(C)c1ccccc1Br 1626a_100020606079_100011218921 [1,1,0,0,0,0|2,0,0]=4 1779 B15R1.4434 CNC(=O)C(=O)N(C)c1ccccc1C 1626a_100000219699_100011218921 [1,1,0,0,0,0|1,0,0]=3 1780 B15R1.4434 CNC(=O)C(=O)N(C)c1ccccc1C 22a_100000219699_100011218921 [1,1,0,0,0,0|1,0,0]=3 1781 B15R1.4434 CNC(=O)C(=O)N(C)c1ccccc1Cl 1626a_100000219374_100011218921 [1,1,0,0,0,0|2,0,0]=4 1782 B15R1.4434 CNC(=O)C(=O)N(C)c1ccccc1F 1626a_100000220357_100011218921 [1,1,0,0,0,0|2,0,0]=4 1783 B15R1.4434 CNC(=O)C(=O)N(C)c1ccccc1F 22a_100000220357_100011218921 [1,1,0,0,0,0|2,0,0]=4 1784 B15R1.4434 CNC(=O)C(=O)N(C)c1ccccc1O 22a_100000033821_100011218921 [1,1,0,0,0,0|2,0,0]=4 1785 B15R1.4434 CNC(=O)C(=O)N(C)c1ccccc1O 527a_100000033821_100011218921 [1,1,0,0,0,0|2,0,0]=4 1786 B15R1.4434 COC(=O)C(=O)N(C)c1ccccc1Br 11a_100020606079_100000024059 [1,1,0,0,0,0|2,0,0]=4 1787 B15R1.4434 COC(=O)C(=O)N(C)c1ccccc1Br 1626a_100020606079_100000024059 [1,1,0,0,0,0|2,0,0]=4 1788 B15R1.4434 COC(=O)C(=O)N(C)c1ccccc1C 11a_100000219699_100000024059 [1,1,0,0,0,0|1,0,0]=3 1789 B15R1.4434 COC(=O)C(=O)N(C)c1ccccc1C 1626a_100000219699_100000024059 [1,1,0,0,0,0|1,0,0]=3 1790 B15R1.4434 COC(=O)C(=O)N(C)c1ccccc1Cl 11a_100000219374_100000024059 [1,1,0,0,0,0|2,0,0]=4 1791 B15R1.4434 COC(=O)C(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000024059 [1,1,0,0,0,0|2,0,0]=4 1792 B15R1.4434 COC(=O)C(=O)N(C)c1ccccc1F 11a_100000220357_100000024059 [1,1,0,0,0,0|2,0,0]=4 1793 B15R1.4434 COC(=O)C(=O)N(C)c1ccccc1F 1626a_100000220357_100000024059 [1,1,0,0,0,0|2,0,0]=4 1794 B15R1.4434 COC(=O)C(=O)N(C)c1ccccc1O 527a_100000033821_100000024059 [1,1,0,0,0,0|2,0,0]=4 1795 B15R1.4434 COC(C)C(=O)N(C)c1ccccc1C 11a_100000219699_100000743197 [1,1,0,0,0,0|1,0,1]=4 1796 B15R1.4434 COC(C)C(=O)N(C)c1ccccc1C 1626a_100000219699_100000743197 [1,1,0,0,0,0|1,0,1]=4 1797 B15R1.4434 COC(C)C(=O)N(C)c1ccccc1C 22a_100000219699_100000743197 [1,1,0,0,0,0|1,0,1]=4 1798 B15R1.4434 CSC(C)C(=O)N(C)c1ccccc1C 11a_100000219699_100000149566 [1,1,0,0,0,0|1,0,1]=4 1799 B15R1.4434 CSC(C)C(=O)N(C)c1ccccc1C 1626a_100000219699_100000149566 [1,1,0,0,0,0|1,0,1]=4 1800 B15R1.4434 CSC(C)C(=O)N(C)c1ccccc1C 22a_100000219699_100000149566 [1,1,0,0,0,0|1,0,1]=4 1801 B15R1.5792 CC(=CC(=O)C(C)c1ccccc1Cl)C 1458a_100000211388_100000181259 [1,1,0,0,0,0|2,0,0]=4 1802 B15R1.5792 CC(=CC(=O)C(C)c1ccccc1Cl)Cl 1458a_200042562850_100000181259 [1,1,0,0,0,0|2,0,0]=4 1803 B15R1.5792 CC(=CC(=O)C(C)c1ccccc1Cl)I 1458a_100025716642_100000181259 [1,1,0,0,0,0|2,0,0]=4 1804 B15R1.5792 CC(=CC(=O)C(C)c1ccccc1F)C 1458a_100000211388_200000741388 [1,1,0,0,0,0|2,0,0]=4 1805 B15R1.5792 CC(=CC(=O)C(C)c1ccccc1F)Cl 1458a_200042562850_200000741388 [1,1,0,0,0,0|2,0,0]=4 1806 B15R1.5792 CC(=CC(=O)C(C)c1ccccc1F)I 1458a_100025716642_200000741388 [1,1,0,0,0,0|2,0,0]=4 1807 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1Br)C 11a_100020606079_100000211388 [1,1,0,0,0,0|1,0,0]=3 1808 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1Br)C 1626a_100020606079_100000211388 [1,1,0,0,0,0|1,0,0]=3 1809 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1Br)Cl 11a_100020606079_200042562850 [1,1,0,0,0,0|1,0,0]=3 1810 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1Br)Cl 1626a_100020606079_200042562850 [1,1,0,0,0,0|1,0,0]=3 1811 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1Br)I 11a_100020606079_100025716642 [1,1,0,0,0,0|1,0,0]=3 1812 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1Br)I 1626a_100020606079_100025716642 [1,1,0,0,0,0|1,0,0]=3 1813 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1C)C 11a_100000219699_100000211388 [1,1,0,0,0,0|0,0,0]=2 1814 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1C)C 1626a_100000219699_100000211388 [1,1,0,0,0,0|0,0,0]=2 1815 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1C)C 22a_100000219699_100000211388 [1,1,0,0,0,0|0,0,0]=2 1816 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1C)Cl 11a_100000219699_200042562850 [1,1,0,0,0,0|0,0,0]=2 1817 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1C)Cl 1626a_100000219699_200042562850 [1,1,0,0,0,0|0,0,0]=2 1818 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1C)Cl 22a_100000219699_200042562850 [1,1,0,0,0,0|0,0,0]=2 1819 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1C)I 11a_100000219699_100025716642 [1,1,0,0,0,0|0,0,0]=2 1820 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1C)I 1626a_100000219699_100025716642 [1,1,0,0,0,0|0,0,0]=2 1821 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1Cl)C 11a_100000219374_100000211388 [1,1,0,0,0,0|1,0,0]=3 1822 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1Cl)C 1626a_100000219374_100000211388 [1,1,0,0,0,0|1,0,0]=3 1823 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1Cl)Cl 11a_100000219374_200042562850 [1,1,0,0,0,0|1,0,0]=3 1824 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1Cl)Cl 1626a_100000219374_200042562850 [1,1,0,0,0,0|1,0,0]=3 1825 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1Cl)I 11a_100000219374_100025716642 [1,1,0,0,0,0|1,0,0]=3 1826 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1Cl)I 1626a_100000219374_100025716642 [1,1,0,0,0,0|1,0,0]=3 1827 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1F)C 11a_100000220357_100000211388 [1,1,0,0,0,0|1,0,0]=3 1828 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1F)C 1626a_100000220357_100000211388 [1,1,0,0,0,0|1,0,0]=3 1829 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1F)C 22a_100000220357_100000211388 [1,1,0,0,0,0|1,0,0]=3 1830 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1F)Cl 11a_100000220357_200042562850 [1,1,0,0,0,0|1,0,0]=3 1831 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1F)Cl 1626a_100000220357_200042562850 [1,1,0,0,0,0|1,0,0]=3 1832 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1F)Cl 22a_100000220357_200042562850 [1,1,0,0,0,0|1,0,0]=3 1833 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1F)I 11a_100000220357_100025716642 [1,1,0,0,0,0|1,0,0]=3 1834 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1F)I 1626a_100000220357_100025716642 [1,1,0,0,0,0|1,0,0]=3 1835 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1O)C 22a_100000033821_100000211388 [1,1,0,0,0,0|1,0,0]=3 1836 B15R1.5792 CC(=CC(=O)N(C)c1ccccc1O)Cl 22a_100000033821_200042562850 [1,1,0,0,0,0|1,0,0]=3 1837 B15R1.5792 CN(C(=O)C=C(Cl)Cl)c1ccccc1Br 1626a_100020606079_100000137448 [1,1,0,0,0,0|2,0,0]=4 1838 B15R1.5792 CN(C(=O)C=C(Cl)Cl)c1ccccc1Cl 1626a_100000219374_100000137448 [1,1,0,0,0,0|2,0,0]=4 1839 B15R1.5792 CN(C(=O)C=C(Cl)Cl)c1ccccc1F 1626a_100000220357_100000137448 [1,1,0,0,0,0|2,0,0]=4 1840 B15R1.5792 Cc1ccccc1N(C)C(=O)C=C(Cl)Cl 1626a_100000219699_100000137448 [1,1,0,0,0,0|1,0,0]=3 1841 B15R1.5792 Cc1ccccc1N(C)C(=O)CC(=O)N 22a_100000219699_100134613110 [1,1,0,0,0,0|1,0,1]=4 1842 B15R1.5792 Cc1ccccc1N(C)C(=O)CC(C)C 11a_100000219699_100000210554 [1,1,0,0,0,0|0,0,2]=4 1843 B15R1.5792 Cc1ccccc1N(C)C(=O)CC(C)C 1626a_100000219699_100000210554 [1,1,0,0,0,0|0,0,2]=4 1844 B15R1.5792 Cc1ccccc1N(C)C(=O)CC(C)C 22a_100000219699_100000210554 [1,1,0,0,0,0|0,0,2]=4 1845 B15R1.5792 Cc1ccccc1N(C)C(=O)CN(C)C 11a_100000219699_100000750896 [1,1,0,0,0,0|1,0,1]=4 1846 B15R1.5792 Cc1ccccc1N(C)C(=O)CN(C)C 22a_100000219699_100000750896 [1,1,0,0,0,0|1,0,1]=4 1847 B15R1.5792 Cc1ccccc1N(C)C(=O)C[C@@H](C)O 22a_100000219699_100011933948 [1,1,0,0,0,0|0,0,2]=4 1848 B15R1.5792 Cc1ccccc1N(C)C(=O)C[S+](C)C 11a_100000219699_200159257847 [1,1,0,0,0,0|1,0,1]=4 1849 B15R1.5792 Cc1ccccc1N(C)C(=O)C[S+](C)C 1626a_100000219699_200159257847 [1,1,0,0,0,0|1,0,1]=4 1850 B15R1.5792 Cc1ccccc1N(C)C(=O)C[S+](C)C 22a_100000219699_200159257847 [1,1,0,0,0,0|1,0,1]=4 1851 B15R1.5792 Cc1ccccc1N(C)C(=O)NC(C)C 512a_100138425928_100000219699 [1,1,0,0,0,0|1,0,1]=4 1852 B15R1.5837 C/C=C/CC(=O)C(C)c1ccccc1Br 1458a_100012359601_100102629194 [1,1,0,0,0,0|2,0,0]=4 1853 B15R1.5837 C/C=C/CC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100102629194 [1,1,0,0,0,0|2,0,0]=4 1854 B15R1.5837 C=CC=CC(=O)N(C)c1ccccc1Br 1626a_100020606079_100016291481 [1,1,0,0,0,0|1,0,1]=4 1855 B15R1.5837 C=CC=CC(=O)N(C)c1ccccc1C 1626a_100000219699_100016291481 [1,1,0,0,0,0|0,0,1]=3 1856 B15R1.5837 C=CC=CC(=O)N(C)c1ccccc1C 22a_100000219699_100016291481 [1,1,0,0,0,0|0,0,1]=3 1857 B15R1.5837 C=CC=CC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100016291481 [1,1,0,0,0,0|1,0,1]=4 1858 B15R1.5837 C=CC=CC(=O)N(C)c1ccccc1F 1626a_100000220357_100016291481 [1,1,0,0,0,0|1,0,1]=4 1859 B15R1.5837 C=CC=CC(=O)N(C)c1ccccc1F 22a_100000220357_100016291481 [1,1,0,0,0,0|1,0,1]=4 1860 B15R1.5837 C=CC=CC(=O)N(C)c1ccccc1O 22a_100000033821_100016291481 [1,1,0,0,0,0|1,0,1]=4 1861 B15R1.5837 C=CCCC(=O)N(C)c1ccccc1C 11a_100000219699_100000749702 [1,1,0,0,0,0|0,0,2]=4 1862 B15R1.5837 C=CCCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000749702 [1,1,0,0,0,0|0,0,2]=4 1863 B15R1.5837 C=CCCC(=O)N(C)c1ccccc1C 22a_100000219699_100000749702 [1,1,0,0,0,0|0,0,2]=4 1864 B15R1.5837 C=CCNC(=O)N(C)c1ccccc1C 512a_100020586998_100000219699 [1,1,0,0,0,0|0,0,2]=4 1865 B15R1.5837 CC=CCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000070051 [1,1,0,0,0,0|2,0,0]=4 1866 B15R1.5837 CC=CCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000070051 [1,1,0,0,0,0|2,0,0]=4 1867 B15R1.5837 CC=CCC(=O)C(C)c1ccccc1Cl 1458a_100121576822_100000181259 [1,1,0,0,0,0|2,0,0]=4 1868 B15R1.5837 CC=CCC(=O)C(C)c1ccccc1F 1458a_100121576822_200000741388 [1,1,0,0,0,0|2,0,0]=4 1869 B15R1.5837 CC=CCC(=O)N(C)c1ccccc1Br 11a_100020606079_100121576822 [1,1,0,0,0,0|1,0,0]=3 1870 B15R1.5837 CC=CCC(=O)N(C)c1ccccc1Br 1626a_100020606079_100121576822 [1,1,0,0,0,0|1,0,0]=3 1871 B15R1.5837 CC=CCC(=O)N(C)c1ccccc1C 11a_100000219699_100121576822 [1,1,0,0,0,0|0,0,0]=2 1872 B15R1.5837 CC=CCC(=O)N(C)c1ccccc1C 1626a_100000219699_100121576822 [1,1,0,0,0,0|0,0,0]=2 1873 B15R1.5837 CC=CCC(=O)N(C)c1ccccc1C 22a_100000219699_100121576822 [1,1,0,0,0,0|0,0,0]=2 1874 B15R1.5837 CC=CCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100121576822 [1,1,0,0,0,0|1,0,0]=3 1875 B15R1.5837 CC=CCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100121576822 [1,1,0,0,0,0|1,0,0]=3 1876 B15R1.5837 CC=CCC(=O)N(C)c1ccccc1F 11a_100000220357_100121576822 [1,1,0,0,0,0|1,0,0]=3 1877 B15R1.5837 CC=CCC(=O)N(C)c1ccccc1F 1626a_100000220357_100121576822 [1,1,0,0,0,0|1,0,0]=3 1878 B15R1.5837 CC=CCC(=O)N(C)c1ccccc1F 22a_100000220357_100121576822 [1,1,0,0,0,0|1,0,0]=3 1879 B15R1.5837 CC=CCC(=O)N(C)c1ccccc1O 22a_100000033821_100121576822 [1,1,0,0,0,0|1,0,0]=3 1880 B15R1.5837 CC=CCC(=O)N(C)c1ccccc1O 527a_100000033821_100121576822 [1,1,0,0,0,0|1,0,0]=3 1881 B15R1.5837 CCC#CC(=O)N(C)c1ccccc1C 22a_100000219699_100011827653 [1,1,0,0,0,0|0,0,2]=4 1882 B15R1.5837 CCC=CC(=O)C(C)c1ccccc1Cl 1458a_100000212282_100000181259 [1,1,0,0,0,0|2,0,0]=4 1883 B15R1.5837 CCC=CC(=O)C(C)c1ccccc1F 1458a_100000212282_200000741388 [1,1,0,0,0,0|2,0,0]=4 1884 B15R1.5837 CCC=CC(=O)N(C)c1ccccc1Br 11a_100020606079_100000212282 [1,1,0,0,0,0|1,0,0]=3 1885 B15R1.5837 CCC=CC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000212282 [1,1,0,0,0,0|1,0,0]=3 1886 B15R1.5837 CCC=CC(=O)N(C)c1ccccc1C 11a_100000219699_100000212282 [1,1,0,0,0,0|0,0,0]=2 1887 B15R1.5837 CCC=CC(=O)N(C)c1ccccc1C 1626a_100000219699_100000212282 [1,1,0,0,0,0|0,0,0]=2 1888 B15R1.5837 CCC=CC(=O)N(C)c1ccccc1C 22a_100000219699_100000212282 [1,1,0,0,0,0|0,0,0]=2 1889 B15R1.5837 CCC=CC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000212282 [1,1,0,0,0,0|1,0,0]=3 1890 B15R1.5837 CCC=CC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000212282 [1,1,0,0,0,0|1,0,0]=3 1891 B15R1.5837 CCC=CC(=O)N(C)c1ccccc1F 11a_100000220357_100000212282 [1,1,0,0,0,0|1,0,0]=3 1892 B15R1.5837 CCC=CC(=O)N(C)c1ccccc1F 1626a_100000220357_100000212282 [1,1,0,0,0,0|1,0,0]=3 1893 B15R1.5837 CCC=CC(=O)N(C)c1ccccc1F 22a_100000220357_100000212282 [1,1,0,0,0,0|1,0,0]=3 1894 B15R1.5837 CCC=CC(=O)N(C)c1ccccc1O 22a_100000033821_100000212282 [1,1,0,0,0,0|1,0,0]=3 1895 B15R1.5837 CCCCC(=O)N(C)c1ccccc1C 11a_100000219699_100000210183 [1,1,0,0,0,0|0,0,2]=4 1896 B15R1.5837 CCCCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000210183 [1,1,0,0,0,0|0,0,2]=4 1897 B15R1.5837 CCCCC(=O)N(C)c1ccccc1C 22a_100000219699_100000210183 [1,1,0,0,0,0|0,0,2]=4 1898 B15R1.5837 CCCNC(=O)N(C)c1ccccc1C 512a_100020643023_100000219699 [1,1,0,0,0,0|0,0,2]=4 1899 B15R1.5837 CCNNC(=O)N(C)c1ccccc1C 512a_100000756455_100000219699 [1,1,0,0,0,0|1,0,1]=4 1900 B15R1.5837 CCOCC(=O)N(C)c1ccccc1C 11a_100000219699_100000211967 [1,1,0,0,0,0|0,0,2]=4 1901 B15R1.5837 CCOCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000211967 [1,1,0,0,0,0|0,0,2]=4 1902 B15R1.5837 CCOCC(=O)N(C)c1ccccc1C 22a_100000219699_100000211967 [1,1,0,0,0,0|0,0,2]=4 1903 B15R1.5837 CCSCC(=O)N(C)c1ccccc1C 11a_100000219699_100000230394 [1,1,0,0,0,0|0,0,2]=4 1904 B15R1.5837 CCSCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000230394 [1,1,0,0,0,0|0,0,2]=4 1905 B15R1.5837 CCSCC(=O)N(C)c1ccccc1C 22a_100000219699_100000230394 [1,1,0,0,0,0|0,0,2]=4 1906 B15R1.5837 COC=CC(=O)C(C)c1ccccc1Cl 1458a_100016268678_100000181259 [1,1,0,0,0,0|2,0,0]=4 1907 B15R1.5837 COC=CC(=O)C(C)c1ccccc1F 1458a_100016268678_200000741388 [1,1,0,0,0,0|2,0,0]=4 1908 B15R1.5837 COC=CC(=O)N(C)c1ccccc1Br 1626a_100020606079_100016268678 [1,1,0,0,0,0|1,0,0]=3 1909 B15R1.5837 COC=CC(=O)N(C)c1ccccc1C 1626a_100000219699_100016268678 [1,1,0,0,0,0|0,0,0]=2 1910 B15R1.5837 COC=CC(=O)N(C)c1ccccc1C 22a_100000219699_100016268678 [1,1,0,0,0,0|0,0,0]=2 1911 B15R1.5837 COC=CC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100016268678 [1,1,0,0,0,0|1,0,0]=3 1912 B15R1.5837 COC=CC(=O)N(C)c1ccccc1F 1626a_100000220357_100016268678 [1,1,0,0,0,0|1,0,0]=3 1913 B15R1.5837 COC=CC(=O)N(C)c1ccccc1F 22a_100000220357_100016268678 [1,1,0,0,0,0|1,0,0]=3 1914 B15R1.5837 COC=CC(=O)N(C)c1ccccc1O 22a_100000033821_100016268678 [1,1,0,0,0,0|1,0,0]=3 1915 B15R1.5837 COCCC(=O)N(C)c1ccccc1C 11a_100000219699_100000749529 [1,1,0,0,0,0|0,0,2]=4 1916 B15R1.5837 COCCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000749529 [1,1,0,0,0,0|0,0,2]=4 1917 B15R1.5837 COCCC(=O)N(C)c1ccccc1C 22a_100000219699_100000749529 [1,1,0,0,0,0|0,0,2]=4 1918 B15R1.5837 CSCCC(=O)N(C)c1ccccc1C 11a_100000219699_100000174002 [1,1,0,0,0,0|0,0,2]=4 1919 B15R1.5837 CSCCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000174002 [1,1,0,0,0,0|0,0,2]=4 1920 B15R1.5837 CSCCC(=O)N(C)c1ccccc1C 22a_100000219699_100000174002 [1,1,0,0,0,0|0,0,2]=4 1921 B15R1.16836 C=CCC(=O)N(C)c1ccc(cc1C)Br 11a_100000221803_100000210193 [1,1,0,0,0,0|0,0,2]=4 1922 B15R1.16836 C=CCC(=O)N(C)c1ccc(cc1C)Br 1626a_100000221803_100000210193 [1,1,0,0,0,0|0,0,2]=4 1923 B15R1.16836 C=CCC(=O)N(C)c1ccc(cc1C)Cl 11a_114849113698_100000210193 [1,1,0,0,0,0|0,0,2]=4 1924 B15R1.16836 C=CCC(=O)N(C)c1ccc(cc1C)Cl 1626a_114849113698_100000210193 [1,1,0,0,0,0|0,0,2]=4 1925 B15R1.16836 C=CCC(=O)N(C)c1ccc(cc1C)O 22a_100161107805_100000210193 [1,1,0,0,0,0|0,0,2]=4 1926 B15R1.16836 C=CCC(=O)N(C)c1ccc(cc1C)O 527a_100161107805_100000210193 [1,1,0,0,0,0|0,0,2]=4 1927 B15R1.16836 CC#CC(=O)N(C)c1ccc(cc1C)O 22a_100161107805_100000763181 [1,1,0,0,0,0|0,0,2]=4 1928 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1Br)Br 1626a_200000221195_100000210699 [1,1,0,0,0,0|1,0,0]=3 1929 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1Br)C 11a_100000221369_100000210699 [1,1,0,0,0,0|1,0,0]=3 1930 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1Br)C 1626a_100000221369_100000210699 [1,1,0,0,0,0|1,0,0]=3 1931 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1Br)Cl 11a_100020633009_100000210699 [1,1,0,0,0,0|1,0,0]=3 1932 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1Br)Cl 1626a_100020633009_100000210699 [1,1,0,0,0,0|1,0,0]=3 1933 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1Br)F 11a_100011246292_100000210699 [1,1,0,0,0,0|1,0,0]=3 1934 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1Br)F 1626a_100011246292_100000210699 [1,1,0,0,0,0|1,0,0]=3 1935 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1C)Br 11a_100000221803_100000210699 [1,1,0,0,0,0|0,0,0]=2 1936 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1C)Br 1626a_100000221803_100000210699 [1,1,0,0,0,0|0,0,0]=2 1937 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1C)Cl 11a_114849113698_100000210699 [1,1,0,0,0,0|0,0,0]=2 1938 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1C)Cl 1626a_114849113698_100000210699 [1,1,0,0,0,0|0,0,0]=2 1939 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1C)O 22a_100161107805_100000210699 [1,1,0,0,0,0|0,0,0]=2 1940 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1Cl)Br 11a_100000221650_100000210699 [1,1,0,0,0,0|1,0,0]=3 1941 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1Cl)Br 1626a_100000221650_100000210699 [1,1,0,0,0,0|1,0,0]=3 1942 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1Cl)Cl 11a_114849113696_100000210699 [1,1,0,0,0,0|1,0,0]=3 1943 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1Cl)Cl 1626a_114849113696_100000210699 [1,1,0,0,0,0|1,0,0]=3 1944 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1F)Br 11a_100000743884_100000210699 [1,1,0,0,0,0|1,0,0]=3 1945 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1F)Br 1626a_100000743884_100000210699 [1,1,0,0,0,0|1,0,0]=3 1946 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1F)F 11a_100020633734_100000210699 [1,1,0,0,0,0|1,0,0]=3 1947 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1F)F 1626a_100020633734_100000210699 [1,1,0,0,0,0|1,0,0]=3 1948 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1F)I 11a_114948340911_100000210699 [1,1,0,0,0,0|1,0,0]=3 1949 B15R1.16836 CC=CC(=O)N(C)c1ccc(cc1F)I 1626a_114948340911_100000210699 [1,1,0,0,0,0|1,0,0]=3 1950 B15R1.16836 CCCC(=O)N(C)c1ccc(cc1C)Br 11a_100000221803_100000211992 [1,1,0,0,0,0|0,0,2]=4 1951 B15R1.16836 CCCC(=O)N(C)c1ccc(cc1C)Br 1626a_100000221803_100000211992 [1,1,0,0,0,0|0,0,2]=4 1952 B15R1.16836 CCCC(=O)N(C)c1ccc(cc1C)Cl 11a_114849113698_100000211992 [1,1,0,0,0,0|0,0,2]=4 1953 B15R1.16836 CCCC(=O)N(C)c1ccc(cc1C)Cl 1626a_114849113698_100000211992 [1,1,0,0,0,0|0,0,2]=4 1954 B15R1.16836 CCCC(=O)N(C)c1ccc(cc1C)O 22a_100161107805_100000211992 [1,1,0,0,0,0|0,0,2]=4 1955 B15R1.16836 CCCC(=O)N(C)c1ccc(cc1C)O 527a_100161107805_100000211992 [1,1,0,0,0,0|0,0,2]=4 1956 B15R1.16836 CCNC(=O)N(C)c1ccc(cc1C)Br 512a_100000221803_100015525214 [1,1,0,0,0,0|1,0,1]=4 1957 B15R1.16836 CCNC(=O)N(C)c1ccc(cc1C)Br 512a_100015525214_100000221803 [1,1,0,0,0,0|1,0,1]=4 1958 B15R1.16836 CCNC(=O)N(C)c1ccc(cc1C)Cl 512a_100015525214_114849113698 [1,1,0,0,0,0|1,0,1]=4 1959 B15R1.16836 CCNC(=O)N(C)c1ccc(cc1C)O 512a_100015525214_100161107805 [1,1,0,0,0,0|1,0,1]=4 1960 B15R1.16836 CN(C(=O)C=CBr)c1ccc(cc1Br)Br 1626a_200000221195_100016273825 [1,1,0,0,0,0|2,0,0]=4 1961 B15R1.16836 CN(C(=O)C=CBr)c1ccc(cc1Br)Cl 1626a_100020633009_100016273825 [1,1,0,0,0,0|2,0,0]=4 1962 B15R1.16836 CN(C(=O)C=CBr)c1ccc(cc1Br)F 1626a_100011246292_100016273825 [1,1,0,0,0,0|2,0,0]=4 1963 B15R1.16836 CN(C(=O)C=CBr)c1ccc(cc1Cl)Br 1626a_100000221650_100016273825 [1,1,0,0,0,0|2,0,0]=4 1964 B15R1.16836 CN(C(=O)C=CBr)c1ccc(cc1Cl)Cl 1626a_114849113696_100016273825 [1,1,0,0,0,0|2,0,0]=4 1965 B15R1.16836 CN(C(=O)C=CBr)c1ccc(cc1F)Br 1626a_100000743884_100016273825 [1,1,0,0,0,0|2,0,0]=4 1966 B15R1.16836 CN(C(=O)C=CBr)c1ccc(cc1F)F 1626a_100020633734_100016273825 [1,1,0,0,0,0|2,0,0]=4 1967 B15R1.16836 CN(C(=O)C=CBr)c1ccc(cc1F)I 1626a_114948340911_100016273825 [1,1,0,0,0,0|2,0,0]=4 1968 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1Br)Br 1626a_200000221195_200016279998 [1,1,0,0,0,0|2,0,0]=4 1969 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1Br)Cl 11a_100020633009_200016279998 [1,1,0,0,0,0|2,0,0]=4 1970 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1Br)Cl 1626a_100020633009_200016279998 [1,1,0,0,0,0|2,0,0]=4 1971 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1Br)F 11a_100011246292_200016279998 [1,1,0,0,0,0|2,0,0]=4 1972 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1Br)F 1626a_100011246292_200016279998 [1,1,0,0,0,0|2,0,0]=4 1973 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1Cl)Br 11a_100000221650_200016279998 [1,1,0,0,0,0|2,0,0]=4 1974 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1Cl)Br 1626a_100000221650_200016279998 [1,1,0,0,0,0|2,0,0]=4 1975 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1Cl)Cl 11a_114849113696_200016279998 [1,1,0,0,0,0|2,0,0]=4 1976 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1Cl)Cl 1626a_114849113696_200016279998 [1,1,0,0,0,0|2,0,0]=4 1977 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1F)Br 11a_100000743884_200016279998 [1,1,0,0,0,0|2,0,0]=4 1978 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1F)Br 1626a_100000743884_200016279998 [1,1,0,0,0,0|2,0,0]=4 1979 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1F)F 11a_100020633734_200016279998 [1,1,0,0,0,0|2,0,0]=4 1980 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1F)F 1626a_100020633734_200016279998 [1,1,0,0,0,0|2,0,0]=4 1981 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1F)I 11a_114948340911_200016279998 [1,1,0,0,0,0|2,0,0]=4 1982 B15R1.16836 CN(C(=O)C=CCl)c1ccc(cc1F)I 1626a_114948340911_200016279998 [1,1,0,0,0,0|2,0,0]=4 1983 B15R1.16836 CN(C(=O)C=CI)c1ccc(cc1Br)Br 1626a_200000221195_100016256311 [1,1,0,0,0,0|2,0,0]=4 1984 B15R1.16836 CN(C(=O)C=CI)c1ccc(cc1Br)Cl 1626a_100020633009_100016256311 [1,1,0,0,0,0|2,0,0]=4 1985 B15R1.16836 CN(C(=O)C=CI)c1ccc(cc1Br)F 1626a_100011246292_100016256311 [1,1,0,0,0,0|2,0,0]=4 1986 B15R1.16836 CN(C(=O)C=CI)c1ccc(cc1Cl)Br 1626a_100000221650_100016256311 [1,1,0,0,0,0|2,0,0]=4 1987 B15R1.16836 CN(C(=O)C=CI)c1ccc(cc1Cl)Cl 1626a_114849113696_100016256311 [1,1,0,0,0,0|2,0,0]=4 1988 B15R1.16836 CN(C(=O)C=CI)c1ccc(cc1F)Br 1626a_100000743884_100016256311 [1,1,0,0,0,0|2,0,0]=4 1989 B15R1.16836 CN(C(=O)C=CI)c1ccc(cc1F)F 1626a_100020633734_100016256311 [1,1,0,0,0,0|2,0,0]=4 1990 B15R1.16836 CN(C(=O)C=CI)c1ccc(cc1F)I 1626a_114948340911_100016256311 [1,1,0,0,0,0|2,0,0]=4 1991 B15R1.16836 CNNC(=O)N(C)c1ccc(cc1C)Br 512a_100000221803_100016993582 [1,1,0,0,0,0|2,0,0]=4 1992 B15R1.16836 CNNC(=O)N(C)c1ccc(cc1C)Br 512a_100016993582_100000221803 [1,1,0,0,0,0|2,0,0]=4 1993 B15R1.16836 CNNC(=O)N(C)c1ccc(cc1C)Cl 512a_100016993582_114849113698 [1,1,0,0,0,0|2,0,0]=4 1994 B15R1.16836 CNNC(=O)N(C)c1ccc(cc1C)O 512a_100016993582_100161107805 [1,1,0,0,0,0|2,0,0]=4 1995 B15R1.16836 COCC(=O)N(C)c1ccc(cc1C)Br 11a_100000221803_100000210968 [1,1,0,0,0,0|1,0,1]=4 1996 B15R1.16836 COCC(=O)N(C)c1ccc(cc1C)Br 1626a_100000221803_100000210968 [1,1,0,0,0,0|1,0,1]=4 1997 B15R1.16836 COCC(=O)N(C)c1ccc(cc1C)Cl 11a_114849113698_100000210968 [1,1,0,0,0,0|1,0,1]=4 1998 B15R1.16836 COCC(=O)N(C)c1ccc(cc1C)Cl 1626a_114849113698_100000210968 [1,1,0,0,0,0|1,0,1]=4 1999 B15R1.16836 COCC(=O)N(C)c1ccc(cc1C)O 22a_100161107805_100000210968 [1,1,0,0,0,0|1,0,1]=4 2000 B15R1.16836 COCC(=O)N(C)c1ccc(cc1C)O 527a_100161107805_100000210968 [1,1,0,0,0,0|1,0,1]=4 2001 B15R1.16836 CSCC(=O)N(C)c1ccc(cc1C)Br 11a_100000221803_100000184570 [1,1,0,0,0,0|1,0,1]=4 2002 B15R1.16836 CSCC(=O)N(C)c1ccc(cc1C)Br 1626a_100000221803_100000184570 [1,1,0,0,0,0|1,0,1]=4 2003 B15R1.16836 CSCC(=O)N(C)c1ccc(cc1C)Cl 11a_114849113698_100000184570 [1,1,0,0,0,0|1,0,1]=4 2004 B15R1.16836 CSCC(=O)N(C)c1ccc(cc1C)Cl 1626a_114849113698_100000184570 [1,1,0,0,0,0|1,0,1]=4 2005 B15R1.16836 CSCC(=O)N(C)c1ccc(cc1C)O 22a_100161107805_100000184570 [1,1,0,0,0,0|1,0,1]=4 2006 B15R1.16836 CSCC(=O)N(C)c1ccc(cc1C)O 527a_100161107805_100000184570 [1,1,0,0,0,0|1,0,1]=4 2007 B15R1.16836 Cc1cc(ccc1N(C)C(=O)C=CBr)Br 1626a_100000221803_100016273825 [1,1,0,0,0,0|1,0,0]=3 2008 B15R1.16836 Cc1cc(ccc1N(C)C(=O)C=CBr)Cl 1626a_114849113698_100016273825 [1,1,0,0,0,0|1,0,0]=3 2009 B15R1.16836 Cc1cc(ccc1N(C)C(=O)C=CCl)Br 11a_100000221803_200016279998 [1,1,0,0,0,0|1,0,0]=3 2010 B15R1.16836 Cc1cc(ccc1N(C)C(=O)C=CCl)Br 1626a_100000221803_200016279998 [1,1,0,0,0,0|1,0,0]=3 2011 B15R1.16836 Cc1cc(ccc1N(C)C(=O)C=CCl)Cl 11a_114849113698_200016279998 [1,1,0,0,0,0|1,0,0]=3 2012 B15R1.16836 Cc1cc(ccc1N(C)C(=O)C=CCl)Cl 1626a_114849113698_200016279998 [1,1,0,0,0,0|1,0,0]=3 2013 B15R1.16836 Cc1cc(ccc1N(C)C(=O)C=CI)Br 1626a_100000221803_100016256311 [1,1,0,0,0,0|1,0,0]=3 2014 B15R1.16836 Cc1cc(ccc1N(C)C(=O)C=CI)Cl 1626a_114849113698_100016256311 [1,1,0,0,0,0|1,0,0]=3 2015 B15R1.16836 Cc1ccc(c(c1)Br)N(C)C(=O)C=CBr 1626a_100000221369_100016273825 [1,1,0,0,0,0|2,0,0]=4 2016 B15R1.16836 Cc1ccc(c(c1)Br)N(C)C(=O)C=CCl 11a_100000221369_200016279998 [1,1,0,0,0,0|2,0,0]=4 2017 B15R1.16836 Cc1ccc(c(c1)Br)N(C)C(=O)C=CCl 1626a_100000221369_200016279998 [1,1,0,0,0,0|2,0,0]=4 2018 B15R1.16836 Cc1ccc(c(c1)Br)N(C)C(=O)C=CI 1626a_100000221369_100016256311 [1,1,0,0,0,0|2,0,0]=4 2019 B15R1.51699 C=CCC(=O)N(C)c1c(cccc1C)C 11a_100011645471_100000210193 [1,1,0,0,0,0|0,0,2]=4 2020 B15R1.51699 C=CCC(=O)N(C)c1c(cccc1C)C 1626a_100011645471_100000210193 [1,1,0,0,0,0|0,0,2]=4 2021 B15R1.51699 CC=CC(=O)N(C)c1c(cccc1C)C 11a_100011645471_100000210699 [1,1,0,0,0,0|0,0,0]=2 2022 B15R1.51699 CC=CC(=O)N(C)c1c(cccc1C)C 1626a_100011645471_100000210699 [1,1,0,0,0,0|0,0,0]=2 2023 B15R1.51699 CC=CC(=O)N(C)c1c(cccc1Cl)Cl 11a_100000691019_100000210699 [1,1,0,0,0,0|1,0,0]=3 2024 B15R1.51699 CC=CC(=O)N(C)c1c(cccc1Cl)Cl 1626a_100000691019_100000210699 [1,1,0,0,0,0|1,0,0]=3 2025 B15R1.51699 CC=CC(=O)N(C)c1c(cccc1F)F 11a_100000743377_100000210699 [1,1,0,0,0,0|1,0,0]=3 2026 B15R1.51699 CC=CC(=O)N(C)c1c(cccc1F)F 1626a_100000743377_100000210699 [1,1,0,0,0,0|1,0,0]=3 2027 B15R1.51699 CCCC(=O)N(C)c1c(cccc1C)C 11a_100011645471_100000211992 [1,1,0,0,0,0|0,0,2]=4 2028 B15R1.51699 CCCC(=O)N(C)c1c(cccc1C)C 1626a_100011645471_100000211992 [1,1,0,0,0,0|0,0,2]=4 2029 B15R1.51699 CCNC(=O)N(C)c1c(cccc1C)C 512a_100011645471_100015525214 [1,1,0,0,0,0|1,0,1]=4 2030 B15R1.51699 CCNC(=O)N(C)c1c(cccc1C)C 512a_100015525214_100011645471 [1,1,0,0,0,0|1,0,1]=4 2031 B15R1.51699 CN(C(=O)C=CBr)c1c(cccc1Cl)Cl 1626a_100000691019_100016273825 [1,1,0,0,0,0|2,0,0]=4 2032 B15R1.51699 CN(C(=O)C=CBr)c1c(cccc1F)F 1626a_100000743377_100016273825 [1,1,0,0,0,0|2,0,0]=4 2033 B15R1.51699 CN(C(=O)C=CCl)c1c(cccc1Cl)Cl 11a_100000691019_200016279998 [1,1,0,0,0,0|2,0,0]=4 2034 B15R1.51699 CN(C(=O)C=CCl)c1c(cccc1Cl)Cl 1626a_100000691019_200016279998 [1,1,0,0,0,0|2,0,0]=4 2035 B15R1.51699 CN(C(=O)C=CCl)c1c(cccc1F)F 11a_100000743377_200016279998 [1,1,0,0,0,0|2,0,0]=4 2036 B15R1.51699 CN(C(=O)C=CCl)c1c(cccc1F)F 1626a_100000743377_200016279998 [1,1,0,0,0,0|2,0,0]=4 2037 B15R1.51699 CN(C(=O)C=CI)c1c(cccc1Cl)Cl 1626a_100000691019_100016256311 [1,1,0,0,0,0|2,0,0]=4 2038 B15R1.51699 CN(C(=O)C=CI)c1c(cccc1F)F 1626a_100000743377_100016256311 [1,1,0,0,0,0|2,0,0]=4 2039 B15R1.51699 CNNC(=O)N(C)c1c(cccc1C)C 512a_100011645471_100016993582 [1,1,0,0,0,0|2,0,0]=4 2040 B15R1.51699 CNNC(=O)N(C)c1c(cccc1C)C 512a_100016993582_100011645471 [1,1,0,0,0,0|2,0,0]=4 2041 B15R1.51699 COCC(=O)N(C)c1c(cccc1C)C 11a_100011645471_100000210968 [1,1,0,0,0,0|1,0,1]=4 2042 B15R1.51699 COCC(=O)N(C)c1c(cccc1C)C 1626a_100011645471_100000210968 [1,1,0,0,0,0|1,0,1]=4 2043 B15R1.51699 CSCC(=O)N(C)c1c(cccc1C)C 11a_100011645471_100000184570 [1,1,0,0,0,0|1,0,1]=4 2044 B15R1.51699 CSCC(=O)N(C)c1c(cccc1C)C 1626a_100011645471_100000184570 [1,1,0,0,0,0|1,0,1]=4 2045 B15R1.51699 Cc1cccc(c1N(C)C(=O)C=CBr)C 1626a_100011645471_100016273825 [1,1,0,0,0,0|1,0,0]=3 2046 B15R1.51699 Cc1cccc(c1N(C)C(=O)C=CCl)C 11a_100011645471_200016279998 [1,1,0,0,0,0|1,0,0]=3 2047 B15R1.51699 Cc1cccc(c1N(C)C(=O)C=CCl)C 1626a_100011645471_200016279998 [1,1,0,0,0,0|1,0,0]=3 2048 B15R1.51699 Cc1cccc(c1N(C)C(=O)C=CI)C 1626a_100011645471_100016256311 [1,1,0,0,0,0|1,0,0]=3 2049 B15R1.933 C=CC(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100000185746 [1,1,0,0,0,0|0,0,0]=2 2050 B15R1.933 C=CC(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100000185746 [1,1,0,0,0,0|0,0,0]=2 2051 B15R1.933 C=CC(C)N(CC)c1cccc(c1C)C 269982a_100000219776_100011215867 [1,1,0,0,0,0|1,0,1]=4 2052 B15R1.933 CCC(=O)N(CC)c1cccc(c1C)C 11a_100000219776_100000210414 [1,1,0,0,0,0|0,0,1]=3 2053 B15R1.933 CCC(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100000210414 [1,1,0,0,0,0|0,0,1]=3 2054 B15R1.933 CCC(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100000210414 [1,1,0,0,0,0|0,0,1]=3 2055 B15R1.933 CCN(C(=O)CO)c1cccc(c1C)C 22a_100000219776_100000210174 [1,1,0,0,0,0|1,0,1]=4 2056 B15R1.933 CCN(C(=O)NC)c1cccc(c1C)C 512a_100000219776_100102657272 [1,1,0,0,0,0|1,0,0]=3 2057 B15R1.933 CCN(C(=O)NC)c1cccc(c1C)C 512a_106832991638_100000219776 [1,1,0,0,0,0|1,0,0]=3 2058 B15R1.3203 C=CC(=O)N(c1ccccc1Br)C(C)C 1626a_100000219599_100000185746 [1,1,0,0,0,0|1,0,0]=3 2059 B15R1.3203 C=CC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000185746 [1,1,0,0,0,0|0,0,0]=2 2060 B15R1.3203 C=CC(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100000185746 [1,1,0,0,0,0|1,0,0]=3 2061 B15R1.3203 C=CC(=O)N(c1ccccc1F)C(C)C 1626a_100000220358_100000185746 [1,1,0,0,0,0|1,0,0]=3 2062 B15R1.3203 C=CC(C)N(c1ccccc1C)C(C)C 269982a_100000219700_100011215867 [1,1,0,0,0,0|1,0,1]=4 2063 B15R1.3203 CCC(=O)C(c1ccccc1C)C(C)C 1458a_200011667393_100000210202 [1,1,0,0,0,0|1,0,1]=4 2064 B15R1.3203 CCC(=O)N(c1ccccc1Br)C(C)C 1626a_100000219599_100000210414 [1,1,0,0,0,0|1,0,1]=4 2065 B15R1.3203 CCC(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000210414 [1,1,0,0,0,0|0,0,1]=3 2066 B15R1.3203 CCC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000210414 [1,1,0,0,0,0|0,0,1]=3 2067 B15R1.3203 CCC(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100000210414 [1,1,0,0,0,0|1,0,1]=4 2068 B15R1.3203 CCC(=O)N(c1ccccc1F)C(C)C 11a_100000220358_100000210414 [1,1,0,0,0,0|1,0,1]=4 2069 B15R1.3203 CCC(=O)N(c1ccccc1F)C(C)C 1626a_100000220358_100000210414 [1,1,0,0,0,0|1,0,1]=4 2070 B15R1.3203 CNC(=O)C(c1ccccc1C)C(C)C 11a_106832991635_200011667393 [1,1,0,0,0,0|2,0,0]=4 2071 B15R1.3203 CNC(=O)C(c1ccccc1C)C(C)C 1626a_100102657272_200011667393 [1,1,0,0,0,0|2,0,0]=4 2072 B15R1.3203 CNC(=O)C(c1ccccc1C)C(C)C 240690a_100102657272_200011667393 [1,1,0,0,0,0|2,0,0]=4 2073 B15R1.3203 CNC(=O)C(c1ccccc1C)C(C)C 527a_100102657272_200011667393 [1,1,0,0,0,0|2,0,0]=4 2074 B15R1.3203 CNC(=O)N(c1ccccc1Br)C(C)C 512a_100000219599_100102657272 [1,1,0,0,0,0|2,0,0]=4 2075 B15R1.3203 CNC(=O)N(c1ccccc1C)C(C)C 512a_100000219700_100102657272 [1,1,0,0,0,0|1,0,0]=3 2076 B15R1.3203 CNC(=O)N(c1ccccc1Cl)C(C)C 512a_100000219376_100102657272 [1,1,0,0,0,0|2,0,0]=4 2077 B15R1.3203 CNC(=O)N(c1ccccc1F)C(C)C 512a_100000220358_100102657272 [1,1,0,0,0,0|2,0,0]=4 2078 B15R1.3211 C=CC(F)(F)N(CC)c1ccccc1C 269982a_100000211084_100009814244 [1,1,0,0,0,0|1,0,1]=4 2079 B15R1.3963 C=C(Br)C(=O)N(CC)c1ccccc1Br 11a_114873767003_100009813364 [1,1,0,0,0,0|1,0,0]=3 2080 B15R1.3963 C=C(Br)C(=O)N(CC)c1ccccc1Br 1626a_114873767003_100009813364 [1,1,0,0,0,0|1,0,0]=3 2081 B15R1.3963 C=C(Br)C(=O)N(CC)c1ccccc1C 11a_100000211084_100009813364 [1,1,0,0,0,0|0,0,0]=2 2082 B15R1.3963 C=C(Br)C(=O)N(CC)c1ccccc1C 1626a_100000211084_100009813364 [1,1,0,0,0,0|0,0,0]=2 2083 B15R1.3963 C=C(Br)C(=O)N(CC)c1ccccc1F 11a_100000220365_100009813364 [1,1,0,0,0,0|1,0,0]=3 2084 B15R1.3963 C=C(Br)C(=O)N(CC)c1ccccc1F 1626a_100000220365_100009813364 [1,1,0,0,0,0|1,0,0]=3 2085 B15R1.3963 C=C(C)C(=O)N(CC)c1ccccc1Br 11a_114873767003_100000185857 [1,1,0,0,0,0|1,0,0]=3 2086 B15R1.3963 C=C(C)C(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000185857 [1,1,0,0,0,0|1,0,0]=3 2087 B15R1.3963 C=C(C)C(=O)N(CC)c1ccccc1C 11a_100000211084_100000185857 [1,1,0,0,0,0|0,0,0]=2 2088 B15R1.3963 C=C(C)C(=O)N(CC)c1ccccc1C 1626a_100000211084_100000185857 [1,1,0,0,0,0|0,0,0]=2 2089 B15R1.3963 C=C(C)C(=O)N(CC)c1ccccc1C 22a_100000211084_100000185857 [1,1,0,0,0,0|0,0,0]=2 2090 B15R1.3963 C=C(C)C(=O)N(CC)c1ccccc1F 11a_100000220365_100000185857 [1,1,0,0,0,0|1,0,0]=3 2091 B15R1.3963 C=C(C)C(=O)N(CC)c1ccccc1F 1626a_100000220365_100000185857 [1,1,0,0,0,0|1,0,0]=3 2092 B15R1.3963 C=C(C)C(=O)N(CC)c1ccccc1O 22a_103624766699_100000185857 [1,1,0,0,0,0|1,0,0]=3 2093 B15R1.3963 C=C(Cl)C(=O)N(CC)c1ccccc1Br 11a_114873767003_100000039160 [1,1,0,0,0,0|1,0,0]=3 2094 B15R1.3963 C=C(Cl)C(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000039160 [1,1,0,0,0,0|1,0,0]=3 2095 B15R1.3963 C=C(Cl)C(=O)N(CC)c1ccccc1C 11a_100000211084_100000039160 [1,1,0,0,0,0|0,0,0]=2 2096 B15R1.3963 C=C(Cl)C(=O)N(CC)c1ccccc1C 1626a_100000211084_100000039160 [1,1,0,0,0,0|0,0,0]=2 2097 B15R1.3963 C=C(Cl)C(=O)N(CC)c1ccccc1C 22a_100000211084_100000039160 [1,1,0,0,0,0|0,0,0]=2 2098 B15R1.3963 C=C(Cl)C(=O)N(CC)c1ccccc1F 11a_100000220365_100000039160 [1,1,0,0,0,0|1,0,0]=3 2099 B15R1.3963 C=C(Cl)C(=O)N(CC)c1ccccc1F 1626a_100000220365_100000039160 [1,1,0,0,0,0|1,0,0]=3 2100 B15R1.3963 C=C(Cl)C(=O)N(CC)c1ccccc1O 22a_103624766699_100000039160 [1,1,0,0,0,0|1,0,0]=3 2101 B15R1.3963 C=C(F)C(=O)N(CC)c1ccccc1Br 11a_114873767003_100000036797 [1,1,0,0,0,0|1,0,0]=3 2102 B15R1.3963 C=C(F)C(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000036797 [1,1,0,0,0,0|1,0,0]=3 2103 B15R1.3963 C=C(F)C(=O)N(CC)c1ccccc1C 11a_100000211084_100000036797 [1,1,0,0,0,0|0,0,0]=2 2104 B15R1.3963 C=C(F)C(=O)N(CC)c1ccccc1C 1626a_100000211084_100000036797 [1,1,0,0,0,0|0,0,0]=2 2105 B15R1.3963 C=C(F)C(=O)N(CC)c1ccccc1C 22a_100000211084_100000036797 [1,1,0,0,0,0|0,0,0]=2 2106 B15R1.3963 C=C(F)C(=O)N(CC)c1ccccc1F 11a_100000220365_100000036797 [1,1,0,0,0,0|1,0,0]=3 2107 B15R1.3963 C=C(F)C(=O)N(CC)c1ccccc1F 1626a_100000220365_100000036797 [1,1,0,0,0,0|1,0,0]=3 2108 B15R1.3963 C=C(F)C(=O)N(CC)c1ccccc1O 22a_103624766699_100000036797 [1,1,0,0,0,0|1,0,0]=3 2109 B15R1.3963 CCN(C(=O)C(=O)N)c1ccccc1C 22a_100000211084_100011215815 [1,1,0,0,0,0|1,0,0]=3 2110 B15R1.3963 CCN(C(=O)C(=O)N)c1ccccc1O 22a_103624766699_100011215815 [1,1,0,0,0,0|2,0,0]=4 2111 B15R1.3963 CCN(C(=O)C(C)C)c1ccccc1Br 11a_114873767003_100000210198 [1,1,0,0,0,0|1,0,1]=4 2112 B15R1.3963 CCN(C(=O)C(C)C)c1ccccc1Br 1626a_114873767003_100000210198 [1,1,0,0,0,0|1,0,1]=4 2113 B15R1.3963 CCN(C(=O)C(C)C)c1ccccc1C 11a_100000211084_100000210198 [1,1,0,0,0,0|0,0,1]=3 2114 B15R1.3963 CCN(C(=O)C(C)C)c1ccccc1C 1626a_100000211084_100000210198 [1,1,0,0,0,0|0,0,1]=3 2115 B15R1.3963 CCN(C(=O)C(C)C)c1ccccc1C 22a_100000211084_100000210198 [1,1,0,0,0,0|0,0,1]=3 2116 B15R1.3963 CCN(C(=O)C(C)C)c1ccccc1F 11a_100000220365_100000210198 [1,1,0,0,0,0|1,0,1]=4 2117 B15R1.3963 CCN(C(=O)C(C)C)c1ccccc1F 1626a_100000220365_100000210198 [1,1,0,0,0,0|1,0,1]=4 2118 B15R1.3963 CCN(C(=O)C(C)C)c1ccccc1O 22a_103624766699_100000210198 [1,1,0,0,0,0|1,0,1]=4 2119 B15R1.3963 CCN(C(=O)C(C)F)c1ccccc1Br 11a_114873767003_100000062450 [1,1,0,0,0,0|1,0,1]=4 2120 B15R1.3963 CCN(C(=O)C(C)F)c1ccccc1Br 1626a_114873767003_100000062450 [1,1,0,0,0,0|1,0,1]=4 2121 B15R1.3963 CCN(C(=O)C(C)F)c1ccccc1C 11a_100000211084_100000062450 [1,1,0,0,0,0|0,0,1]=3 2122 B15R1.3963 CCN(C(=O)C(C)F)c1ccccc1C 1626a_100000211084_100000062450 [1,1,0,0,0,0|0,0,1]=3 2123 B15R1.3963 CCN(C(=O)C(C)F)c1ccccc1C 22a_100000211084_100000062450 [1,1,0,0,0,0|0,0,1]=3 2124 B15R1.3963 CCN(C(=O)C(C)F)c1ccccc1F 11a_100000220365_100000062450 [1,1,0,0,0,0|1,0,1]=4 2125 B15R1.3963 CCN(C(=O)C(C)F)c1ccccc1F 1626a_100000220365_100000062450 [1,1,0,0,0,0|1,0,1]=4 2126 B15R1.3963 CCN(C(=O)C(C)F)c1ccccc1O 22a_103624766699_100000062450 [1,1,0,0,0,0|1,0,1]=4 2127 B15R1.3963 CCN(C(=O)C(F)F)c1ccccc1C 11a_100000211084_100000210393 [1,1,0,0,0,0|1,0,1]=4 2128 B15R1.3963 CCN(C(=O)C(F)F)c1ccccc1C 1626a_100000211084_100000210393 [1,1,0,0,0,0|1,0,1]=4 2129 B15R1.3963 CCN(C(=O)C(F)F)c1ccccc1C 22a_100000211084_100000210393 [1,1,0,0,0,0|1,0,1]=4 2130 B15R1.3963 CCN(C(=O)C(O)O)c1ccccc1C 22a_100000211084_100000233687 [1,1,0,0,0,0|1,0,1]=4 2131 B15R1.3963 CCN(C(=O)[C@@H](C)O)c1ccccc1C 22a_100000211084_100000717761 [1,1,0,0,0,0|0,0,1]=3 2132 B15R1.3963 CCN(C(=O)[C@@H](C)O)c1ccccc1O 22a_103624766699_100000717761 [1,1,0,0,0,0|1,0,1]=4 2133 B15R1.3963 CCN(C(=O)[C@H](C)O)c1ccccc1Br 1626a_114873767003_217856618621 [1,1,0,0,0,0|1,0,1]=4 2134 B15R1.3963 CCN(C(=O)[C@H](C)O)c1ccccc1C 1626a_100000211084_217856618621 [1,1,0,0,0,0|0,0,1]=3 2135 B15R1.3963 CCN(C(=O)[C@H](C)O)c1ccccc1C 22a_100000211084_217856618621 [1,1,0,0,0,0|0,0,1]=3 2136 B15R1.3963 CCN(C(=O)[C@H](C)O)c1ccccc1F 1626a_100000220365_217856618621 [1,1,0,0,0,0|1,0,1]=4 2137 B15R1.3963 CCN(C(=O)[C@H](C)O)c1ccccc1O 22a_103624766699_217856618621 [1,1,0,0,0,0|1,0,1]=4 2138 B15R1.3963 CCN(c1ccccc1C)C(C)C(=O)C 2230a_100000211084_100009814033 [1,1,0,0,0,0|1,0,1]=4 2139 B15R1.3963 CCN(c1ccccc1C)C(C)C(=O)C 269982a_100000211084_100009814033 [1,1,0,0,0,0|1,0,1]=4 2140 B15R1.4555 C=CC(=O)N(CC)c1ccccc1C#N 1626a_200000218880_100000185746 [1,1,0,0,0,0|0,0,1]=3 2141 B15R1.4555 C=CC(=O)N(CC)c1ccccc1OC 1626a_100020603010_100000185746 [1,1,0,0,0,0|0,0,0]=2 2142 B15R1.4555 C=CC(=O)N(CC)c1ccccc1OC 22a_100020603010_100000185746 [1,1,0,0,0,0|0,0,0]=2 2143 B15R1.4555 C=CC(C)N(CC)c1ccccc1OC 269982a_100020603010_100011215867 [1,1,0,0,0,0|1,0,1]=4 2144 B15R1.4555 CCC(=O)N(CC)c1ccccc1C#N 1626a_200000218880_100000210414 [1,1,0,0,0,0|0,0,2]=4 2145 B15R1.4555 CCC(=O)N(CC)c1ccccc1OC 11a_100020603010_100000210414 [1,1,0,0,0,0|0,0,1]=3 2146 B15R1.4555 CCC(=O)N(CC)c1ccccc1OC 1626a_100020603010_100000210414 [1,1,0,0,0,0|0,0,1]=3 2147 B15R1.4555 CCC(=O)N(CC)c1ccccc1OC 22a_100020603010_100000210414 [1,1,0,0,0,0|0,0,1]=3 2148 B15R1.4555 CCN(C(=O)CO)c1ccccc1OC 22a_100020603010_100000210174 [1,1,0,0,0,0|1,0,1]=4 2149 B15R1.4555 CCN(C(=O)NC)c1ccccc1C#N 512a_200000218880_100102657272 [1,1,0,0,0,0|1,0,1]=4 2150 B15R1.5853 C=CC(=O)N(CCC)c1ccccc1F 1626a_100011231789_100000185746 [1,1,0,0,0,0|1,0,0]=3 2151 B15R1.5853 C=CC(C)N(CCO)c1ccccc1C 269982a_100011233185_100011215867 [1,1,0,0,0,0|1,0,1]=4 2152 B15R1.5853 CCCN(C(=O)CC)c1ccccc1F 11a_100011231789_100000210414 [1,1,0,0,0,0|1,0,1]=4 2153 B15R1.5853 CCCN(C(=O)CC)c1ccccc1F 1626a_100011231789_100000210414 [1,1,0,0,0,0|1,0,1]=4 2154 B15R1.5853 CCCN(C(=O)NC)c1ccccc1F 512a_100011231789_100102657272 [1,1,0,0,0,0|2,0,0]=4 2155 B15R1.5853 CNC(=O)N(CCO)c1ccccc1C 512a_106832991638_100011233185 [1,1,0,0,0,0|1,0,0]=3 2156 B15R1.8630 CCN(c1ccccc1C)C(C=O)C=O 2230a_100000211084_100000736813 [1,1,0,0,0,0|1,0,1]=4 2157 B15R1.8630 CCN(c1ccccc1C)C(C=O)C=O 34a_100000211084_100000736813 [1,1,0,0,0,0|1,0,1]=4 2158 B15R1.11481 C=CC(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100000185746 [1,1,0,0,0,0|0,0,0]=2 2159 B15R1.11481 C=CC(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100000185746 [1,1,0,0,0,0|0,0,0]=2 2160 B15R1.11481 C=CC(C)N(CC)c1cc(ccc1C)C 269982a_100000743043_100011215867 [1,1,0,0,0,0|1,0,1]=4 2161 B15R1.11481 C=CC(C)N(CC)c1cc(ccc1C)O 269982a_100000211784_100011215867 [1,1,0,0,0,0|1,0,1]=4 2162 B15R1.11481 CCC(=O)N(CC)c1cc(ccc1C)C 11a_100000743043_100000210414 [1,1,0,0,0,0|0,0,1]=3 2163 B15R1.11481 CCC(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100000210414 [1,1,0,0,0,0|0,0,1]=3 2164 B15R1.11481 CCC(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100000210414 [1,1,0,0,0,0|0,0,1]=3 2165 B15R1.11481 CCN(C(=O)CO)c1cc(ccc1C)C 22a_100000743043_100000210174 [1,1,0,0,0,0|1,0,1]=4 2166 B15R1.11481 CCN(C(=O)NC)c1cc(ccc1C)C 512a_100000743043_100102657272 [1,1,0,0,0,0|1,0,0]=3 2167 B15R1.11481 CCN(C(=O)NC)c1cc(ccc1C)C 512a_106832991638_100000743043 [1,1,0,0,0,0|1,0,0]=3 2168 B15R1.11481 CCN(C(=O)NC)c1cc(ccc1C)O 512a_100000211784_100102657272 [1,1,0,0,0,0|1,0,0]=3 2169 B15R1.38934 C=CC(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100000185746 [1,1,0,0,0,0|0,0,0]=2 2170 B15R1.38934 C=CC(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100000185746 [1,1,0,0,0,0|0,0,0]=2 2171 B15R1.38934 C=CC(=O)N(CC)c1ccc(cc1Cl)Cl 1626a_100160557746_100000185746 [1,1,0,0,0,0|1,0,0]=3 2172 B15R1.38934 C=CC(C)N(CC)c1ccc(cc1C)F 269982a_100000221679_100011215867 [1,1,0,0,0,0|1,0,1]=4 2173 B15R1.38934 CCC(=O)N(CC)c1ccc(cc1C)F 11a_100000221679_100000210414 [1,1,0,0,0,0|0,0,1]=3 2174 B15R1.38934 CCC(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100000210414 [1,1,0,0,0,0|0,0,1]=3 2175 B15R1.38934 CCC(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100000210414 [1,1,0,0,0,0|0,0,1]=3 2176 B15R1.38934 CCC(=O)N(CC)c1ccc(cc1Cl)Cl 11a_100160557746_100000210414 [1,1,0,0,0,0|1,0,1]=4 2177 B15R1.38934 CCC(=O)N(CC)c1ccc(cc1Cl)Cl 1626a_100160557746_100000210414 [1,1,0,0,0,0|1,0,1]=4 2178 B15R1.38934 CCN(C(=O)CO)c1ccc(cc1C)F 22a_100000221679_100000210174 [1,1,0,0,0,0|1,0,1]=4 2179 B15R1.38934 CCN(C(=O)NC)c1ccc(cc1C)F 512a_100000221679_100102657272 [1,1,0,0,0,0|1,0,0]=3 2180 B15R1.38934 CCN(C(=O)NC)c1ccc(cc1C)F 512a_106832991638_100000221679 [1,1,0,0,0,0|1,0,0]=3 2181 B17R1.1618 C=COC(=O)CN(CC)c1cccc(c1C)C 2230a_100000219776_100000036128 [0,1,0,0,0,1|1,0,1]=4 2182 B17R1.1618 C=COC(=O)CN(CC)c1cccc(c1C)C 269982a_100000219776_100000036128 [0,1,0,0,0,1|1,0,1]=4 2183 B17R1.1618 C=COC(=O)CN(CC)c1cccc(c1C)C 34a_100000219776_100000036128 [0,1,0,0,0,1|1,0,1]=4 2184 B17R1.1618 CCCC(=O)CN(CC)c1cccc(c1C)C 2230a_100000219776_100000747444 [0,1,0,0,0,1|0,0,2]=4 2185 B17R1.1618 CCCC(=O)CN(CC)c1cccc(c1C)C 269982a_100000219776_100000747444 [0,1,0,0,0,1|0,0,2]=4 2186 B17R1.1618 CCCC(=O)CN(CC)c1cccc(c1C)C 7a_100000219776_100000747444 [0,1,0,0,0,1|0,0,2]=4 2187 B17R1.1618 CCNC(=O)CN(CC)c1cccc(c1C)C 2230a_100000219776_100000183381 [0,1,0,0,0,1|1,0,1]=4 2188 B17R1.1618 CCNC(=O)CN(CC)c1cccc(c1C)C 269982a_100000219776_100000183381 [0,1,0,0,0,1|1,0,1]=4 2189 B17R1.1618 CCNC(=O)CN(CC)c1cccc(c1C)C 34a_100000219776_100000183381 [0,1,0,0,0,1|1,0,1]=4 2190 B17R1.1618 CCNC(=O)CN(CC)c1cccc(c1C)C 7a_100000219776_100000183381 [0,1,0,0,0,1|1,0,1]=4 2191 B17R1.1618 CCOC(=O)CN(CC)c1cccc(c1C)C 2230a_100000219776_100000188475 [0,1,0,0,0,1|1,0,1]=4 2192 B17R1.1618 CCOC(=O)CN(CC)c1cccc(c1C)C 269982a_100000219776_100000188475 [0,1,0,0,0,1|1,0,1]=4 2193 B17R1.1618 CCOC(=O)CN(CC)c1cccc(c1C)C 34a_100000219776_100000188475 [0,1,0,0,0,1|1,0,1]=4 2194 B17R1.1618 CCOC(=O)CN(CC)c1cccc(c1C)C 7a_100000219776_100000188475 [0,1,0,0,0,1|1,0,1]=4 2195 B17R1.16755 CCC(NC(=O)C=C(C)C)c1ncccc1C 11a_200011536107_100000211388 [0,1,0,0,0,1|2,0,0]=4 2196 B17R1.16755 CCC(NC(=O)C=C(C)C)c1ncccc1C 1626a_200011536107_100000211388 [0,1,0,0,0,1|2,0,0]=4 2197 B17R1.16755 CCC(NC(=O)C=C(C)C)c1ncccc1C 240690a_200011536107_100000211388 [0,1,0,0,0,1|2,0,0]=4 2198 B17R1.16755 CCC(NC(=O)C=C(C)Cl)c1ncccc1C 11a_200011536107_200042562850 [0,1,0,0,0,1|2,0,0]=4 2199 B17R1.16755 CCC(NC(=O)C=C(C)Cl)c1ncccc1C 1626a_200011536107_200042562850 [0,1,0,0,0,1|2,0,0]=4 2200 B17R1.16755 CCC(NC(=O)C=C(C)Cl)c1ncccc1C 240690a_200011536107_200042562850 [0,1,0,0,0,1|2,0,0]=4 2201 B17R1.16755 CCC(NC(=O)C=C(C)I)c1ncccc1C 11a_200011536107_100025716642 [0,1,0,0,0,1|2,0,0]=4 2202 B17R1.16755 CCC(NC(=O)C=C(C)I)c1ncccc1C 1626a_200011536107_100025716642 [0,1,0,0,0,1|2,0,0]=4 2203 B17R1.16755 CCN(CC(=O)NC(=O)C)c1ccccc1Br 269982a_114873767003_100000183797 [0,1,0,0,0,1|2,0,0]=4 2204 B17R1.16755 CCN(CC(=O)NC(=O)C)c1ccccc1C 269982a_100000211084_100000183797 [0,1,0,0,0,1|1,0,0]=3 2205 B17R1.16755 CCN(CC(=O)NC(=O)C)c1ccccc1F 269982a_100000220365_100000183797 [0,1,0,0,0,1|2,0,0]=4 2206 B17R1.16755 CCN(CC(=O)NC(=O)C)c1ccccc1O 269982a_103624766699_100000183797 [0,1,0,0,0,1|2,0,0]=4 2207 B17R1.16755 CCN(CC(=O)NC(=O)N)c1ccccc1C 2230a_100000211084_100000182717 [0,1,0,0,0,1|2,0,0]=4 2208 B17R1.16755 CCN(CC(=O)NC(=O)N)c1ccccc1C 269982a_100000211084_100000182717 [0,1,0,0,0,1|2,0,0]=4 2209 B17R1.16755 CCN(CC(=O)NC(C)C)c1ccccc1C 2230a_100000211084_100000183996 [0,1,0,0,0,1|1,0,1]=4 2210 B17R1.16755 CCN(CC(=O)NC(C)C)c1ccccc1C 269982a_100000211084_100000183996 [0,1,0,0,0,1|1,0,1]=4 2211 B17R1.16755 CCN(CC(=O)NC(C)C)c1ccccc1C 34a_100000211084_100000183996 [0,1,0,0,0,1|1,0,1]=4 2212 B17R1.16755 CCN(CC(=O)OC(C)C)c1ccccc1C 2230a_100000211084_100011215430 [0,1,0,0,0,1|1,0,1]=4 2213 B17R1.16755 CCN(CC(=O)OC(C)C)c1ccccc1C 269982a_100000211084_100011215430 [0,1,0,0,0,1|1,0,1]=4 2214 B17R1.16755 CCN(CC(=O)OC(C)C)c1ccccc1C 34a_100000211084_100011215430 [0,1,0,0,0,1|1,0,1]=4 2215 B17R1.16755 CC[C@H](NC(=O)C=C(C)C)c1ccccc1Cl 11a_200016987949_100000211388 [0,1,0,0,0,1|2,0,0]=4 2216 B17R1.16755 CC[C@H](NC(=O)C=C(C)C)c1ccccc1Cl 1626a_200016987949_100000211388 [0,1,0,0,0,1|2,0,0]=4 2217 B17R1.16755 CC[C@H](NC(=O)C=C(C)C)c1ccccc1Cl 240690a_200016987949_100000211388 [0,1,0,0,0,1|2,0,0]=4 2218 B17R1.16755 CC[C@H](NC(=O)C=C(C)C)c1ccccc1F 11a_100015190424_100000211388 [0,1,0,0,0,1|2,0,0]=4 2219 B17R1.16755 CC[C@H](NC(=O)C=C(C)C)c1ccccc1F 1626a_100015190424_100000211388 [0,1,0,0,0,1|2,0,0]=4 2220 B17R1.16755 CC[C@H](NC(=O)C=C(C)C)c1ccccc1F 240690a_100015190424_100000211388 [0,1,0,0,0,1|2,0,0]=4 2221 B17R1.16755 CC[C@H](NC(=O)C=C(C)Cl)c1ccccc1Cl 11a_200016987949_200042562850 [0,1,0,0,0,1|2,0,0]=4 2222 B17R1.16755 CC[C@H](NC(=O)C=C(C)Cl)c1ccccc1Cl 1626a_200016987949_200042562850 [0,1,0,0,0,1|2,0,0]=4 2223 B17R1.16755 CC[C@H](NC(=O)C=C(C)Cl)c1ccccc1Cl 240690a_200016987949_200042562850 [0,1,0,0,0,1|2,0,0]=4 2224 B17R1.16755 CC[C@H](NC(=O)C=C(C)Cl)c1ccccc1F 11a_100015190424_200042562850 [0,1,0,0,0,1|2,0,0]=4 2225 B17R1.16755 CC[C@H](NC(=O)C=C(C)Cl)c1ccccc1F 1626a_100015190424_200042562850 [0,1,0,0,0,1|2,0,0]=4 2226 B17R1.16755 CC[C@H](NC(=O)C=C(C)Cl)c1ccccc1F 240690a_100015190424_200042562850 [0,1,0,0,0,1|2,0,0]=4 2227 B17R1.16755 CC[C@H](NC(=O)C=C(C)I)c1ccccc1Cl 11a_200016987949_100025716642 [0,1,0,0,0,1|2,0,0]=4 2228 B17R1.16755 CC[C@H](NC(=O)C=C(C)I)c1ccccc1Cl 1626a_200016987949_100025716642 [0,1,0,0,0,1|2,0,0]=4 2229 B17R1.16755 CC[C@H](NC(=O)C=C(C)I)c1ccccc1F 11a_100015190424_100025716642 [0,1,0,0,0,1|2,0,0]=4 2230 B17R1.16755 CC[C@H](NC(=O)C=C(C)I)c1ccccc1F 1626a_100015190424_100025716642 [0,1,0,0,0,1|2,0,0]=4 2231 B17R1.22071 C=COC(=O)CN(c1ccccc1C)C(C)C 2230a_100000219700_100000036128 [0,1,0,0,0,1|1,0,1]=4 2232 B17R1.22071 C=COC(=O)CN(c1ccccc1C)C(C)C 269982a_100000219700_100000036128 [0,1,0,0,0,1|1,0,1]=4 2233 B17R1.22071 C=COC(=O)CN(c1ccccc1C)C(C)C 34a_100000219700_100000036128 [0,1,0,0,0,1|1,0,1]=4 2234 B17R1.22071 CCCC(=O)CN(c1ccccc1C)C(C)C 2230a_100000219700_100000747444 [0,1,0,0,0,1|0,0,2]=4 2235 B17R1.22071 CCCC(=O)CN(c1ccccc1C)C(C)C 269982a_100000219700_100000747444 [0,1,0,0,0,1|0,0,2]=4 2236 B17R1.22071 CCCC(=O)CN(c1ccccc1C)C(C)C 7a_100000219700_100000747444 [0,1,0,0,0,1|0,0,2]=4 2237 B17R1.22071 CCNC(=O)CN(c1ccccc1C)C(C)C 2230a_100000219700_100000183381 [0,1,0,0,0,1|1,0,1]=4 2238 B17R1.22071 CCNC(=O)CN(c1ccccc1C)C(C)C 269982a_100000219700_100000183381 [0,1,0,0,0,1|1,0,1]=4 2239 B17R1.22071 CCNC(=O)CN(c1ccccc1C)C(C)C 34a_100000219700_100000183381 [0,1,0,0,0,1|1,0,1]=4 2240 B17R1.22071 CCNC(=O)CN(c1ccccc1C)C(C)C 7a_100000219700_100000183381 [0,1,0,0,0,1|1,0,1]=4 2241 B17R1.22071 CCOC(=O)CN(c1ccccc1C)C(C)C 2230a_100000219700_100000188475 [0,1,0,0,0,1|1,0,1]=4 2242 B17R1.22071 CCOC(=O)CN(c1ccccc1C)C(C)C 2230a_200000219698_100000210206 [0,1,0,0,0,1|1,0,1]=4 2243 B17R1.22071 CCOC(=O)CN(c1ccccc1C)C(C)C 269982a_100000219700_100000188475 [0,1,0,0,0,1|1,0,1]=4 2244 B17R1.22071 CCOC(=O)CN(c1ccccc1C)C(C)C 269982a_200000219698_100000210206 [0,1,0,0,0,1|1,0,1]=4 2245 B17R1.22071 CCOC(=O)CN(c1ccccc1C)C(C)C 34a_100000219700_100000188475 [0,1,0,0,0,1|1,0,1]=4 2246 B17R1.22071 CCOC(=O)CN(c1ccccc1C)C(C)C 7a_100000219700_100000188475 [0,1,0,0,0,1|1,0,1]=4 2247 B17R1.30615 C=COC(=O)CN(CC)c1cc(ccc1C)C 2230a_100000743043_100000036128 [0,1,0,0,0,1|1,0,1]=4 2248 B17R1.30615 C=COC(=O)CN(CC)c1cc(ccc1C)C 269982a_100000743043_100000036128 [0,1,0,0,0,1|1,0,1]=4 2249 B17R1.30615 C=COC(=O)CN(CC)c1cc(ccc1C)C 34a_100000743043_100000036128 [0,1,0,0,0,1|1,0,1]=4 2250 B17R1.30615 C=COC(=O)CN(CC)c1cc(ccc1C)O 269982a_100000211784_100000036128 [0,1,0,0,0,1|1,0,1]=4 2251 B17R1.30615 C=COC(=O)CN(CC)c1cc(ccc1C)O 34a_100000211784_100000036128 [0,1,0,0,0,1|1,0,1]=4 2252 B17R1.30615 CC=CC(=O)N[C@@H](CC)c1cc(ccc1Br)Cl 11a_200015425730_100000210699 [0,1,0,0,0,1|2,0,0]=4 2253 B17R1.30615 CC=CC(=O)N[C@@H](CC)c1cc(ccc1Br)Cl 1626a_200015425730_100000210699 [0,1,0,0,0,1|2,0,0]=4 2254 B17R1.30615 CC=CC(=O)N[C@@H](CC)c1cc(ccc1Br)Cl 240690a_200015425730_100000210699 [0,1,0,0,0,1|2,0,0]=4 2255 B17R1.30615 CC=CC(=O)N[C@@H](CC)c1cc(ccc1F)F 11a_100015190423_100000210699 [0,1,0,0,0,1|2,0,0]=4 2256 B17R1.30615 CC=CC(=O)N[C@@H](CC)c1cc(ccc1F)F 1626a_100015190423_100000210699 [0,1,0,0,0,1|2,0,0]=4 2257 B17R1.30615 CC=CC(=O)N[C@@H](CC)c1cc(ccc1F)F 240690a_100015190423_100000210699 [0,1,0,0,0,1|2,0,0]=4 2258 B17R1.30615 CCCC(=O)CN(CC)c1cc(ccc1C)C 2230a_100000743043_100000747444 [0,1,0,0,0,1|0,0,2]=4 2259 B17R1.30615 CCCC(=O)CN(CC)c1cc(ccc1C)C 269982a_100000743043_100000747444 [0,1,0,0,0,1|0,0,2]=4 2260 B17R1.30615 CCCC(=O)CN(CC)c1cc(ccc1C)C 7a_100000743043_100000747444 [0,1,0,0,0,1|0,0,2]=4 2261 B17R1.30615 CCCC(=O)CN(CC)c1cc(ccc1C)O 269982a_100000211784_100000747444 [0,1,0,0,0,1|0,0,2]=4 2262 B17R1.30615 CCNC(=O)CN(CC)c1cc(ccc1C)C 2230a_100000743043_100000183381 [0,1,0,0,0,1|1,0,1]=4 2263 B17R1.30615 CCNC(=O)CN(CC)c1cc(ccc1C)C 269982a_100000743043_100000183381 [0,1,0,0,0,1|1,0,1]=4 2264 B17R1.30615 CCNC(=O)CN(CC)c1cc(ccc1C)C 34a_100000743043_100000183381 [0,1,0,0,0,1|1,0,1]=4 2265 B17R1.30615 CCNC(=O)CN(CC)c1cc(ccc1C)C 7a_100000743043_100000183381 [0,1,0,0,0,1|1,0,1]=4 2266 B17R1.30615 CCNC(=O)CN(CC)c1cc(ccc1C)O 269982a_100000211784_100000183381 [0,1,0,0,0,1|1,0,1]=4 2267 B17R1.30615 CCNC(=O)CN(CC)c1cc(ccc1C)O 34a_100000211784_100000183381 [0,1,0,0,0,1|1,0,1]=4 2268 B17R1.30615 CCOC(=O)CN(CC)c1cc(ccc1C)C 2230a_100000743043_100000188475 [0,1,0,0,0,1|1,0,1]=4 2269 B17R1.30615 CCOC(=O)CN(CC)c1cc(ccc1C)C 269982a_100000743043_100000188475 [0,1,0,0,0,1|1,0,1]=4 2270 B17R1.30615 CCOC(=O)CN(CC)c1cc(ccc1C)C 34a_100000743043_100000188475 [0,1,0,0,0,1|1,0,1]=4 2271 B17R1.30615 CCOC(=O)CN(CC)c1cc(ccc1C)C 7a_100000743043_100000188475 [0,1,0,0,0,1|1,0,1]=4 2272 B17R1.30615 CCOC(=O)CN(CC)c1cc(ccc1C)O 269982a_100000211784_100000188475 [0,1,0,0,0,1|1,0,1]=4 2273 B17R1.30615 CCOC(=O)CN(CC)c1cc(ccc1C)O 34a_100000211784_100000188475 [0,1,0,0,0,1|1,0,1]=4 2274 B17R1.30632 C=COC(=O)CN(CC)c1ccccc1OC 2230a_100020603010_100000036128 [0,1,0,0,0,1|1,0,1]=4 2275 B17R1.30632 C=COC(=O)CN(CC)c1ccccc1OC 269982a_100020603010_100000036128 [0,1,0,0,0,1|1,0,1]=4 2276 B17R1.30632 CC=CC(=O)NC(CC)c1ccccc1OC 11a_100016991433_100000210699 [0,1,0,0,0,1|1,0,0]=3 2277 B17R1.30632 CC=CC(=O)NC(CC)c1ccccc1OC 1626a_100016991433_100000210699 [0,1,0,0,0,1|1,0,0]=3 2278 B17R1.30632 CC=CC(=O)NC(CC)c1ccccc1OC 240690a_100016991433_100000210699 [0,1,0,0,0,1|1,0,0]=3 2279 B17R1.30632 CC=CC(=O)NC(CO)c1ccccc1OC 240690a_100000756845_100000210699 [0,1,0,0,0,1|2,0,0]=4 2280 B17R1.30632 CCC(NC(=O)C=CBr)c1ccccc1OC 1626a_100016991433_100016273825 [0,1,0,0,0,1|2,0,0]=4 2281 B17R1.30632 CCC(NC(=O)C=CBr)c1ccccc1OC 240690a_100016991433_100016273825 [0,1,0,0,0,1|2,0,0]=4 2282 B17R1.30632 CCC(NC(=O)C=CCl)c1ccccc1OC 11a_100016991433_200016279998 [0,1,0,0,0,1|2,0,0]=4 2283 B17R1.30632 CCC(NC(=O)C=CCl)c1ccccc1OC 1626a_100016991433_200016279998 [0,1,0,0,0,1|2,0,0]=4 2284 B17R1.30632 CCC(NC(=O)C=CCl)c1ccccc1OC 240690a_100016991433_200016279998 [0,1,0,0,0,1|2,0,0]=4 2285 B17R1.30632 CCC(NC(=O)C=CI)c1ccccc1OC 1626a_100016991433_100016256311 [0,1,0,0,0,1|2,0,0]=4 2286 B17R1.30632 CCCC(=O)CN(CC)c1ccccc1OC 2230a_100020603010_100000747444 [0,1,0,0,0,1|0,0,2]=4 2287 B17R1.30632 CCCC(=O)CN(CC)c1ccccc1OC 269982a_100020603010_100000747444 [0,1,0,0,0,1|0,0,2]=4 2288 B17R1.30632 CCNC(=O)CN(CC)c1ccccc1OC 2230a_100020603010_100000183381 [0,1,0,0,0,1|1,0,1]=4 2289 B17R1.30632 CCNC(=O)CN(CC)c1ccccc1OC 269982a_100020603010_100000183381 [0,1,0,0,0,1|1,0,1]=4 2290 B17R1.30632 CCOC(=O)CN(CC)c1ccccc1OC 2230a_100020603010_100000188475 [0,1,0,0,0,1|1,0,1]=4 2291 B17R1.30632 CCOC(=O)CN(CC)c1ccccc1OC 269982a_100020603010_100000188475 [0,1,0,0,0,1|1,0,1]=4 2292 B17R1.107457 C=CCNC(=O)CN(CC)c1ccccc1C 2230a_100000211084_100000183597 [0,1,0,0,0,1|0,0,2]=4 2293 B17R1.107457 C=CCNC(=O)CN(CC)c1ccccc1C 269982a_100000211084_100000183597 [0,1,0,0,0,1|0,0,2]=4 2294 B17R1.107457 C=CCOC(=O)CN(CC)c1ccccc1C 2230a_100000211084_100000033060 [0,1,0,0,0,1|0,0,2]=4 2295 B17R1.107457 C=CCOC(=O)CN(CC)c1ccccc1C 269982a_100000211084_100000033060 [0,1,0,0,0,1|0,0,2]=4 2296 B17R1.107457 C=CCOC(=O)CN(CC)c1ccccc1C 34a_100000211084_100000033060 [0,1,0,0,0,1|0,0,2]=4 2297 B17R1.107457 CC=CCC(=O)NC(CC)c1ncccc1C 11a_200011536107_100121576822 [0,1,0,0,0,1|2,0,0]=4 2298 B17R1.107457 CC=CCC(=O)NC(CC)c1ncccc1C 1626a_200011536107_100121576822 [0,1,0,0,0,1|2,0,0]=4 2299 B17R1.107457 CC=CCC(=O)NC(CC)c1ncccc1C 240690a_200011536107_100121576822 [0,1,0,0,0,1|2,0,0]=4 2300 B17R1.107457 CC=CCC(=O)NC(CC)c1ncccc1C 527a_200011536107_100121576822 [0,1,0,0,0,1|2,0,0]=4 2301 B17R1.107457 CC=CCC(=O)N[C@@H](CC)c1ccccc1Cl 11a_200016987949_100121576822 [0,1,0,0,0,1|2,0,0]=4 2302 B17R1.107457 CC=CCC(=O)N[C@@H](CC)c1ccccc1Cl 1626a_200016987949_100121576822 [0,1,0,0,0,1|2,0,0]=4 2303 B17R1.107457 CC=CCC(=O)N[C@@H](CC)c1ccccc1Cl 240690a_200016987949_100121576822 [0,1,0,0,0,1|2,0,0]=4 2304 B17R1.107457 CC=CCC(=O)N[C@@H](CC)c1ccccc1Cl 527a_200016987949_100121576822 [0,1,0,0,0,1|2,0,0]=4 2305 B17R1.107457 CC=CCC(=O)N[C@@H](CC)c1ccccc1F 11a_100015190424_100121576822 [0,1,0,0,0,1|2,0,0]=4 2306 B17R1.107457 CC=CCC(=O)N[C@@H](CC)c1ccccc1F 1626a_100015190424_100121576822 [0,1,0,0,0,1|2,0,0]=4 2307 B17R1.107457 CC=CCC(=O)N[C@@H](CC)c1ccccc1F 240690a_100015190424_100121576822 [0,1,0,0,0,1|2,0,0]=4 2308 B17R1.107457 CC=CCC(=O)N[C@@H](CC)c1ccccc1F 527a_100015190424_100121576822 [0,1,0,0,0,1|2,0,0]=4 2309 B17R1.107457 CCC(NC(=O)C=COC)c1ncccc1C 1626a_200011536107_100016268678 [0,1,0,0,0,1|2,0,0]=4 2310 B17R1.107457 CCC(NC(=O)C=COC)c1ncccc1C 240690a_200011536107_100016268678 [0,1,0,0,0,1|2,0,0]=4 2311 B17R1.107457 CCC=CC(=O)NC(CC)c1ncccc1C 11a_200011536107_100000212282 [0,1,0,0,0,1|2,0,0]=4 2312 B17R1.107457 CCC=CC(=O)NC(CC)c1ncccc1C 1626a_200011536107_100000212282 [0,1,0,0,0,1|2,0,0]=4 2313 B17R1.107457 CCC=CC(=O)NC(CC)c1ncccc1C 240690a_200011536107_100000212282 [0,1,0,0,0,1|2,0,0]=4 2314 B17R1.107457 CCC=CC(=O)N[C@@H](CC)c1ccccc1Cl 11a_200016987949_100000212282 [0,1,0,0,0,1|2,0,0]=4 2315 B17R1.107457 CCC=CC(=O)N[C@@H](CC)c1ccccc1Cl 1626a_200016987949_100000212282 [0,1,0,0,0,1|2,0,0]=4 2316 B17R1.107457 CCC=CC(=O)N[C@@H](CC)c1ccccc1Cl 240690a_200016987949_100000212282 [0,1,0,0,0,1|2,0,0]=4 2317 B17R1.107457 CCC=CC(=O)N[C@@H](CC)c1ccccc1F 11a_100015190424_100000212282 [0,1,0,0,0,1|2,0,0]=4 2318 B17R1.107457 CCC=CC(=O)N[C@@H](CC)c1ccccc1F 1626a_100015190424_100000212282 [0,1,0,0,0,1|2,0,0]=4 2319 B17R1.107457 CCC=CC(=O)N[C@@H](CC)c1ccccc1F 240690a_100015190424_100000212282 [0,1,0,0,0,1|2,0,0]=4 2320 B17R1.107457 CCCNC(=O)CN(CC)c1ccccc1C 2230a_100000211084_100000183358 [0,1,0,0,0,1|0,0,2]=4 2321 B17R1.107457 CCCNC(=O)CN(CC)c1ccccc1C 269982a_100000211084_100000183358 [0,1,0,0,0,1|0,0,2]=4 2322 B17R1.107457 CCCNC(=O)CN(CC)c1ccccc1C 34a_100000211084_100000183358 [0,1,0,0,0,1|0,0,2]=4 2323 B17R1.107457 CCCOC(=O)CN(CC)c1ccccc1C 2230a_100000211084_200011215008 [0,1,0,0,0,1|0,0,2]=4 2324 B17R1.107457 CCCOC(=O)CN(CC)c1ccccc1C 269982a_100000211084_200011215008 [0,1,0,0,0,1|0,0,2]=4 2325 B17R1.107457 CCCOC(=O)CN(CC)c1ccccc1C 34a_100000211084_200011215008 [0,1,0,0,0,1|0,0,2]=4 2326 B17R1.107457 CC[C@H](NC(=O)C=COC)c1ccccc1Cl 1626a_200016987949_100016268678 [0,1,0,0,0,1|2,0,0]=4 2327 B17R1.107457 CC[C@H](NC(=O)C=COC)c1ccccc1Cl 240690a_200016987949_100016268678 [0,1,0,0,0,1|2,0,0]=4 2328 B17R1.107457 CC[C@H](NC(=O)C=COC)c1ccccc1F 1626a_100015190424_100016268678 [0,1,0,0,0,1|2,0,0]=4 2329 B17R1.107457 CC[C@H](NC(=O)C=COC)c1ccccc1F 240690a_100015190424_100016268678 [0,1,0,0,0,1|2,0,0]=4 2330 B17R1.125270 C=COC(=O)CN(CCO)c1ccccc1C 269982a_100011233185_100000036128 [0,1,0,0,0,1|1,0,1]=4 2331 B17R1.125270 C=COC(=O)CN(CCO)c1ccccc1C 34a_100011233185_100000036128 [0,1,0,0,0,1|1,0,1]=4 2332 B17R1.125270 CC=CC(=O)NC(CCO)c1ccccc1Cl 240690a_100011661560_100000210699 [0,1,0,0,0,1|2,0,0]=4 2333 B17R1.125270 CC=CC(=O)NC(CCO)c1ccccc1F 240690a_100011661569_100000210699 [0,1,0,0,0,1|2,0,0]=4 2334 B17R1.125270 CCCC(=O)CN(CCO)c1ccccc1C 269982a_100011233185_100000747444 [0,1,0,0,0,1|0,0,2]=4 2335 B17R1.125270 CCCN(CC(=O)OCC)c1ccccc1C 2230a_200000219698_100000210303 [0,1,0,0,0,1|1,0,1]=4 2336 B17R1.125270 CCCN(CC(=O)OCC)c1ccccc1C 269982a_200000219698_100000210303 [0,1,0,0,0,1|1,0,1]=4 2337 B17R1.125270 CCNC(=O)CN(CCO)c1ccccc1C 269982a_100011233185_100000183381 [0,1,0,0,0,1|1,0,1]=4 2338 B17R1.125270 CCNC(=O)CN(CCO)c1ccccc1C 34a_100011233185_100000183381 [0,1,0,0,0,1|1,0,1]=4 2339 B17R1.125270 CCOC(=O)CN(CCF)c1ccccc1C 2230a_200000219698_100011217306 [0,1,0,0,0,1|1,0,1]=4 2340 B17R1.125270 CCOC(=O)CN(CCF)c1ccccc1C 269982a_200000219698_100011217306 [0,1,0,0,0,1|1,0,1]=4 2341 B17R1.125270 CCOC(=O)CN(CCO)c1ccccc1C 2230a_200000219698_100000211926 [0,1,0,0,0,1|1,0,1]=4 2342 B17R1.125270 CCOC(=O)CN(CCO)c1ccccc1C 269982a_100011233185_100000188475 [0,1,0,0,0,1|1,0,1]=4 2343 B17R1.125270 CCOC(=O)CN(CCO)c1ccccc1C 269982a_200000219698_100000211926 [0,1,0,0,0,1|1,0,1]=4 2344 B17R1.125270 CCOC(=O)CN(CCO)c1ccccc1C 34a_100011233185_100000188475 [0,1,0,0,0,1|1,0,1]=4 2345 B17R1.125270 CCOC(=O)CN(COC)c1ccccc1C 2230a_200000219698_100000766300 [0,1,0,0,0,1|1,0,1]=4 2346 B17R1.125270 CCOC(=O)CN(COC)c1ccccc1C 269982a_200000219698_100000766300 [0,1,0,0,0,1|1,0,1]=4 2347 B17R1.125270 CCOC(=O)CN(CSC)c1ccccc1C 2230a_200000219698_100011218213 [0,1,0,0,0,1|1,0,1]=4 2348 B17R1.125270 CCOC(=O)CN(CSC)c1ccccc1C 269982a_200000219698_100011218213 [0,1,0,0,0,1|1,0,1]=4 2349 B17R1.130906 CC/C=C(\C)/C(=O)N(CC)c1ccccc1C 11a_100000211084_100016988807 [0,1,0,0,0,1|1,0,1]=4 2350 B17R1.130906 CC/C=C(\C)/C(=O)N(CC)c1ccccc1C 1626a_100000211084_100016988807 [0,1,0,0,0,1|1,0,1]=4 2351 B17R1.130906 CC/C=C(\C)/C(=O)N(CC)c1ccccc1C 22a_100000211084_100016988807 [0,1,0,0,0,1|1,0,1]=4 2352 B17R1.130906 CCNC(=O)C(=O)N(CC)c1ccccc1C 1626a_100000211084_200011297158 [0,1,0,0,0,1|1,0,1]=4 2353 B17R1.130906 CCNC(=O)C(=O)N(CC)c1ccccc1C 22a_100000211084_200011297158 [0,1,0,0,0,1|1,0,1]=4 2354 B17R1.130906 CCNC(=O)C(C)N(CC)c1ccccc1C 2230a_100000211084_100000230173 [0,1,0,0,0,1|1,0,1]=4 2355 B17R1.130906 CCNC(=O)C(C)N(CC)c1ccccc1C 269982a_100000211084_100000230173 [0,1,0,0,0,1|1,0,1]=4 2356 B17R1.130906 CCNC(=O)C(C)N(CC)c1ccccc1C 34a_100000211084_100000230173 [0,1,0,0,0,1|1,0,1]=4 2357 B17R1.130906 CCOC(=O)C(=O)N(CC)c1ccccc1C 11a_100000211084_100014798877 [0,1,0,0,0,1|1,0,1]=4 2358 B17R1.130906 CCOC(=O)C(=O)N(CC)c1ccccc1C 1626a_100000211084_100014798877 [0,1,0,0,0,1|1,0,1]=4 2359 B17R1.130906 CCOC(=O)C(C)N(CC)c1ccccc1C 2230a_100000211084_100011215307 [0,1,0,0,0,1|1,0,1]=4 2360 B17R1.130906 CCOC(=O)C(C)N(CC)c1ccccc1C 269982a_100000211084_100011216346 [0,1,0,0,0,1|1,0,1]=4 2361 B17R1.130906 CCOC(=O)C(C)N(CC)c1ccccc1C 34a_100000211084_100011216346 [0,1,0,0,0,1|1,0,1]=4 2362 B17R1.130906 CCOC(=O)C(F)N(CC)c1ccccc1C 2230a_100000211084_100000760018 [0,1,0,0,0,1|1,0,1]=4 2363 B17R1.130906 CCOC(=O)C(F)N(CC)c1ccccc1C 269982a_100000211084_100000760018 [0,1,0,0,0,1|1,0,1]=4 2364 B17R1.130906 CCOC(=O)C(F)N(CC)c1ccccc1C 34a_100000211084_100000760018 [0,1,0,0,0,1|1,0,1]=4 2365 B17R1.172812 C=COC(=O)CN(CC)c1ccc(cc1C)F 2230a_100000221679_100000036128 [0,1,0,0,0,1|1,0,1]=4 2366 B17R1.172812 C=COC(=O)CN(CC)c1ccc(cc1C)F 269982a_100000221679_100000036128 [0,1,0,0,0,1|1,0,1]=4 2367 B17R1.172812 C=COC(=O)CN(CC)c1ccc(cc1C)F 34a_100000221679_100000036128 [0,1,0,0,0,1|1,0,1]=4 2368 B17R1.172812 CC=CC(=O)NC(CC)c1ccc(cc1C)C 11a_100015185828_100000210699 [0,1,0,0,0,1|1,0,0]=3 2369 B17R1.172812 CC=CC(=O)NC(CC)c1ccc(cc1C)C 1626a_100015185828_100000210699 [0,1,0,0,0,1|1,0,0]=3 2370 B17R1.172812 CC=CC(=O)NC(CC)c1ccc(cc1C)C 240690a_100015185828_100000210699 [0,1,0,0,0,1|1,0,0]=3 2371 B17R1.172812 CC=CC(=O)N[C@H](CO)c1ccc(cc1C)Br 240690a_100138412551_100000210699 [0,1,0,0,0,1|2,0,0]=4 2372 B17R1.172812 CCC(NC(=O)C=CBr)c1ccc(cc1C)C 1626a_100015185828_100016273825 [0,1,0,0,0,1|2,0,0]=4 2373 B17R1.172812 CCC(NC(=O)C=CBr)c1ccc(cc1C)C 240690a_100015185828_100016273825 [0,1,0,0,0,1|2,0,0]=4 2374 B17R1.172812 CCC(NC(=O)C=CCl)c1ccc(cc1C)C 11a_100015185828_200016279998 [0,1,0,0,0,1|2,0,0]=4 2375 B17R1.172812 CCC(NC(=O)C=CCl)c1ccc(cc1C)C 1626a_100015185828_200016279998 [0,1,0,0,0,1|2,0,0]=4 2376 B17R1.172812 CCC(NC(=O)C=CCl)c1ccc(cc1C)C 240690a_100015185828_200016279998 [0,1,0,0,0,1|2,0,0]=4 2377 B17R1.172812 CCC(NC(=O)C=CI)c1ccc(cc1C)C 1626a_100015185828_100016256311 [0,1,0,0,0,1|2,0,0]=4 2378 B17R1.172812 CCCC(=O)CN(CC)c1ccc(cc1C)F 2230a_100000221679_100000747444 [0,1,0,0,0,1|0,0,2]=4 2379 B17R1.172812 CCCC(=O)CN(CC)c1ccc(cc1C)F 269982a_100000221679_100000747444 [0,1,0,0,0,1|0,0,2]=4 2380 B17R1.172812 CCCC(=O)CN(CC)c1ccc(cc1C)F 7a_100000221679_100000747444 [0,1,0,0,0,1|0,0,2]=4 2381 B17R1.172812 CCNC(=O)CN(CC)c1ccc(cc1C)F 2230a_100000221679_100000183381 [0,1,0,0,0,1|1,0,1]=4 2382 B17R1.172812 CCNC(=O)CN(CC)c1ccc(cc1C)F 269982a_100000221679_100000183381 [0,1,0,0,0,1|1,0,1]=4 2383 B17R1.172812 CCNC(=O)CN(CC)c1ccc(cc1C)F 34a_100000221679_100000183381 [0,1,0,0,0,1|1,0,1]=4 2384 B17R1.172812 CCNC(=O)CN(CC)c1ccc(cc1C)F 7a_100000221679_100000183381 [0,1,0,0,0,1|1,0,1]=4 2385 B17R1.172812 CCOC(=O)CN(CC)c1ccc(cc1C)F 2230a_100000221679_100000188475 [0,1,0,0,0,1|1,0,1]=4 2386 B17R1.172812 CCOC(=O)CN(CC)c1ccc(cc1C)F 269982a_100000221679_100000188475 [0,1,0,0,0,1|1,0,1]=4 2387 B17R1.172812 CCOC(=O)CN(CC)c1ccc(cc1C)F 34a_100000221679_100000188475 [0,1,0,0,0,1|1,0,1]=4 2388 B17R1.172812 CCOC(=O)CN(CC)c1ccc(cc1C)F 7a_100000221679_100000188475 [0,1,0,0,0,1|1,0,1]=4 2389 B17R1.178255 C/C=C(\C)/C(=O)NC(CC)c1ncccc1C 11a_200011536107_100020587367 [0,1,0,0,0,1|2,0,0]=4 2390 B17R1.178255 C/C=C(\C)/C(=O)NC(CC)c1ncccc1C 1626a_200011536107_100020587367 [0,1,0,0,0,1|2,0,0]=4 2391 B17R1.178255 C/C=C(\C)/C(=O)N[C@@H](CC)c1ccccc1Cl 11a_200016987949_100020587367 [0,1,0,0,0,1|2,0,0]=4 2392 B17R1.178255 C/C=C(\C)/C(=O)N[C@@H](CC)c1ccccc1Cl 1626a_200016987949_100020587367 [0,1,0,0,0,1|2,0,0]=4 2393 B17R1.178255 C/C=C(\C)/C(=O)N[C@@H](CC)c1ccccc1F 11a_100015190424_100020587367 [0,1,0,0,0,1|2,0,0]=4 2394 B17R1.178255 C/C=C(\C)/C(=O)N[C@@H](CC)c1ccccc1F 1626a_100015190424_100020587367 [0,1,0,0,0,1|2,0,0]=4 2395 B17R1.178255 C=C(CN(CC)c1ccccc1C)C(=O)OC 34a_100000211084_100009813391 [0,1,0,0,0,1|2,0,0]=4 2396 B17R1.178255 CCN(C)C(=O)CN(CC)c1ccccc1C 2230a_100000211084_100000738999 [0,1,0,0,0,1|1,0,1]=4 2397 B17R1.178255 CCN(C)C(=O)CN(CC)c1ccccc1C 269982a_100000211084_100000738999 [0,1,0,0,0,1|1,0,1]=4 2398 B17R1.178255 CCN(C)C(=O)CN(CC)c1ccccc1C 34a_100000211084_100000738999 [0,1,0,0,0,1|1,0,1]=4 2399 B17R1.178255 CCN(CC(=O)C(=O)OC)c1ccccc1Br 34a_114873767003_100011610305 [0,1,0,0,0,1|2,0,0]=4 2400 B17R1.178255 CCN(CC(=O)C(=O)OC)c1ccccc1C 34a_100000211084_100011610305 [0,1,0,0,0,1|1,0,0]=3 2401 B17R1.178255 CCN(CC(=O)C(=O)OC)c1ccccc1F 34a_100000220365_100011610305 [0,1,0,0,0,1|2,0,0]=4 2402 B17R1.178255 CCN(CC(=O)N(C)OC)c1ccccc1C 2230a_100000211084_100000764215 [0,1,0,0,0,1|2,0,0]=4 2403 B17R1.178255 CCN(CC(=O)N(C)OC)c1ccccc1C 269982a_100000211084_100000764215 [0,1,0,0,0,1|2,0,0]=4 2404 B17R1.782 CC=CC(=O)N(CC)Cc1cccc(c1F)F 11a_100011192140_100000210699 [0,1,0,0,0,1|1,0,0]=3 2405 B17R1.782 CC=CC(=O)N(CC)Cc1cccc(c1F)F 1626a_100011192140_100000210699 [0,1,0,0,0,1|1,0,0]=3 2406 B17R1.782 CC=CC(=O)N(CC)Cc1cccc(c1F)F 240690a_100011192140_100000210699 [0,1,0,0,0,1|1,0,0]=3 2407 B17R1.782 CCN(Cc1cccc(c1F)F)C(=O)C=CBr 1626a_100011192140_100016273825 [0,1,0,0,0,1|2,0,0]=4 2408 B17R1.782 CCN(Cc1cccc(c1F)F)C(=O)C=CBr 240690a_100011192140_100016273825 [0,1,0,0,0,1|2,0,0]=4 2409 B17R1.782 CCN(Cc1cccc(c1F)F)C(=O)C=CCl 11a_100011192140_200016279998 [0,1,0,0,0,1|2,0,0]=4 2410 B17R1.782 CCN(Cc1cccc(c1F)F)C(=O)C=CCl 1626a_100011192140_200016279998 [0,1,0,0,0,1|2,0,0]=4 2411 B17R1.782 CCN(Cc1cccc(c1F)F)C(=O)C=CCl 240690a_100011192140_200016279998 [0,1,0,0,0,1|2,0,0]=4 2412 B17R1.782 CCN(Cc1cccc(c1F)F)C(=O)C=CI 1626a_100011192140_100016256311 [0,1,0,0,0,1|2,0,0]=4 2413 B17R1.2060 C/C=C(\C)/C(=O)N(CC)Cc1ccccc1C 11a_100000201206_100020587367 [0,1,0,0,0,1|0,0,0]=2 2414 B17R1.2060 C/C=C(\C)/C(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100020587367 [0,1,0,0,0,1|0,0,0]=2 2415 B17R1.2060 C/C=C(\C)/C(=O)N(CC)Cc1ccccc1Cl 11a_100000201176_100020587367 [0,1,0,0,0,1|1,0,0]=3 2416 B17R1.2060 C/C=C(\C)/C(=O)N(CC)Cc1ccccc1Cl 1626a_100000201176_100020587367 [0,1,0,0,0,1|1,0,0]=3 2417 B17R1.2060 C/C=C(\C)/C(=O)N(CC)Cc1ccccc1F 11a_100015186831_100020587367 [0,1,0,0,0,1|1,0,0]=3 2418 B17R1.2060 C/C=C(\C)/C(=O)N(CC)Cc1ccccc1F 1626a_100015186831_100020587367 [0,1,0,0,0,1|1,0,0]=3 2419 B17R1.2060 C=CC(C)C(=O)N(CC)Cc1ccccc1C 11a_100000201206_100011216780 [0,1,0,0,0,1|0,0,2]=4 2420 B17R1.2060 C=CC(C)C(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100011216780 [0,1,0,0,0,1|0,0,2]=4 2421 B17R1.2060 C=CC(C)C(=O)N(CC)Cc1ccccc1C 240690a_100000201206_100011216780 [0,1,0,0,0,1|0,0,2]=4 2422 B17R1.2060 C=CC(C)C(=O)N(CC)Cc1ccccc1C 527a_100000201206_100011216780 [0,1,0,0,0,1|0,0,2]=4 2423 B17R1.2060 CCC(C)C(=O)N(CC)Cc1ccccc1C 11a_100000201206_100011192722 [0,1,0,0,0,1|0,0,2]=4 2424 B17R1.2060 CCC(C)C(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100011192722 [0,1,0,0,0,1|0,0,2]=4 2425 B17R1.2060 CCC(C)C(=O)N(CC)Cc1ccccc1C 240690a_100000201206_100011192722 [0,1,0,0,0,1|0,0,2]=4 2426 B17R1.2060 CCC(C)C(=O)N(CC)Cc1ccccc1C 527a_100000201206_100011192722 [0,1,0,0,0,1|0,0,2]=4 2427 B17R1.2060 CCC(O)C(=O)N(CC)Cc1ccccc1C 240690a_100000201206_100011196387 [0,1,0,0,0,1|0,0,2]=4 2428 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(=O)NC 1626a_100000201206_100011218921 [0,1,0,0,0,1|1,0,0]=3 2429 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(=O)NC 240690a_100000201206_100011218921 [0,1,0,0,0,1|1,0,0]=3 2430 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(=O)NC 527a_100000201206_100011218921 [0,1,0,0,0,1|1,0,0]=3 2431 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(=O)OC 11a_100000201206_100000024059 [0,1,0,0,0,1|1,0,0]=3 2432 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(=O)OC 1626a_100000201206_100000024059 [0,1,0,0,0,1|1,0,0]=3 2433 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(=O)OC 240690a_100000201206_100000024059 [0,1,0,0,0,1|1,0,0]=3 2434 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(=O)OC 527a_100000201206_100000024059 [0,1,0,0,0,1|1,0,0]=3 2435 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(C)OC 11a_100000201206_100000743197 [0,1,0,0,0,1|1,0,1]=4 2436 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(C)OC 1626a_100000201206_100000743197 [0,1,0,0,0,1|1,0,1]=4 2437 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(C)OC 240690a_100000201206_100000743197 [0,1,0,0,0,1|1,0,1]=4 2438 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(C)OC 527a_100000201206_100000743197 [0,1,0,0,0,1|1,0,1]=4 2439 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(C)SC 11a_100000201206_100000149566 [0,1,0,0,0,1|1,0,1]=4 2440 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(C)SC 1626a_100000201206_100000149566 [0,1,0,0,0,1|1,0,1]=4 2441 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(C)SC 240690a_100000201206_100000149566 [0,1,0,0,0,1|1,0,1]=4 2442 B17R1.2060 CCN(Cc1ccccc1C)C(=O)C(C)SC 527a_100000201206_100000149566 [0,1,0,0,0,1|1,0,1]=4 2443 B17R1.2060 CCN(Cc1ccccc1Cl)C(=O)C(=O)NC 1626a_100000201176_100011218921 [0,1,0,0,0,1|2,0,0]=4 2444 B17R1.2060 CCN(Cc1ccccc1Cl)C(=O)C(=O)NC 240690a_100000201176_100011218921 [0,1,0,0,0,1|2,0,0]=4 2445 B17R1.2060 CCN(Cc1ccccc1Cl)C(=O)C(=O)NC 527a_100000201176_100011218921 [0,1,0,0,0,1|2,0,0]=4 2446 B17R1.2060 CCN(Cc1ccccc1Cl)C(=O)C(=O)OC 11a_100000201176_100000024059 [0,1,0,0,0,1|2,0,0]=4 2447 B17R1.2060 CCN(Cc1ccccc1Cl)C(=O)C(=O)OC 1626a_100000201176_100000024059 [0,1,0,0,0,1|2,0,0]=4 2448 B17R1.2060 CCN(Cc1ccccc1Cl)C(=O)C(=O)OC 240690a_100000201176_100000024059 [0,1,0,0,0,1|2,0,0]=4 2449 B17R1.2060 CCN(Cc1ccccc1Cl)C(=O)C(=O)OC 527a_100000201176_100000024059 [0,1,0,0,0,1|2,0,0]=4 2450 B17R1.2060 CCN(Cc1ccccc1F)C(=O)C(=O)NC 1626a_100015186831_100011218921 [0,1,0,0,0,1|2,0,0]=4 2451 B17R1.2060 CCN(Cc1ccccc1F)C(=O)C(=O)NC 240690a_100015186831_100011218921 [0,1,0,0,0,1|2,0,0]=4 2452 B17R1.2060 CCN(Cc1ccccc1F)C(=O)C(=O)NC 527a_100015186831_100011218921 [0,1,0,0,0,1|2,0,0]=4 2453 B17R1.2060 CCN(Cc1ccccc1F)C(=O)C(=O)OC 11a_100015186831_100000024059 [0,1,0,0,0,1|2,0,0]=4 2454 B17R1.2060 CCN(Cc1ccccc1F)C(=O)C(=O)OC 1626a_100015186831_100000024059 [0,1,0,0,0,1|2,0,0]=4 2455 B17R1.2060 CCN(Cc1ccccc1F)C(=O)C(=O)OC 240690a_100015186831_100000024059 [0,1,0,0,0,1|2,0,0]=4 2456 B17R1.2060 CCN(Cc1ccccc1F)C(=O)C(=O)OC 527a_100015186831_100000024059 [0,1,0,0,0,1|2,0,0]=4 2457 B17R1.2060 CCN(Cc1ccccc1O)C(=O)C(=O)NC 240690a_100011223546_100011218921 [0,1,0,0,0,1|2,0,0]=4 2458 B17R1.2060 CCN(Cc1ccccc1O)C(=O)C(=O)NC 527a_100011223546_100011218921 [0,1,0,0,0,1|2,0,0]=4 2459 B17R1.2060 CCN(Cc1ccccc1O)C(=O)C(=O)OC 240690a_100011223546_100000024059 [0,1,0,0,0,1|2,0,0]=4 2460 B17R1.2060 CCN(Cc1ccccc1O)C(=O)C(=O)OC 527a_100011223546_100000024059 [0,1,0,0,0,1|2,0,0]=4 2461 B17R1.18493 C=CCC(=O)N(Cc1ccccc1C)C(C)C 11a_100015184664_100000210193 [0,1,0,0,0,1|0,0,2]=4 2462 B17R1.18493 C=CCC(=O)N(Cc1ccccc1C)C(C)C 1626a_100015184664_100000210193 [0,1,0,0,0,1|0,0,2]=4 2463 B17R1.18493 C=CCC(=O)N(Cc1ccccc1C)C(C)C 240690a_100015184664_100000210193 [0,1,0,0,0,1|0,0,2]=4 2464 B17R1.18493 C=CCC(=O)N(Cc1ccccc1C)C(C)C 527a_100015184664_100000210193 [0,1,0,0,0,1|0,0,2]=4 2465 B17R1.18493 CC(C)N(Cc1ccccc1Br)C(=O)C=CBr 1626a_100000195800_100016273825 [0,1,0,0,0,1|2,0,0]=4 2466 B17R1.18493 CC(C)N(Cc1ccccc1Br)C(=O)C=CBr 240690a_100000195800_100016273825 [0,1,0,0,0,1|2,0,0]=4 2467 B17R1.18493 CC(C)N(Cc1ccccc1Br)C(=O)C=CCl 11a_100000195800_200016279998 [0,1,0,0,0,1|2,0,0]=4 2468 B17R1.18493 CC(C)N(Cc1ccccc1Br)C(=O)C=CCl 1626a_100000195800_200016279998 [0,1,0,0,0,1|2,0,0]=4 2469 B17R1.18493 CC(C)N(Cc1ccccc1Br)C(=O)C=CCl 240690a_100000195800_200016279998 [0,1,0,0,0,1|2,0,0]=4 2470 B17R1.18493 CC(C)N(Cc1ccccc1Br)C(=O)C=CI 1626a_100000195800_100016256311 [0,1,0,0,0,1|2,0,0]=4 2471 B17R1.18493 CC(C)N(Cc1ccccc1Cl)C(=O)C=CBr 1626a_100015185289_100016273825 [0,1,0,0,0,1|2,0,0]=4 2472 B17R1.18493 CC(C)N(Cc1ccccc1Cl)C(=O)C=CBr 240690a_100015185289_100016273825 [0,1,0,0,0,1|2,0,0]=4 2473 B17R1.18493 CC(C)N(Cc1ccccc1Cl)C(=O)C=CCl 11a_100015185289_200016279998 [0,1,0,0,0,1|2,0,0]=4 2474 B17R1.18493 CC(C)N(Cc1ccccc1Cl)C(=O)C=CCl 1626a_100015185289_200016279998 [0,1,0,0,0,1|2,0,0]=4 2475 B17R1.18493 CC(C)N(Cc1ccccc1Cl)C(=O)C=CCl 240690a_100015185289_200016279998 [0,1,0,0,0,1|2,0,0]=4 2476 B17R1.18493 CC(C)N(Cc1ccccc1Cl)C(=O)C=CI 1626a_100015185289_100016256311 [0,1,0,0,0,1|2,0,0]=4 2477 B17R1.18493 CC(C)N(Cc1ccccc1F)C(=O)C=CBr 1626a_100000195788_100016273825 [0,1,0,0,0,1|2,0,0]=4 2478 B17R1.18493 CC(C)N(Cc1ccccc1F)C(=O)C=CBr 240690a_100000195788_100016273825 [0,1,0,0,0,1|2,0,0]=4 2479 B17R1.18493 CC(C)N(Cc1ccccc1F)C(=O)C=CCl 11a_100000195788_200016279998 [0,1,0,0,0,1|2,0,0]=4 2480 B17R1.18493 CC(C)N(Cc1ccccc1F)C(=O)C=CCl 1626a_100000195788_200016279998 [0,1,0,0,0,1|2,0,0]=4 2481 B17R1.18493 CC(C)N(Cc1ccccc1F)C(=O)C=CCl 240690a_100000195788_200016279998 [0,1,0,0,0,1|2,0,0]=4 2482 B17R1.18493 CC(C)N(Cc1ccccc1F)C(=O)C=CI 1626a_100000195788_100016256311 [0,1,0,0,0,1|2,0,0]=4 2483 B17R1.18493 CC=CC(=O)N(Cc1ccccc1Br)C(C)C 11a_100000195800_100000210699 [0,1,0,0,0,1|1,0,0]=3 2484 B17R1.18493 CC=CC(=O)N(Cc1ccccc1Br)C(C)C 1626a_100000195800_100000210699 [0,1,0,0,0,1|1,0,0]=3 2485 B17R1.18493 CC=CC(=O)N(Cc1ccccc1Br)C(C)C 240690a_100000195800_100000210699 [0,1,0,0,0,1|1,0,0]=3 2486 B17R1.18493 CC=CC(=O)N(Cc1ccccc1C)C(C)C 11a_100015184664_100000210699 [0,1,0,0,0,1|0,0,0]=2 2487 B17R1.18493 CC=CC(=O)N(Cc1ccccc1C)C(C)C 1626a_100015184664_100000210699 [0,1,0,0,0,1|0,0,0]=2 2488 B17R1.18493 CC=CC(=O)N(Cc1ccccc1C)C(C)C 240690a_100015184664_100000210699 [0,1,0,0,0,1|0,0,0]=2 2489 B17R1.18493 CC=CC(=O)N(Cc1ccccc1Cl)C(C)C 11a_100015185289_100000210699 [0,1,0,0,0,1|1,0,0]=3 2490 B17R1.18493 CC=CC(=O)N(Cc1ccccc1Cl)C(C)C 1626a_100015185289_100000210699 [0,1,0,0,0,1|1,0,0]=3 2491 B17R1.18493 CC=CC(=O)N(Cc1ccccc1Cl)C(C)C 240690a_100015185289_100000210699 [0,1,0,0,0,1|1,0,0]=3 2492 B17R1.18493 CC=CC(=O)N(Cc1ccccc1F)C(C)C 11a_100000195788_100000210699 [0,1,0,0,0,1|1,0,0]=3 2493 B17R1.18493 CC=CC(=O)N(Cc1ccccc1F)C(C)C 1626a_100000195788_100000210699 [0,1,0,0,0,1|1,0,0]=3 2494 B17R1.18493 CC=CC(=O)N(Cc1ccccc1F)C(C)C 240690a_100000195788_100000210699 [0,1,0,0,0,1|1,0,0]=3 2495 B17R1.18493 CCCC(=O)N(Cc1ccccc1C)C(C)C 11a_100015184664_100000211992 [0,1,0,0,0,1|0,0,2]=4 2496 B17R1.18493 CCCC(=O)N(Cc1ccccc1C)C(C)C 1626a_100015184664_100000211992 [0,1,0,0,0,1|0,0,2]=4 2497 B17R1.18493 CCCC(=O)N(Cc1ccccc1C)C(C)C 240690a_100015184664_100000211992 [0,1,0,0,0,1|0,0,2]=4 2498 B17R1.18493 CCCC(=O)N(Cc1ccccc1C)C(C)C 527a_100015184664_100000211992 [0,1,0,0,0,1|0,0,2]=4 2499 B17R1.18493 CCNC(=O)N(Cc1ccccc1C)C(C)C 2708a_100015525214_100015184664 [0,1,0,0,0,1|1,0,1]=4 2500 B17R1.18493 CCNC(=O)N(Cc1ccccc1C)C(C)C 273464a_100015525214_100015184664 [0,1,0,0,0,1|1,0,1]=4 2501 B17R1.18493 COCC(=O)N(Cc1ccccc1C)C(C)C 11a_100015184664_100000210968 [0,1,0,0,0,1|1,0,1]=4 2502 B17R1.18493 COCC(=O)N(Cc1ccccc1C)C(C)C 1626a_100015184664_100000210968 [0,1,0,0,0,1|1,0,1]=4 2503 B17R1.18493 COCC(=O)N(Cc1ccccc1C)C(C)C 240690a_100015184664_100000210968 [0,1,0,0,0,1|1,0,1]=4 2504 B17R1.18493 COCC(=O)N(Cc1ccccc1C)C(C)C 527a_100015184664_100000210968 [0,1,0,0,0,1|1,0,1]=4 2505 B17R1.18493 CSCC(=O)N(Cc1ccccc1C)C(C)C 11a_100015184664_100000184570 [0,1,0,0,0,1|1,0,1]=4 2506 B17R1.18493 CSCC(=O)N(Cc1ccccc1C)C(C)C 1626a_100015184664_100000184570 [0,1,0,0,0,1|1,0,1]=4 2507 B17R1.18493 CSCC(=O)N(Cc1ccccc1C)C(C)C 240690a_100015184664_100000184570 [0,1,0,0,0,1|1,0,1]=4 2508 B17R1.18493 CSCC(=O)N(Cc1ccccc1C)C(C)C 527a_100015184664_100000184570 [0,1,0,0,0,1|1,0,1]=4 2509 B17R1.18493 Cc1ccccc1CN(C(=O)C=CBr)C(C)C 1626a_100015184664_100016273825 [0,1,0,0,0,1|1,0,0]=3 2510 B17R1.18493 Cc1ccccc1CN(C(=O)C=CBr)C(C)C 240690a_100015184664_100016273825 [0,1,0,0,0,1|1,0,0]=3 2511 B17R1.18493 Cc1ccccc1CN(C(=O)C=CCl)C(C)C 11a_100015184664_200016279998 [0,1,0,0,0,1|1,0,0]=3 2512 B17R1.18493 Cc1ccccc1CN(C(=O)C=CCl)C(C)C 1626a_100015184664_200016279998 [0,1,0,0,0,1|1,0,0]=3 2513 B17R1.18493 Cc1ccccc1CN(C(=O)C=CCl)C(C)C 240690a_100015184664_200016279998 [0,1,0,0,0,1|1,0,0]=3 2514 B17R1.18493 Cc1ccccc1CN(C(=O)C=CI)C(C)C 1626a_100015184664_100016256311 [0,1,0,0,0,1|1,0,0]=3 2515 B17R1.19262 CC=CC(=O)N(CC)Cc1cc(ccc1F)Br 11a_100000748473_100000210699 [0,1,0,0,0,1|1,0,0]=3 2516 B17R1.19262 CC=CC(=O)N(CC)Cc1cc(ccc1F)Br 1626a_100000748473_100000210699 [0,1,0,0,0,1|1,0,0]=3 2517 B17R1.19262 CC=CC(=O)N(CC)Cc1cc(ccc1F)Br 240690a_100000748473_100000210699 [0,1,0,0,0,1|1,0,0]=3 2518 B17R1.19262 CC=CC(=O)N(CC)Cc1cc(ccc1O)Br 240690a_100000765307_100000210699 [0,1,0,0,0,1|1,0,0]=3 2519 B17R1.19262 CC=CC(=O)N(CC)Cc1cc(ccc1O)Cl 240690a_100011223571_100000210699 [0,1,0,0,0,1|1,0,0]=3 2520 B17R1.19262 CC=CC(=O)N(CC)Cc1cc(ccc1O)F 240690a_100012769503_100000210699 [0,1,0,0,0,1|1,0,0]=3 2521 B17R1.19262 CCN(Cc1cc(ccc1F)Br)C(=O)C=CBr 1626a_100000748473_100016273825 [0,1,0,0,0,1|2,0,0]=4 2522 B17R1.19262 CCN(Cc1cc(ccc1F)Br)C(=O)C=CBr 240690a_100000748473_100016273825 [0,1,0,0,0,1|2,0,0]=4 2523 B17R1.19262 CCN(Cc1cc(ccc1F)Br)C(=O)C=CCl 11a_100000748473_200016279998 [0,1,0,0,0,1|2,0,0]=4 2524 B17R1.19262 CCN(Cc1cc(ccc1F)Br)C(=O)C=CCl 1626a_100000748473_200016279998 [0,1,0,0,0,1|2,0,0]=4 2525 B17R1.19262 CCN(Cc1cc(ccc1F)Br)C(=O)C=CCl 240690a_100000748473_200016279998 [0,1,0,0,0,1|2,0,0]=4 2526 B17R1.19262 CCN(Cc1cc(ccc1F)Br)C(=O)C=CI 1626a_100000748473_100016256311 [0,1,0,0,0,1|2,0,0]=4 2527 B17R1.19262 CCN(Cc1cc(ccc1O)Br)C(=O)C=CBr 240690a_100000765307_100016273825 [0,1,0,0,0,1|2,0,0]=4 2528 B17R1.19262 CCN(Cc1cc(ccc1O)Br)C(=O)C=CCl 240690a_100000765307_200016279998 [0,1,0,0,0,1|2,0,0]=4 2529 B17R1.19262 CCN(Cc1cc(ccc1O)Cl)C(=O)C=CBr 240690a_100011223571_100016273825 [0,1,0,0,0,1|2,0,0]=4 2530 B17R1.19262 CCN(Cc1cc(ccc1O)Cl)C(=O)C=CCl 240690a_100011223571_200016279998 [0,1,0,0,0,1|2,0,0]=4 2531 B17R1.19262 CCN(Cc1cc(ccc1O)F)C(=O)C=CBr 240690a_100012769503_100016273825 [0,1,0,0,0,1|2,0,0]=4 2532 B17R1.19262 CCN(Cc1cc(ccc1O)F)C(=O)C=CCl 240690a_100012769503_200016279998 [0,1,0,0,0,1|2,0,0]=4 2533 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C=C(C)C 11a_100000201206_100000211388 [0,1,0,0,0,1|0,0,0]=2 2534 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C=C(C)C 1626a_100000201206_100000211388 [0,1,0,0,0,1|0,0,0]=2 2535 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C=C(C)C 240690a_100000201206_100000211388 [0,1,0,0,0,1|0,0,0]=2 2536 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C=C(C)Cl 11a_100000201206_200042562850 [0,1,0,0,0,1|0,0,0]=2 2537 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C=C(C)Cl 1626a_100000201206_200042562850 [0,1,0,0,0,1|0,0,0]=2 2538 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C=C(C)Cl 240690a_100000201206_200042562850 [0,1,0,0,0,1|0,0,0]=2 2539 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C=C(C)I 11a_100000201206_100025716642 [0,1,0,0,0,1|0,0,0]=2 2540 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C=C(C)I 1626a_100000201206_100025716642 [0,1,0,0,0,1|0,0,0]=2 2541 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C=C(Cl)Cl 1626a_100000201206_100000137448 [0,1,0,0,0,1|1,0,0]=3 2542 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C=C(Cl)Cl 240690a_100000201206_100000137448 [0,1,0,0,0,1|1,0,0]=3 2543 B17R1.19812 CCN(Cc1ccccc1C)C(=O)CC(=O)N 240690a_100000201206_100134613110 [0,1,0,0,0,1|1,0,1]=4 2544 B17R1.19812 CCN(Cc1ccccc1C)C(=O)CC(=O)N 527a_100000201206_100134613110 [0,1,0,0,0,1|1,0,1]=4 2545 B17R1.19812 CCN(Cc1ccccc1C)C(=O)CC(C)C 11a_100000201206_100000210554 [0,1,0,0,0,1|0,0,2]=4 2546 B17R1.19812 CCN(Cc1ccccc1C)C(=O)CC(C)C 1626a_100000201206_100000210554 [0,1,0,0,0,1|0,0,2]=4 2547 B17R1.19812 CCN(Cc1ccccc1C)C(=O)CC(C)C 240690a_100000201206_100000210554 [0,1,0,0,0,1|0,0,2]=4 2548 B17R1.19812 CCN(Cc1ccccc1C)C(=O)CC(C)C 527a_100000201206_100000210554 [0,1,0,0,0,1|0,0,2]=4 2549 B17R1.19812 CCN(Cc1ccccc1C)C(=O)CN(C)C 11a_100000201206_100000750896 [0,1,0,0,0,1|1,0,1]=4 2550 B17R1.19812 CCN(Cc1ccccc1C)C(=O)CN(C)C 240690a_100000201206_100000750896 [0,1,0,0,0,1|1,0,1]=4 2551 B17R1.19812 CCN(Cc1ccccc1C)C(=O)CN(C)C 527a_100000201206_100000750896 [0,1,0,0,0,1|1,0,1]=4 2552 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C[C@@H](C)O 240690a_100000201206_100011933948 [0,1,0,0,0,1|0,0,2]=4 2553 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C[S+](C)C 11a_100000201206_200159257847 [0,1,0,0,0,1|1,0,1]=4 2554 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C[S+](C)C 1626a_100000201206_200159257847 [0,1,0,0,0,1|1,0,1]=4 2555 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C[S+](C)C 240690a_100000201206_200159257847 [0,1,0,0,0,1|1,0,1]=4 2556 B17R1.19812 CCN(Cc1ccccc1C)C(=O)C[S+](C)C 527a_100000201206_200159257847 [0,1,0,0,0,1|1,0,1]=4 2557 B17R1.19812 CCN(Cc1ccccc1C)C(=O)NC(C)C 2708a_100138425928_100000201206 [0,1,0,0,0,1|1,0,1]=4 2558 B17R1.19812 CCN(Cc1ccccc1C)C(=O)NC(C)C 273464a_100138425928_100000201206 [0,1,0,0,0,1|1,0,1]=4 2559 B17R1.19812 CCN(Cc1ccccc1Cl)C(=O)C=C(C)C 11a_100000201176_100000211388 [0,1,0,0,0,1|1,0,0]=3 2560 B17R1.19812 CCN(Cc1ccccc1Cl)C(=O)C=C(C)C 1626a_100000201176_100000211388 [0,1,0,0,0,1|1,0,0]=3 2561 B17R1.19812 CCN(Cc1ccccc1Cl)C(=O)C=C(C)C 240690a_100000201176_100000211388 [0,1,0,0,0,1|1,0,0]=3 2562 B17R1.19812 CCN(Cc1ccccc1Cl)C(=O)C=C(C)Cl 11a_100000201176_200042562850 [0,1,0,0,0,1|1,0,0]=3 2563 B17R1.19812 CCN(Cc1ccccc1Cl)C(=O)C=C(C)Cl 1626a_100000201176_200042562850 [0,1,0,0,0,1|1,0,0]=3 2564 B17R1.19812 CCN(Cc1ccccc1Cl)C(=O)C=C(C)Cl 240690a_100000201176_200042562850 [0,1,0,0,0,1|1,0,0]=3 2565 B17R1.19812 CCN(Cc1ccccc1Cl)C(=O)C=C(C)I 11a_100000201176_100025716642 [0,1,0,0,0,1|1,0,0]=3 2566 B17R1.19812 CCN(Cc1ccccc1Cl)C(=O)C=C(C)I 1626a_100000201176_100025716642 [0,1,0,0,0,1|1,0,0]=3 2567 B17R1.19812 CCN(Cc1ccccc1Cl)C(=O)C=C(Cl)Cl 1626a_100000201176_100000137448 [0,1,0,0,0,1|2,0,0]=4 2568 B17R1.19812 CCN(Cc1ccccc1Cl)C(=O)C=C(Cl)Cl 240690a_100000201176_100000137448 [0,1,0,0,0,1|2,0,0]=4 2569 B17R1.19812 CCN(Cc1ccccc1F)C(=O)C=C(C)C 11a_100015186831_100000211388 [0,1,0,0,0,1|1,0,0]=3 2570 B17R1.19812 CCN(Cc1ccccc1F)C(=O)C=C(C)C 1626a_100015186831_100000211388 [0,1,0,0,0,1|1,0,0]=3 2571 B17R1.19812 CCN(Cc1ccccc1F)C(=O)C=C(C)C 240690a_100015186831_100000211388 [0,1,0,0,0,1|1,0,0]=3 2572 B17R1.19812 CCN(Cc1ccccc1F)C(=O)C=C(C)Cl 11a_100015186831_200042562850 [0,1,0,0,0,1|1,0,0]=3 2573 B17R1.19812 CCN(Cc1ccccc1F)C(=O)C=C(C)Cl 1626a_100015186831_200042562850 [0,1,0,0,0,1|1,0,0]=3 2574 B17R1.19812 CCN(Cc1ccccc1F)C(=O)C=C(C)Cl 240690a_100015186831_200042562850 [0,1,0,0,0,1|1,0,0]=3 2575 B17R1.19812 CCN(Cc1ccccc1F)C(=O)C=C(C)I 11a_100015186831_100025716642 [0,1,0,0,0,1|1,0,0]=3 2576 B17R1.19812 CCN(Cc1ccccc1F)C(=O)C=C(C)I 1626a_100015186831_100025716642 [0,1,0,0,0,1|1,0,0]=3 2577 B17R1.19812 CCN(Cc1ccccc1F)C(=O)C=C(Cl)Cl 1626a_100015186831_100000137448 [0,1,0,0,0,1|2,0,0]=4 2578 B17R1.19812 CCN(Cc1ccccc1F)C(=O)C=C(Cl)Cl 240690a_100015186831_100000137448 [0,1,0,0,0,1|2,0,0]=4 2579 B17R1.19812 CCN(Cc1ccccc1O)C(=O)C=C(C)C 240690a_100011223546_100000211388 [0,1,0,0,0,1|1,0,0]=3 2580 B17R1.19812 CCN(Cc1ccccc1O)C(=O)C=C(C)Cl 240690a_100011223546_200042562850 [0,1,0,0,0,1|1,0,0]=3 2581 B17R1.19812 CCN(Cc1ccccc1O)C(=O)C=C(Cl)Cl 240690a_100011223546_100000137448 [0,1,0,0,0,1|2,0,0]=4 2582 B17R1.21954 C#CCN(Cc1ccccc1Cl)C(=O)C=CC 11a_100000746241_100000210699 [0,1,0,0,0,1|1,0,1]=4 2583 B17R1.21954 C#CCN(Cc1ccccc1Cl)C(=O)C=CC 1626a_100000746241_100000210699 [0,1,0,0,0,1|1,0,1]=4 2584 B17R1.21954 C#CCN(Cc1ccccc1Cl)C(=O)C=CC 240690a_100000746241_100000210699 [0,1,0,0,0,1|1,0,1]=4 2585 B17R1.21954 C=CCC(=O)N(CCC)Cc1ccccc1C 11a_100015185261_100000210193 [0,1,0,0,0,1|0,0,2]=4 2586 B17R1.21954 C=CCC(=O)N(CCC)Cc1ccccc1C 1626a_100015185261_100000210193 [0,1,0,0,0,1|0,0,2]=4 2587 B17R1.21954 C=CCC(=O)N(CCC)Cc1ccccc1C 240690a_100015185261_100000210193 [0,1,0,0,0,1|0,0,2]=4 2588 B17R1.21954 C=CCC(=O)N(CCC)Cc1ccccc1C 527a_100015185261_100000210193 [0,1,0,0,0,1|0,0,2]=4 2589 B17R1.21954 C=CCN(Cc1ccccc1C)C(=O)C=CBr 1626a_200015183989_100016273825 [0,1,0,0,0,1|1,0,1]=4 2590 B17R1.21954 C=CCN(Cc1ccccc1C)C(=O)C=CBr 240690a_200015183989_100016273825 [0,1,0,0,0,1|1,0,1]=4 2591 B17R1.21954 C=CCN(Cc1ccccc1C)C(=O)C=CC 11a_200015183989_100000210699 [0,1,0,0,0,1|0,0,1]=3 2592 B17R1.21954 C=CCN(Cc1ccccc1C)C(=O)C=CC 1626a_200015183989_100000210699 [0,1,0,0,0,1|0,0,1]=3 2593 B17R1.21954 C=CCN(Cc1ccccc1C)C(=O)C=CC 240690a_200015183989_100000210699 [0,1,0,0,0,1|0,0,1]=3 2594 B17R1.21954 C=CCN(Cc1ccccc1C)C(=O)C=CCl 11a_200015183989_200016279998 [0,1,0,0,0,1|1,0,1]=4 2595 B17R1.21954 C=CCN(Cc1ccccc1C)C(=O)C=CCl 1626a_200015183989_200016279998 [0,1,0,0,0,1|1,0,1]=4 2596 B17R1.21954 C=CCN(Cc1ccccc1C)C(=O)C=CCl 240690a_200015183989_200016279998 [0,1,0,0,0,1|1,0,1]=4 2597 B17R1.21954 C=CCN(Cc1ccccc1C)C(=O)C=CI 1626a_200015183989_100016256311 [0,1,0,0,0,1|1,0,1]=4 2598 B17R1.21954 C=CCN(Cc1ccccc1Cl)C(=O)C=CC 11a_200015185268_100000210699 [0,1,0,0,0,1|1,0,1]=4 2599 B17R1.21954 C=CCN(Cc1ccccc1Cl)C(=O)C=CC 1626a_200015185268_100000210699 [0,1,0,0,0,1|1,0,1]=4 2600 B17R1.21954 C=CCN(Cc1ccccc1Cl)C(=O)C=CC 240690a_200015185268_100000210699 [0,1,0,0,0,1|1,0,1]=4 2601 B17R1.21954 CC=CC(=O)N(CCC)Cc1ccccc1Br 11a_100000196483_100000210699 [0,1,0,0,0,1|1,0,0]=3 2602 B17R1.21954 CC=CC(=O)N(CCC)Cc1ccccc1Br 1626a_100000196483_100000210699 [0,1,0,0,0,1|1,0,0]=3 2603 B17R1.21954 CC=CC(=O)N(CCC)Cc1ccccc1Br 240690a_100000196483_100000210699 [0,1,0,0,0,1|1,0,0]=3 2604 B17R1.21954 CC=CC(=O)N(CCC)Cc1ccccc1C 11a_100015185261_100000210699 [0,1,0,0,0,1|0,0,0]=2 2605 B17R1.21954 CC=CC(=O)N(CCC)Cc1ccccc1C 1626a_100015185261_100000210699 [0,1,0,0,0,1|0,0,0]=2 2606 B17R1.21954 CC=CC(=O)N(CCC)Cc1ccccc1C 240690a_100015185261_100000210699 [0,1,0,0,0,1|0,0,0]=2 2607 B17R1.21954 CC=CC(=O)N(CCC)Cc1ccccc1Cl 11a_100015184737_100000210699 [0,1,0,0,0,1|1,0,0]=3 2608 B17R1.21954 CC=CC(=O)N(CCC)Cc1ccccc1Cl 1626a_100015184737_100000210699 [0,1,0,0,0,1|1,0,0]=3 2609 B17R1.21954 CC=CC(=O)N(CCC)Cc1ccccc1Cl 240690a_100015184737_100000210699 [0,1,0,0,0,1|1,0,0]=3 2610 B17R1.21954 CC=CC(=O)N(CCC)Cc1ccccc1F 11a_100015184649_100000210699 [0,1,0,0,0,1|1,0,0]=3 2611 B17R1.21954 CC=CC(=O)N(CCC)Cc1ccccc1F 1626a_100015184649_100000210699 [0,1,0,0,0,1|1,0,0]=3 2612 B17R1.21954 CC=CC(=O)N(CCC)Cc1ccccc1F 240690a_100015184649_100000210699 [0,1,0,0,0,1|1,0,0]=3 2613 B17R1.21954 CC=CC(=O)N(CCC)Cc1ccccc1O 240690a_100000749093_100000210699 [0,1,0,0,0,1|1,0,0]=3 2614 B17R1.21954 CC=CC(=O)N(CCO)Cc1ccccc1Br 240690a_106744479749_100000210699 [0,1,0,0,0,1|1,0,0]=3 2615 B17R1.21954 CC=CC(=O)N(CCO)Cc1ccccc1Cl 240690a_100015187164_100000210699 [0,1,0,0,0,1|1,0,0]=3 2616 B17R1.21954 CCCC(=O)N(CCC)Cc1ccccc1C 11a_100015185261_100000211992 [0,1,0,0,0,1|0,0,2]=4 2617 B17R1.21954 CCCC(=O)N(CCC)Cc1ccccc1C 1626a_100015185261_100000211992 [0,1,0,0,0,1|0,0,2]=4 2618 B17R1.21954 CCCC(=O)N(CCC)Cc1ccccc1C 240690a_100015185261_100000211992 [0,1,0,0,0,1|0,0,2]=4 2619 B17R1.21954 CCCC(=O)N(CCC)Cc1ccccc1C 527a_100015185261_100000211992 [0,1,0,0,0,1|0,0,2]=4 2620 B17R1.21954 CCCN(Cc1ccccc1Br)C(=O)C=CBr 1626a_100000196483_100016273825 [0,1,0,0,0,1|2,0,0]=4 2621 B17R1.21954 CCCN(Cc1ccccc1Br)C(=O)C=CBr 240690a_100000196483_100016273825 [0,1,0,0,0,1|2,0,0]=4 2622 B17R1.21954 CCCN(Cc1ccccc1Br)C(=O)C=CCl 11a_100000196483_200016279998 [0,1,0,0,0,1|2,0,0]=4 2623 B17R1.21954 CCCN(Cc1ccccc1Br)C(=O)C=CCl 1626a_100000196483_200016279998 [0,1,0,0,0,1|2,0,0]=4 2624 B17R1.21954 CCCN(Cc1ccccc1Br)C(=O)C=CCl 240690a_100000196483_200016279998 [0,1,0,0,0,1|2,0,0]=4 2625 B17R1.21954 CCCN(Cc1ccccc1Br)C(=O)C=CI 1626a_100000196483_100016256311 [0,1,0,0,0,1|2,0,0]=4 2626 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)C=CBr 1626a_100015185261_100016273825 [0,1,0,0,0,1|1,0,0]=3 2627 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)C=CBr 240690a_100015185261_100016273825 [0,1,0,0,0,1|1,0,0]=3 2628 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)C=CCl 11a_100015185261_200016279998 [0,1,0,0,0,1|1,0,0]=3 2629 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)C=CCl 1626a_100015185261_200016279998 [0,1,0,0,0,1|1,0,0]=3 2630 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)C=CCl 240690a_100015185261_200016279998 [0,1,0,0,0,1|1,0,0]=3 2631 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)C=CI 1626a_100015185261_100016256311 [0,1,0,0,0,1|1,0,0]=3 2632 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)COC 11a_100015185261_100000210968 [0,1,0,0,0,1|1,0,1]=4 2633 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)COC 1626a_100015185261_100000210968 [0,1,0,0,0,1|1,0,1]=4 2634 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)COC 240690a_100015185261_100000210968 [0,1,0,0,0,1|1,0,1]=4 2635 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)COC 527a_100015185261_100000210968 [0,1,0,0,0,1|1,0,1]=4 2636 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)CSC 11a_100015185261_100000184570 [0,1,0,0,0,1|1,0,1]=4 2637 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)CSC 1626a_100015185261_100000184570 [0,1,0,0,0,1|1,0,1]=4 2638 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)CSC 240690a_100015185261_100000184570 [0,1,0,0,0,1|1,0,1]=4 2639 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)CSC 527a_100015185261_100000184570 [0,1,0,0,0,1|1,0,1]=4 2640 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)NCC 2708a_100015525214_100015185261 [0,1,0,0,0,1|1,0,1]=4 2641 B17R1.21954 CCCN(Cc1ccccc1C)C(=O)NCC 273464a_100015525214_100015185261 [0,1,0,0,0,1|1,0,1]=4 2642 B17R1.21954 CCCN(Cc1ccccc1Cl)C(=O)C=CBr 1626a_100015184737_100016273825 [0,1,0,0,0,1|2,0,0]=4 2643 B17R1.21954 CCCN(Cc1ccccc1Cl)C(=O)C=CBr 240690a_100015184737_100016273825 [0,1,0,0,0,1|2,0,0]=4 2644 B17R1.21954 CCCN(Cc1ccccc1Cl)C(=O)C=CCl 11a_100015184737_200016279998 [0,1,0,0,0,1|2,0,0]=4 2645 B17R1.21954 CCCN(Cc1ccccc1Cl)C(=O)C=CCl 1626a_100015184737_200016279998 [0,1,0,0,0,1|2,0,0]=4 2646 B17R1.21954 CCCN(Cc1ccccc1Cl)C(=O)C=CCl 240690a_100015184737_200016279998 [0,1,0,0,0,1|2,0,0]=4 2647 B17R1.21954 CCCN(Cc1ccccc1Cl)C(=O)C=CI 1626a_100015184737_100016256311 [0,1,0,0,0,1|2,0,0]=4 2648 B17R1.21954 CCCN(Cc1ccccc1F)C(=O)C=CBr 1626a_100015184649_100016273825 [0,1,0,0,0,1|2,0,0]=4 2649 B17R1.21954 CCCN(Cc1ccccc1F)C(=O)C=CBr 240690a_100015184649_100016273825 [0,1,0,0,0,1|2,0,0]=4 2650 B17R1.21954 CCCN(Cc1ccccc1F)C(=O)C=CCl 11a_100015184649_200016279998 [0,1,0,0,0,1|2,0,0]=4 2651 B17R1.21954 CCCN(Cc1ccccc1F)C(=O)C=CCl 1626a_100015184649_200016279998 [0,1,0,0,0,1|2,0,0]=4 2652 B17R1.21954 CCCN(Cc1ccccc1F)C(=O)C=CCl 240690a_100015184649_200016279998 [0,1,0,0,0,1|2,0,0]=4 2653 B17R1.21954 CCCN(Cc1ccccc1F)C(=O)C=CI 1626a_100015184649_100016256311 [0,1,0,0,0,1|2,0,0]=4 2654 B17R1.21954 CCCN(Cc1ccccc1O)C(=O)C=CBr 240690a_100000749093_100016273825 [0,1,0,0,0,1|2,0,0]=4 2655 B17R1.21954 CCCN(Cc1ccccc1O)C(=O)C=CCl 240690a_100000749093_200016279998 [0,1,0,0,0,1|2,0,0]=4 2656 B17R1.21954 O=C(C=CBr)N(CCO)Cc1ccccc1Br 240690a_106744479749_100016273825 [0,1,0,0,0,1|2,0,0]=4 2657 B17R1.21954 O=C(C=CBr)N(CCO)Cc1ccccc1Cl 240690a_100015187164_100016273825 [0,1,0,0,0,1|2,0,0]=4 2658 B17R1.21954 O=C(C=CCl)N(CCO)Cc1ccccc1Br 240690a_106744479749_200016279998 [0,1,0,0,0,1|2,0,0]=4 2659 B17R1.21954 O=C(C=CCl)N(CCO)Cc1ccccc1Cl 240690a_100015187164_200016279998 [0,1,0,0,0,1|2,0,0]=4 2660 B17R1.29980 C/C=C/CC(=O)C(CC)Oc1ccccc1Cl 1458a_100000205292_100102629194 [0,1,0,0,0,1|2,0,0]=4 2661 B17R1.29980 C=CC=CC(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100016291481 [0,1,0,0,0,1|0,0,1]=3 2662 B17R1.29980 C=CC=CC(=O)N(CC)Cc1ccccc1Cl 1626a_100000201176_100016291481 [0,1,0,0,0,1|1,0,1]=4 2663 B17R1.29980 C=CC=CC(=O)N(CC)Cc1ccccc1F 1626a_100015186831_100016291481 [0,1,0,0,0,1|1,0,1]=4 2664 B17R1.29980 C=CCCC(=O)N(CC)Cc1ccccc1C 11a_100000201206_100000749702 [0,1,0,0,0,1|0,0,2]=4 2665 B17R1.29980 C=CCCC(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100000749702 [0,1,0,0,0,1|0,0,2]=4 2666 B17R1.29980 C=CCCC(=O)N(CC)Cc1ccccc1C 240690a_100000201206_100000749702 [0,1,0,0,0,1|0,0,2]=4 2667 B17R1.29980 C=CCCC(=O)N(CC)Cc1ccccc1C 527a_100000201206_100000749702 [0,1,0,0,0,1|0,0,2]=4 2668 B17R1.29980 C=CCNC(=O)N(CC)Cc1ccccc1C 273464a_100020586998_100000201206 [0,1,0,0,0,1|0,0,2]=4 2669 B17R1.29980 CC=CCC(=O)C(CC)Oc1ccccc1Cl 1458a_100000205292_100000070051 [0,1,0,0,0,1|2,0,0]=4 2670 B17R1.29980 CC=CCC(=O)N(CC)Cc1ccccc1C 11a_100000201206_100121576822 [0,1,0,0,0,1|0,0,0]=2 2671 B17R1.29980 CC=CCC(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100121576822 [0,1,0,0,0,1|0,0,0]=2 2672 B17R1.29980 CC=CCC(=O)N(CC)Cc1ccccc1C 240690a_100000201206_100121576822 [0,1,0,0,0,1|0,0,0]=2 2673 B17R1.29980 CC=CCC(=O)N(CC)Cc1ccccc1C 527a_100000201206_100121576822 [0,1,0,0,0,1|0,0,0]=2 2674 B17R1.29980 CC=CCC(=O)N(CC)Cc1ccccc1Cl 11a_100000201176_100121576822 [0,1,0,0,0,1|1,0,0]=3 2675 B17R1.29980 CC=CCC(=O)N(CC)Cc1ccccc1Cl 1626a_100000201176_100121576822 [0,1,0,0,0,1|1,0,0]=3 2676 B17R1.29980 CC=CCC(=O)N(CC)Cc1ccccc1Cl 240690a_100000201176_100121576822 [0,1,0,0,0,1|1,0,0]=3 2677 B17R1.29980 CC=CCC(=O)N(CC)Cc1ccccc1Cl 527a_100000201176_100121576822 [0,1,0,0,0,1|1,0,0]=3 2678 B17R1.29980 CC=CCC(=O)N(CC)Cc1ccccc1F 11a_100015186831_100121576822 [0,1,0,0,0,1|1,0,0]=3 2679 B17R1.29980 CC=CCC(=O)N(CC)Cc1ccccc1F 1626a_100015186831_100121576822 [0,1,0,0,0,1|1,0,0]=3 2680 B17R1.29980 CC=CCC(=O)N(CC)Cc1ccccc1F 240690a_100015186831_100121576822 [0,1,0,0,0,1|1,0,0]=3 2681 B17R1.29980 CC=CCC(=O)N(CC)Cc1ccccc1F 527a_100015186831_100121576822 [0,1,0,0,0,1|1,0,0]=3 2682 B17R1.29980 CC=CCC(=O)N(CC)Cc1ccccc1O 240690a_100011223546_100121576822 [0,1,0,0,0,1|1,0,0]=3 2683 B17R1.29980 CC=CCC(=O)N(CC)Cc1ccccc1O 527a_100011223546_100121576822 [0,1,0,0,0,1|1,0,0]=3 2684 B17R1.29980 CCC=CC(=O)N(CC)Cc1ccccc1C 11a_100000201206_100000212282 [0,1,0,0,0,1|0,0,0]=2 2685 B17R1.29980 CCC=CC(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100000212282 [0,1,0,0,0,1|0,0,0]=2 2686 B17R1.29980 CCC=CC(=O)N(CC)Cc1ccccc1C 240690a_100000201206_100000212282 [0,1,0,0,0,1|0,0,0]=2 2687 B17R1.29980 CCC=CC(=O)N(CC)Cc1ccccc1Cl 11a_100000201176_100000212282 [0,1,0,0,0,1|1,0,0]=3 2688 B17R1.29980 CCC=CC(=O)N(CC)Cc1ccccc1Cl 1626a_100000201176_100000212282 [0,1,0,0,0,1|1,0,0]=3 2689 B17R1.29980 CCC=CC(=O)N(CC)Cc1ccccc1Cl 240690a_100000201176_100000212282 [0,1,0,0,0,1|1,0,0]=3 2690 B17R1.29980 CCC=CC(=O)N(CC)Cc1ccccc1F 11a_100015186831_100000212282 [0,1,0,0,0,1|1,0,0]=3 2691 B17R1.29980 CCC=CC(=O)N(CC)Cc1ccccc1F 1626a_100015186831_100000212282 [0,1,0,0,0,1|1,0,0]=3 2692 B17R1.29980 CCC=CC(=O)N(CC)Cc1ccccc1F 240690a_100015186831_100000212282 [0,1,0,0,0,1|1,0,0]=3 2693 B17R1.29980 CCC=CC(=O)N(CC)Cc1ccccc1O 240690a_100011223546_100000212282 [0,1,0,0,0,1|1,0,0]=3 2694 B17R1.29980 CCCCC(=O)N(CC)Cc1ccccc1C 11a_100000201206_100000210183 [0,1,0,0,0,1|0,0,2]=4 2695 B17R1.29980 CCCCC(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100000210183 [0,1,0,0,0,1|0,0,2]=4 2696 B17R1.29980 CCCCC(=O)N(CC)Cc1ccccc1C 240690a_100000201206_100000210183 [0,1,0,0,0,1|0,0,2]=4 2697 B17R1.29980 CCCCC(=O)N(CC)Cc1ccccc1C 527a_100000201206_100000210183 [0,1,0,0,0,1|0,0,2]=4 2698 B17R1.29980 CCCNC(=O)N(CC)Cc1ccccc1C 2708a_100020643023_100000201206 [0,1,0,0,0,1|0,0,2]=4 2699 B17R1.29980 CCCNC(=O)N(CC)Cc1ccccc1C 273464a_100020643023_100000201206 [0,1,0,0,0,1|0,0,2]=4 2700 B17R1.29980 CCN(Cc1ccccc1C)C(=O)C=COC 1626a_100000201206_100016268678 [0,1,0,0,0,1|0,0,0]=2 2701 B17R1.29980 CCN(Cc1ccccc1C)C(=O)C=COC 240690a_100000201206_100016268678 [0,1,0,0,0,1|0,0,0]=2 2702 B17R1.29980 CCN(Cc1ccccc1C)C(=O)CCOC 11a_100000201206_100000749529 [0,1,0,0,0,1|0,0,2]=4 2703 B17R1.29980 CCN(Cc1ccccc1C)C(=O)CCOC 1626a_100000201206_100000749529 [0,1,0,0,0,1|0,0,2]=4 2704 B17R1.29980 CCN(Cc1ccccc1C)C(=O)CCOC 240690a_100000201206_100000749529 [0,1,0,0,0,1|0,0,2]=4 2705 B17R1.29980 CCN(Cc1ccccc1C)C(=O)CCOC 527a_100000201206_100000749529 [0,1,0,0,0,1|0,0,2]=4 2706 B17R1.29980 CCN(Cc1ccccc1C)C(=O)CCSC 11a_100000201206_100000174002 [0,1,0,0,0,1|0,0,2]=4 2707 B17R1.29980 CCN(Cc1ccccc1C)C(=O)CCSC 1626a_100000201206_100000174002 [0,1,0,0,0,1|0,0,2]=4 2708 B17R1.29980 CCN(Cc1ccccc1C)C(=O)CCSC 240690a_100000201206_100000174002 [0,1,0,0,0,1|0,0,2]=4 2709 B17R1.29980 CCN(Cc1ccccc1C)C(=O)CCSC 527a_100000201206_100000174002 [0,1,0,0,0,1|0,0,2]=4 2710 B17R1.29980 CCN(Cc1ccccc1C)C(=O)NCCF 273464a_100000724931_100000201206 [0,1,0,0,0,1|1,0,1]=4 2711 B17R1.29980 CCN(Cc1ccccc1C)C(=O)NCCO 273464a_100000210304_100000201206 [0,1,0,0,0,1|1,0,1]=4 2712 B17R1.29980 CCN(Cc1ccccc1Cl)C(=O)C=COC 1626a_100000201176_100016268678 [0,1,0,0,0,1|1,0,0]=3 2713 B17R1.29980 CCN(Cc1ccccc1Cl)C(=O)C=COC 240690a_100000201176_100016268678 [0,1,0,0,0,1|1,0,0]=3 2714 B17R1.29980 CCN(Cc1ccccc1F)C(=O)C=COC 1626a_100015186831_100016268678 [0,1,0,0,0,1|1,0,0]=3 2715 B17R1.29980 CCN(Cc1ccccc1F)C(=O)C=COC 240690a_100015186831_100016268678 [0,1,0,0,0,1|1,0,0]=3 2716 B17R1.29980 CCN(Cc1ccccc1O)C(=O)C=COC 240690a_100011223546_100016268678 [0,1,0,0,0,1|1,0,0]=3 2717 B17R1.29980 CCOCC(=O)N(CC)Cc1ccccc1C 11a_100000201206_100000211967 [0,1,0,0,0,1|0,0,2]=4 2718 B17R1.29980 CCOCC(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100000211967 [0,1,0,0,0,1|0,0,2]=4 2719 B17R1.29980 CCOCC(=O)N(CC)Cc1ccccc1C 240690a_100000201206_100000211967 [0,1,0,0,0,1|0,0,2]=4 2720 B17R1.29980 CCOCC(=O)N(CC)Cc1ccccc1C 527a_100000201206_100000211967 [0,1,0,0,0,1|0,0,2]=4 2721 B17R1.29980 CCSCC(=O)N(CC)Cc1ccccc1C 11a_100000201206_100000230394 [0,1,0,0,0,1|0,0,2]=4 2722 B17R1.29980 CCSCC(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100000230394 [0,1,0,0,0,1|0,0,2]=4 2723 B17R1.29980 CCSCC(=O)N(CC)Cc1ccccc1C 240690a_100000201206_100000230394 [0,1,0,0,0,1|0,0,2]=4 2724 B17R1.29980 CCSCC(=O)N(CC)Cc1ccccc1C 527a_100000201206_100000230394 [0,1,0,0,0,1|0,0,2]=4 2725 B17R1.114783 CC=CC(=O)N(CC)Cc1ccc(cc1Cl)Cl 11a_100000186925_100000210699 [0,1,0,0,0,1|1,0,0]=3 2726 B17R1.114783 CC=CC(=O)N(CC)Cc1ccc(cc1Cl)Cl 1626a_100000186925_100000210699 [0,1,0,0,0,1|1,0,0]=3 2727 B17R1.114783 CC=CC(=O)N(CC)Cc1ccc(cc1Cl)Cl 240690a_100000186925_100000210699 [0,1,0,0,0,1|1,0,0]=3 2728 B17R1.114783 CCN(Cc1ccc(cc1Cl)Cl)C(=O)C=CBr 1626a_100000186925_100016273825 [0,1,0,0,0,1|2,0,0]=4 2729 B17R1.114783 CCN(Cc1ccc(cc1Cl)Cl)C(=O)C=CBr 240690a_100000186925_100016273825 [0,1,0,0,0,1|2,0,0]=4 2730 B17R1.114783 CCN(Cc1ccc(cc1Cl)Cl)C(=O)C=CCl 11a_100000186925_200016279998 [0,1,0,0,0,1|2,0,0]=4 2731 B17R1.114783 CCN(Cc1ccc(cc1Cl)Cl)C(=O)C=CCl 1626a_100000186925_200016279998 [0,1,0,0,0,1|2,0,0]=4 2732 B17R1.114783 CCN(Cc1ccc(cc1Cl)Cl)C(=O)C=CCl 240690a_100000186925_200016279998 [0,1,0,0,0,1|2,0,0]=4 2733 B17R1.114783 CCN(Cc1ccc(cc1Cl)Cl)C(=O)C=CI 1626a_100000186925_100016256311 [0,1,0,0,0,1|2,0,0]=4 2734 B17R1.370326 CC=CC(=O)N(CC)Cc1c(cccc1Cl)F 11a_200000186927_100000210699 [0,1,0,0,0,1|1,0,0]=3 2735 B17R1.370326 CC=CC(=O)N(CC)Cc1c(cccc1Cl)F 1626a_200000186927_100000210699 [0,1,0,0,0,1|1,0,0]=3 2736 B17R1.370326 CC=CC(=O)N(CC)Cc1c(cccc1Cl)F 240690a_200000186927_100000210699 [0,1,0,0,0,1|1,0,0]=3 2737 B17R1.370326 CC=CC(=O)N(CC)Cc1c(cccc1F)F 11a_100000201297_100000210699 [0,1,0,0,0,1|1,0,0]=3 2738 B17R1.370326 CC=CC(=O)N(CC)Cc1c(cccc1F)F 1626a_100000201297_100000210699 [0,1,0,0,0,1|1,0,0]=3 2739 B17R1.370326 CC=CC(=O)N(CC)Cc1c(cccc1F)F 240690a_100000201297_100000210699 [0,1,0,0,0,1|1,0,0]=3 2740 B17R1.370326 CCN(Cc1c(cccc1Cl)F)C(=O)C=CBr 1626a_200000186927_100016273825 [0,1,0,0,0,1|2,0,0]=4 2741 B17R1.370326 CCN(Cc1c(cccc1Cl)F)C(=O)C=CBr 240690a_200000186927_100016273825 [0,1,0,0,0,1|2,0,0]=4 2742 B17R1.370326 CCN(Cc1c(cccc1Cl)F)C(=O)C=CCl 11a_200000186927_200016279998 [0,1,0,0,0,1|2,0,0]=4 2743 B17R1.370326 CCN(Cc1c(cccc1Cl)F)C(=O)C=CCl 1626a_200000186927_200016279998 [0,1,0,0,0,1|2,0,0]=4 2744 B17R1.370326 CCN(Cc1c(cccc1Cl)F)C(=O)C=CCl 240690a_200000186927_200016279998 [0,1,0,0,0,1|2,0,0]=4 2745 B17R1.370326 CCN(Cc1c(cccc1Cl)F)C(=O)C=CI 1626a_200000186927_100016256311 [0,1,0,0,0,1|2,0,0]=4 2746 B17R1.370326 CCN(Cc1c(cccc1F)F)C(=O)C=CBr 1626a_100000201297_100016273825 [0,1,0,0,0,1|2,0,0]=4 2747 B17R1.370326 CCN(Cc1c(cccc1F)F)C(=O)C=CBr 240690a_100000201297_100016273825 [0,1,0,0,0,1|2,0,0]=4 2748 B17R1.370326 CCN(Cc1c(cccc1F)F)C(=O)C=CCl 11a_100000201297_200016279998 [0,1,0,0,0,1|2,0,0]=4 2749 B17R1.370326 CCN(Cc1c(cccc1F)F)C(=O)C=CCl 1626a_100000201297_200016279998 [0,1,0,0,0,1|2,0,0]=4 2750 B17R1.370326 CCN(Cc1c(cccc1F)F)C(=O)C=CCl 240690a_100000201297_200016279998 [0,1,0,0,0,1|2,0,0]=4 2751 B17R1.370326 CCN(Cc1c(cccc1F)F)C(=O)C=CI 1626a_100000201297_100016256311 [0,1,0,0,0,1|2,0,0]=4 2752 B17R1.1521 C=CC=CC(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100016291481 [0,2,0,0,0,0|0,0,1]=3 2753 B17R1.1521 C=CC=CC(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100016291481 [0,2,0,0,0,0|0,0,1]=3 2754 B17R1.1521 C=CCCC(=O)N(CC)c1cccc(c1C)C 11a_100000219776_100000749702 [0,2,0,0,0,0|0,0,2]=4 2755 B17R1.1521 C=CCCC(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100000749702 [0,2,0,0,0,0|0,0,2]=4 2756 B17R1.1521 C=CCCC(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100000749702 [0,2,0,0,0,0|0,0,2]=4 2757 B17R1.1521 C=CCNC(=O)N(CC)c1cccc(c1C)C 512a_100000219776_100020586998 [0,2,0,0,0,0|0,0,2]=4 2758 B17R1.1521 C=CCNC(=O)N(CC)c1cccc(c1C)C 512a_100020586998_100000219776 [0,2,0,0,0,0|0,0,2]=4 2759 B17R1.1521 CC=CCC(=O)N(CC)c1cccc(c1C)C 11a_100000219776_100121576822 [0,2,0,0,0,0|0,0,0]=2 2760 B17R1.1521 CC=CCC(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100121576822 [0,2,0,0,0,0|0,0,0]=2 2761 B17R1.1521 CC=CCC(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100121576822 [0,2,0,0,0,0|0,0,0]=2 2762 B17R1.1521 CCC#CC(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100011827653 [0,2,0,0,0,0|0,0,2]=4 2763 B17R1.1521 CCC=CC(=O)N(CC)c1cccc(c1C)C 11a_100000219776_100000212282 [0,2,0,0,0,0|0,0,0]=2 2764 B17R1.1521 CCC=CC(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100000212282 [0,2,0,0,0,0|0,0,0]=2 2765 B17R1.1521 CCC=CC(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100000212282 [0,2,0,0,0,0|0,0,0]=2 2766 B17R1.1521 CCCCC(=O)N(CC)c1cccc(c1C)C 11a_100000219776_100000210183 [0,2,0,0,0,0|0,0,2]=4 2767 B17R1.1521 CCCCC(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100000210183 [0,2,0,0,0,0|0,0,2]=4 2768 B17R1.1521 CCCCC(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100000210183 [0,2,0,0,0,0|0,0,2]=4 2769 B17R1.1521 CCCNC(=O)N(CC)c1cccc(c1C)C 512a_100000219776_100020643023 [0,2,0,0,0,0|0,0,2]=4 2770 B17R1.1521 CCCNC(=O)N(CC)c1cccc(c1C)C 512a_100020643023_100000219776 [0,2,0,0,0,0|0,0,2]=4 2771 B17R1.1521 CCN(C(=O)C=COC)c1cccc(c1C)C 1626a_100000219776_100016268678 [0,2,0,0,0,0|0,0,0]=2 2772 B17R1.1521 CCN(C(=O)C=COC)c1cccc(c1C)C 22a_100000219776_100016268678 [0,2,0,0,0,0|0,0,0]=2 2773 B17R1.1521 CCN(C(=O)CCOC)c1cccc(c1C)C 11a_100000219776_100000749529 [0,2,0,0,0,0|0,0,2]=4 2774 B17R1.1521 CCN(C(=O)CCOC)c1cccc(c1C)C 1626a_100000219776_100000749529 [0,2,0,0,0,0|0,0,2]=4 2775 B17R1.1521 CCN(C(=O)CCOC)c1cccc(c1C)C 22a_100000219776_100000749529 [0,2,0,0,0,0|0,0,2]=4 2776 B17R1.1521 CCN(C(=O)CCSC)c1cccc(c1C)C 11a_100000219776_100000174002 [0,2,0,0,0,0|0,0,2]=4 2777 B17R1.1521 CCN(C(=O)CCSC)c1cccc(c1C)C 1626a_100000219776_100000174002 [0,2,0,0,0,0|0,0,2]=4 2778 B17R1.1521 CCN(C(=O)CCSC)c1cccc(c1C)C 22a_100000219776_100000174002 [0,2,0,0,0,0|0,0,2]=4 2779 B17R1.1521 CCN(C(=O)NCCF)c1cccc(c1C)C 512a_100000219776_100000724931 [0,2,0,0,0,0|1,0,1]=4 2780 B17R1.1521 CCN(C(=O)NCCO)c1cccc(c1C)C 512a_100000219776_100000210304 [0,2,0,0,0,0|1,0,1]=4 2781 B17R1.1521 CCNNC(=O)N(CC)c1cccc(c1C)C 512a_100000219776_100000756455 [0,2,0,0,0,0|1,0,1]=4 2782 B17R1.1521 CCNNC(=O)N(CC)c1cccc(c1C)C 512a_100000756455_100000219776 [0,2,0,0,0,0|1,0,1]=4 2783 B17R1.1521 CCOCC(=O)N(CC)c1cccc(c1C)C 11a_100000219776_100000211967 [0,2,0,0,0,0|0,0,2]=4 2784 B17R1.1521 CCOCC(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100000211967 [0,2,0,0,0,0|0,0,2]=4 2785 B17R1.1521 CCOCC(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100000211967 [0,2,0,0,0,0|0,0,2]=4 2786 B17R1.1521 CCSCC(=O)N(CC)c1cccc(c1C)C 11a_100000219776_100000230394 [0,2,0,0,0,0|0,0,2]=4 2787 B17R1.1521 CCSCC(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100000230394 [0,2,0,0,0,0|0,0,2]=4 2788 B17R1.1521 CCSCC(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100000230394 [0,2,0,0,0,0|0,0,2]=4 2789 B17R1.1753 C/C=C(\C)/C(=O)N(CC)c1cccc(c1C)C 11a_100000219776_100020587367 [0,2,0,0,0,0|0,0,0]=2 2790 B17R1.1753 C/C=C(\C)/C(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100020587367 [0,2,0,0,0,0|0,0,0]=2 2791 B17R1.1753 C/C=C(\C)/C(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100020587367 [0,2,0,0,0,0|0,0,0]=2 2792 B17R1.1753 C=C(CO)C(=O)N(CC)c1cccc(c1C)C 22a_100000219776_200000705526 [0,2,0,0,0,0|1,0,1]=4 2793 B17R1.1753 C=CC(C)C(=O)N(CC)c1cccc(c1C)C 11a_100000219776_100011216780 [0,2,0,0,0,0|0,0,2]=4 2794 B17R1.1753 C=CC(C)C(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100011216780 [0,2,0,0,0,0|0,0,2]=4 2795 B17R1.1753 C=CC(C)C(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100011216780 [0,2,0,0,0,0|0,0,2]=4 2796 B17R1.1753 CCC(C)C(=O)N(CC)c1cccc(c1C)C 11a_100000219776_100011192722 [0,2,0,0,0,0|0,0,2]=4 2797 B17R1.1753 CCC(C)C(=O)N(CC)c1cccc(c1C)C 1626a_100000219776_100011192722 [0,2,0,0,0,0|0,0,2]=4 2798 B17R1.1753 CCC(C)C(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100011192722 [0,2,0,0,0,0|0,0,2]=4 2799 B17R1.1753 CCC(O)C(=O)N(CC)c1cccc(c1C)C 22a_100000219776_100011196387 [0,2,0,0,0,0|0,0,2]=4 2800 B17R1.1753 CCN(C(=O)C(=O)NC)c1cccc(c1C)C 1626a_100000219776_100011218921 [0,2,0,0,0,0|1,0,0]=3 2801 B17R1.1753 CCN(C(=O)C(=O)NC)c1cccc(c1C)C 22a_100000219776_100011218921 [0,2,0,0,0,0|1,0,0]=3 2802 B17R1.1753 CCN(C(=O)C(=O)OC)c1cccc(c1C)C 11a_100000219776_100000024059 [0,2,0,0,0,0|1,0,0]=3 2803 B17R1.1753 CCN(C(=O)C(=O)OC)c1cccc(c1C)C 1626a_100000219776_100000024059 [0,2,0,0,0,0|1,0,0]=3 2804 B17R1.1753 CCN(C(=O)C(C)OC)c1cccc(c1C)C 11a_100000219776_100000743197 [0,2,0,0,0,0|1,0,1]=4 2805 B17R1.1753 CCN(C(=O)C(C)OC)c1cccc(c1C)C 1626a_100000219776_100000743197 [0,2,0,0,0,0|1,0,1]=4 2806 B17R1.1753 CCN(C(=O)C(C)OC)c1cccc(c1C)C 22a_100000219776_100000743197 [0,2,0,0,0,0|1,0,1]=4 2807 B17R1.1753 CCN(C(=O)C(C)SC)c1cccc(c1C)C 11a_100000219776_100000149566 [0,2,0,0,0,0|1,0,1]=4 2808 B17R1.1753 CCN(C(=O)C(C)SC)c1cccc(c1C)C 1626a_100000219776_100000149566 [0,2,0,0,0,0|1,0,1]=4 2809 B17R1.1753 CCN(C(=O)C(C)SC)c1cccc(c1C)C 22a_100000219776_100000149566 [0,2,0,0,0,0|1,0,1]=4 2810 B17R1.2951 CCN(C(=O)C=C(C)C)c1cccc(c1C)C 11a_100000219776_100000211388 [0,2,0,0,0,0|0,0,0]=2 2811 B17R1.2951 CCN(C(=O)C=C(C)C)c1cccc(c1C)C 1626a_100000219776_100000211388 [0,2,0,0,0,0|0,0,0]=2 2812 B17R1.2951 CCN(C(=O)C=C(C)C)c1cccc(c1C)C 22a_100000219776_100000211388 [0,2,0,0,0,0|0,0,0]=2 2813 B17R1.2951 CCN(C(=O)C=C(C)Cl)c1cccc(c1C)C 11a_100000219776_200042562850 [0,2,0,0,0,0|0,0,0]=2 2814 B17R1.2951 CCN(C(=O)C=C(C)Cl)c1cccc(c1C)C 1626a_100000219776_200042562850 [0,2,0,0,0,0|0,0,0]=2 2815 B17R1.2951 CCN(C(=O)C=C(C)Cl)c1cccc(c1C)C 22a_100000219776_200042562850 [0,2,0,0,0,0|0,0,0]=2 2816 B17R1.2951 CCN(C(=O)C=C(C)I)c1cccc(c1C)C 11a_100000219776_100025716642 [0,2,0,0,0,0|0,0,0]=2 2817 B17R1.2951 CCN(C(=O)C=C(C)I)c1cccc(c1C)C 1626a_100000219776_100025716642 [0,2,0,0,0,0|0,0,0]=2 2818 B17R1.2951 CCN(C(=O)C=C(Cl)Cl)c1cccc(c1C)C 1626a_100000219776_100000137448 [0,2,0,0,0,0|1,0,0]=3 2819 B17R1.2951 CCN(C(=O)CC(=O)N)c1cccc(c1C)C 22a_100000219776_100134613110 [0,2,0,0,0,0|1,0,1]=4 2820 B17R1.2951 CCN(C(=O)CC(C)C)c1cccc(c1C)C 11a_100000219776_100000210554 [0,2,0,0,0,0|0,0,2]=4 2821 B17R1.2951 CCN(C(=O)CC(C)C)c1cccc(c1C)C 1626a_100000219776_100000210554 [0,2,0,0,0,0|0,0,2]=4 2822 B17R1.2951 CCN(C(=O)CC(C)C)c1cccc(c1C)C 22a_100000219776_100000210554 [0,2,0,0,0,0|0,0,2]=4 2823 B17R1.2951 CCN(C(=O)CN(C)C)c1cccc(c1C)C 11a_100000219776_100000750896 [0,2,0,0,0,0|1,0,1]=4 2824 B17R1.2951 CCN(C(=O)CN(C)C)c1cccc(c1C)C 22a_100000219776_100000750896 [0,2,0,0,0,0|1,0,1]=4 2825 B17R1.2951 CCN(C(=O)C[C@@H](C)O)c1cccc(c1C)C 22a_100000219776_100011933948 [0,2,0,0,0,0|0,0,2]=4 2826 B17R1.2951 CCN(C(=O)C[S+](C)C)c1cccc(c1C)C 11a_100000219776_200159257847 [0,2,0,0,0,0|1,0,1]=4 2827 B17R1.2951 CCN(C(=O)C[S+](C)C)c1cccc(c1C)C 1626a_100000219776_200159257847 [0,2,0,0,0,0|1,0,1]=4 2828 B17R1.2951 CCN(C(=O)C[S+](C)C)c1cccc(c1C)C 22a_100000219776_200159257847 [0,2,0,0,0,0|1,0,1]=4 2829 B17R1.2951 CCN(C(=O)NC(C)C)c1cccc(c1C)C 512a_100000219776_100138425928 [0,2,0,0,0,0|1,0,1]=4 2830 B17R1.2951 CCN(C(=O)NC(C)C)c1cccc(c1C)C 512a_100138425928_100000219776 [0,2,0,0,0,0|1,0,1]=4 2831 B17R1.2042 C/C=C(\C)/C(=O)N(CC)c1cc(ccc1C)C 11a_100000743043_100020587367 [0,2,0,0,0,0|0,0,0]=2 2832 B17R1.2042 C/C=C(\C)/C(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100020587367 [0,2,0,0,0,0|0,0,0]=2 2833 B17R1.2042 C/C=C(\C)/C(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100020587367 [0,2,0,0,0,0|0,0,0]=2 2834 B17R1.2042 C=C(CO)C(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_200000705526 [0,2,0,0,0,0|1,0,1]=4 2835 B17R1.2042 C=CC(C)C(=O)N(CC)c1cc(ccc1C)C 11a_100000743043_100011216780 [0,2,0,0,0,0|0,0,2]=4 2836 B17R1.2042 C=CC(C)C(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100011216780 [0,2,0,0,0,0|0,0,2]=4 2837 B17R1.2042 C=CC(C)C(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100011216780 [0,2,0,0,0,0|0,0,2]=4 2838 B17R1.2042 CCC(C)C(=O)N(CC)c1cc(ccc1C)C 11a_100000743043_100011192722 [0,2,0,0,0,0|0,0,2]=4 2839 B17R1.2042 CCC(C)C(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100011192722 [0,2,0,0,0,0|0,0,2]=4 2840 B17R1.2042 CCC(C)C(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100011192722 [0,2,0,0,0,0|0,0,2]=4 2841 B17R1.2042 CCC(O)C(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100011196387 [0,2,0,0,0,0|0,0,2]=4 2842 B17R1.2042 CCN(C(=O)C(=O)NC)c1cc(ccc1C)C 1626a_100000743043_100011218921 [0,2,0,0,0,0|1,0,0]=3 2843 B17R1.2042 CCN(C(=O)C(=O)NC)c1cc(ccc1C)C 22a_100000743043_100011218921 [0,2,0,0,0,0|1,0,0]=3 2844 B17R1.2042 CCN(C(=O)C(=O)OC)c1cc(ccc1C)C 11a_100000743043_100000024059 [0,2,0,0,0,0|1,0,0]=3 2845 B17R1.2042 CCN(C(=O)C(=O)OC)c1cc(ccc1C)C 1626a_100000743043_100000024059 [0,2,0,0,0,0|1,0,0]=3 2846 B17R1.2042 CCN(C(=O)C(C)OC)c1cc(ccc1C)C 11a_100000743043_100000743197 [0,2,0,0,0,0|1,0,1]=4 2847 B17R1.2042 CCN(C(=O)C(C)OC)c1cc(ccc1C)C 1626a_100000743043_100000743197 [0,2,0,0,0,0|1,0,1]=4 2848 B17R1.2042 CCN(C(=O)C(C)OC)c1cc(ccc1C)C 22a_100000743043_100000743197 [0,2,0,0,0,0|1,0,1]=4 2849 B17R1.2042 CCN(C(=O)C(C)SC)c1cc(ccc1C)C 11a_100000743043_100000149566 [0,2,0,0,0,0|1,0,1]=4 2850 B17R1.2042 CCN(C(=O)C(C)SC)c1cc(ccc1C)C 1626a_100000743043_100000149566 [0,2,0,0,0,0|1,0,1]=4 2851 B17R1.2042 CCN(C(=O)C(C)SC)c1cc(ccc1C)C 22a_100000743043_100000149566 [0,2,0,0,0,0|1,0,1]=4 2852 B17R1.2401 C/C=C(\C)/C(=O)N(c1ccccc1Br)C(C)C 1626a_100000219599_100020587367 [0,2,0,0,0,0|1,0,0]=3 2853 B17R1.2401 C/C=C(\C)/C(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100020587367 [0,2,0,0,0,0|0,0,0]=2 2854 B17R1.2401 C/C=C(\C)/C(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100020587367 [0,2,0,0,0,0|0,0,0]=2 2855 B17R1.2401 C/C=C(\C)/C(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100020587367 [0,2,0,0,0,0|1,0,0]=3 2856 B17R1.2401 C/C=C(\C)/C(=O)N(c1ccccc1F)C(C)C 11a_100000220358_100020587367 [0,2,0,0,0,0|1,0,0]=3 2857 B17R1.2401 C/C=C(\C)/C(=O)N(c1ccccc1F)C(C)C 1626a_100000220358_100020587367 [0,2,0,0,0,0|1,0,0]=3 2858 B17R1.2401 C=CC(C)C(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100011216780 [0,2,0,0,0,0|0,0,2]=4 2859 B17R1.2401 C=CC(C)C(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100011216780 [0,2,0,0,0,0|0,0,2]=4 2860 B17R1.2401 CCC(C)C(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100011192722 [0,2,0,0,0,0|0,0,2]=4 2861 B17R1.2401 CCC(C)C(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100011192722 [0,2,0,0,0,0|0,0,2]=4 2862 B17R1.2401 CNC(=O)C(=O)N(c1ccccc1Br)C(C)C 1626a_100000219599_100011218921 [0,2,0,0,0,0|2,0,0]=4 2863 B17R1.2401 CNC(=O)C(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100011218921 [0,2,0,0,0,0|1,0,0]=3 2864 B17R1.2401 CNC(=O)C(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100011218921 [0,2,0,0,0,0|2,0,0]=4 2865 B17R1.2401 CNC(=O)C(=O)N(c1ccccc1F)C(C)C 1626a_100000220358_100011218921 [0,2,0,0,0,0|2,0,0]=4 2866 B17R1.2401 COC(=O)C(=O)N(c1ccccc1Br)C(C)C 1626a_100000219599_100000024059 [0,2,0,0,0,0|2,0,0]=4 2867 B17R1.2401 COC(=O)C(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000024059 [0,2,0,0,0,0|1,0,0]=3 2868 B17R1.2401 COC(=O)C(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000024059 [0,2,0,0,0,0|1,0,0]=3 2869 B17R1.2401 COC(=O)C(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100000024059 [0,2,0,0,0,0|2,0,0]=4 2870 B17R1.2401 COC(=O)C(=O)N(c1ccccc1F)C(C)C 11a_100000220358_100000024059 [0,2,0,0,0,0|2,0,0]=4 2871 B17R1.2401 COC(=O)C(=O)N(c1ccccc1F)C(C)C 1626a_100000220358_100000024059 [0,2,0,0,0,0|2,0,0]=4 2872 B17R1.2401 COC(C)C(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000743197 [0,2,0,0,0,0|1,0,1]=4 2873 B17R1.2401 COC(C)C(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000743197 [0,2,0,0,0,0|1,0,1]=4 2874 B17R1.2401 CSC(C)C(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000149566 [0,2,0,0,0,0|1,0,1]=4 2875 B17R1.2401 CSC(C)C(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000149566 [0,2,0,0,0,0|1,0,1]=4 2876 B17R1.3110 CCN(C(=O)C(=C(Cl)Cl)Cl)c1ccccc1Br 11a_114873767003_100000031907 [0,2,0,0,0,0|2,0,0]=4 2877 B17R1.3110 CCN(C(=O)C(=C(Cl)Cl)Cl)c1ccccc1Br 1626a_114873767003_100000031907 [0,2,0,0,0,0|2,0,0]=4 2878 B17R1.3110 CCN(C(=O)C(=C(Cl)Cl)Cl)c1ccccc1C 11a_100000211084_100000031907 [0,2,0,0,0,0|1,0,0]=3 2879 B17R1.3110 CCN(C(=O)C(=C(Cl)Cl)Cl)c1ccccc1C 1626a_100000211084_100000031907 [0,2,0,0,0,0|1,0,0]=3 2880 B17R1.3110 CCN(C(=O)C(=C(Cl)Cl)Cl)c1ccccc1C 22a_100000211084_100000031907 [0,2,0,0,0,0|1,0,0]=3 2881 B17R1.3110 CCN(C(=O)C(=C(Cl)Cl)Cl)c1ccccc1F 11a_100000220365_100000031907 [0,2,0,0,0,0|2,0,0]=4 2882 B17R1.3110 CCN(C(=O)C(=C(Cl)Cl)Cl)c1ccccc1F 1626a_100000220365_100000031907 [0,2,0,0,0,0|2,0,0]=4 2883 B17R1.3110 CCN(C(=O)C(=C(Cl)Cl)Cl)c1ccccc1O 22a_103624766699_100000031907 [0,2,0,0,0,0|2,0,0]=4 2884 B17R1.3110 CCN(C(=O)C(=O)N(C)C)c1ccccc1Br 1626a_114873767003_100011218876 [0,2,0,0,0,0|2,0,0]=4 2885 B17R1.3110 CCN(C(=O)C(=O)N(C)C)c1ccccc1C 1626a_100000211084_100011218876 [0,2,0,0,0,0|1,0,0]=3 2886 B17R1.3110 CCN(C(=O)C(=O)N(C)C)c1ccccc1C 22a_100000211084_100011218876 [0,2,0,0,0,0|1,0,0]=3 2887 B17R1.3110 CCN(C(=O)C(=O)N(C)C)c1ccccc1F 1626a_100000220365_100011218876 [0,2,0,0,0,0|2,0,0]=4 2888 B17R1.3110 CCN(C(=O)C(=O)N(C)C)c1ccccc1O 22a_103624766699_100011218876 [0,2,0,0,0,0|2,0,0]=4 2889 B17R1.3110 CCN(C(=O)C(C)C(C)C)c1ccccc1C 11a_100000211084_100000755409 [0,2,0,0,0,0|0,0,2]=4 2890 B17R1.3110 CCN(C(=O)C(C)C(C)C)c1ccccc1C 1626a_100000211084_100000755409 [0,2,0,0,0,0|0,0,2]=4 2891 B17R1.3110 CCN(C(=O)C(C)C(C)C)c1ccccc1C 22a_100000211084_100000755409 [0,2,0,0,0,0|0,0,2]=4 2892 B17R1.3110 CCN(C(=O)[C@H](C)N(C)C)c1ccccc1C 22a_100000211084_100009822176 [0,2,0,0,0,0|1,0,1]=4 2893 B17R1.3110 CCN(C(=O)[C@H](O)C(C)C)c1ccccc1C 22a_100000211084_100000691806 [0,2,0,0,0,0|0,0,2]=4 2894 B17R1.19247 C/C=C(\C)/C(=O)N(CCC)c1ccccc1F 11a_100011231789_100020587367 [0,2,0,0,0,0|1,0,0]=3 2895 B17R1.19247 C/C=C(\C)/C(=O)N(CCC)c1ccccc1F 1626a_100011231789_100020587367 [0,2,0,0,0,0|1,0,0]=3 2896 B17R1.19247 CCCN(C(=O)C(=O)NC)c1ccccc1F 1626a_100011231789_100011218921 [0,2,0,0,0,0|2,0,0]=4 2897 B17R1.19247 CCCN(C(=O)C(=O)OC)c1ccccc1F 11a_100011231789_100000024059 [0,2,0,0,0,0|2,0,0]=4 2898 B17R1.19247 CCCN(C(=O)C(=O)OC)c1ccccc1F 1626a_100011231789_100000024059 [0,2,0,0,0,0|2,0,0]=4 2899 B17R1.27051 C/C=C(\C)/C(=O)N(CC)c1ccccc1C#N 1626a_200000218880_100020587367 [0,2,0,0,0,0|0,0,1]=3 2900 B17R1.27051 C/C=C(\C)/C(=O)N(CC)c1ccccc1OC 11a_100020603010_100020587367 [0,2,0,0,0,0|0,0,0]=2 2901 B17R1.27051 C/C=C(\C)/C(=O)N(CC)c1ccccc1OC 1626a_100020603010_100020587367 [0,2,0,0,0,0|0,0,0]=2 2902 B17R1.27051 C/C=C(\C)/C(=O)N(CC)c1ccccc1OC 22a_100020603010_100020587367 [0,2,0,0,0,0|0,0,0]=2 2903 B17R1.27051 C=C(CO)C(=O)N(CC)c1ccccc1OC 22a_100020603010_200000705526 [0,2,0,0,0,0|1,0,1]=4 2904 B17R1.27051 C=CC(C)C(=O)N(CC)c1ccccc1OC 11a_100020603010_100011216780 [0,2,0,0,0,0|0,0,2]=4 2905 B17R1.27051 C=CC(C)C(=O)N(CC)c1ccccc1OC 1626a_100020603010_100011216780 [0,2,0,0,0,0|0,0,2]=4 2906 B17R1.27051 C=CC(C)C(=O)N(CC)c1ccccc1OC 22a_100020603010_100011216780 [0,2,0,0,0,0|0,0,2]=4 2907 B17R1.27051 CCC(C)C(=O)N(CC)c1ccccc1OC 11a_100020603010_100011192722 [0,2,0,0,0,0|0,0,2]=4 2908 B17R1.27051 CCC(C)C(=O)N(CC)c1ccccc1OC 1626a_100020603010_100011192722 [0,2,0,0,0,0|0,0,2]=4 2909 B17R1.27051 CCC(C)C(=O)N(CC)c1ccccc1OC 22a_100020603010_100011192722 [0,2,0,0,0,0|0,0,2]=4 2910 B17R1.27051 CCC(O)C(=O)N(CC)c1ccccc1OC 22a_100020603010_100011196387 [0,2,0,0,0,0|0,0,2]=4 2911 B17R1.27051 CCN(C(=O)C(=O)NC)c1ccccc1C#N 1626a_200000218880_100011218921 [0,2,0,0,0,0|1,0,1]=4 2912 B17R1.27051 CCN(C(=O)C(=O)NC)c1ccccc1OC 1626a_100020603010_100011218921 [0,2,0,0,0,0|1,0,0]=3 2913 B17R1.27051 CCN(C(=O)C(=O)NC)c1ccccc1OC 22a_100020603010_100011218921 [0,2,0,0,0,0|1,0,0]=3 2914 B17R1.27051 CCN(C(=O)C(=O)OC)c1ccccc1C#N 1626a_200000218880_100000024059 [0,2,0,0,0,0|1,0,1]=4 2915 B17R1.27051 CCN(C(=O)C(=O)OC)c1ccccc1OC 11a_100020603010_100000024059 [0,2,0,0,0,0|1,0,0]=3 2916 B17R1.27051 CCN(C(=O)C(=O)OC)c1ccccc1OC 1626a_100020603010_100000024059 [0,2,0,0,0,0|1,0,0]=3 2917 B17R1.27051 CCN(C(=O)C(C)OC)c1ccccc1OC 11a_100020603010_100000743197 [0,2,0,0,0,0|1,0,1]=4 2918 B17R1.27051 CCN(C(=O)C(C)OC)c1ccccc1OC 1626a_100020603010_100000743197 [0,2,0,0,0,0|1,0,1]=4 2919 B17R1.27051 CCN(C(=O)C(C)OC)c1ccccc1OC 22a_100020603010_100000743197 [0,2,0,0,0,0|1,0,1]=4 2920 B17R1.27051 CCN(C(=O)C(C)SC)c1ccccc1OC 11a_100020603010_100000149566 [0,2,0,0,0,0|1,0,1]=4 2921 B17R1.27051 CCN(C(=O)C(C)SC)c1ccccc1OC 1626a_100020603010_100000149566 [0,2,0,0,0,0|1,0,1]=4 2922 B17R1.27051 CCN(C(=O)C(C)SC)c1ccccc1OC 22a_100020603010_100000149566 [0,2,0,0,0,0|1,0,1]=4 2923 B17R1.101693 CCC(CC)C(=O)N(CC)c1ccccc1C 11a_100000211084_100000211163 [0,2,0,0,0,0|0,0,2]=4 2924 B17R1.101693 CCC(CC)C(=O)N(CC)c1ccccc1C 1626a_100000211084_100000211163 [0,2,0,0,0,0|0,0,2]=4 2925 B17R1.101693 CCC(CC)C(=O)N(CC)c1ccccc1C 22a_100000211084_100000211163 [0,2,0,0,0,0|0,0,2]=4 2926 B17R1.101693 CCC(OC)C(=O)N(CC)c1ccccc1C 11a_100000211084_100000747056 [0,2,0,0,0,0|0,0,2]=4 2927 B17R1.101693 CCC(OC)C(=O)N(CC)c1ccccc1C 1626a_100000211084_100000747056 [0,2,0,0,0,0|0,0,2]=4 2928 B17R1.101693 CCC(OC)C(=O)N(CC)c1ccccc1C 22a_100000211084_100000747056 [0,2,0,0,0,0|0,0,2]=4 2929 B17R1.101693 CCN(C(=O)C(OC)OC)c1ccccc1C 11a_100000211084_100000046285 [0,2,0,0,0,0|1,0,1]=4 2930 B17R1.101693 CCN(C(=O)C(OC)OC)c1ccccc1C 22a_100000211084_100000046285 [0,2,0,0,0,0|1,0,1]=4 2931 B17R1.138174 CCN(c1ccccc1C)C(C=O)C(=O)OC 34a_100000211084_100000046368 [0,2,0,0,0,0|1,0,1]=4 2932 B17R1.178109 C/C=C(\C)/C(=O)N(CC)c1ccc(cc1C)F 11a_100000221679_100020587367 [0,2,0,0,0,0|0,0,0]=2 2933 B17R1.178109 C/C=C(\C)/C(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100020587367 [0,2,0,0,0,0|0,0,0]=2 2934 B17R1.178109 C/C=C(\C)/C(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100020587367 [0,2,0,0,0,0|0,0,0]=2 2935 B17R1.178109 C/C=C(\C)/C(=O)N(CC)c1ccc(cc1Cl)Cl 11a_100160557746_100020587367 [0,2,0,0,0,0|1,0,0]=3 2936 B17R1.178109 C/C=C(\C)/C(=O)N(CC)c1ccc(cc1Cl)Cl 1626a_100160557746_100020587367 [0,2,0,0,0,0|1,0,0]=3 2937 B17R1.178109 C=C(CO)C(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_200000705526 [0,2,0,0,0,0|1,0,1]=4 2938 B17R1.178109 C=CC(C)C(=O)N(CC)c1ccc(cc1C)F 11a_100000221679_100011216780 [0,2,0,0,0,0|0,0,2]=4 2939 B17R1.178109 C=CC(C)C(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100011216780 [0,2,0,0,0,0|0,0,2]=4 2940 B17R1.178109 C=CC(C)C(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100011216780 [0,2,0,0,0,0|0,0,2]=4 2941 B17R1.178109 CCC(C)C(=O)N(CC)c1ccc(cc1C)F 11a_100000221679_100011192722 [0,2,0,0,0,0|0,0,2]=4 2942 B17R1.178109 CCC(C)C(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100011192722 [0,2,0,0,0,0|0,0,2]=4 2943 B17R1.178109 CCC(C)C(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100011192722 [0,2,0,0,0,0|0,0,2]=4 2944 B17R1.178109 CCC(O)C(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100011196387 [0,2,0,0,0,0|0,0,2]=4 2945 B17R1.178109 CCN(C(=O)C(=O)NC)c1ccc(cc1C)F 1626a_100000221679_100011218921 [0,2,0,0,0,0|1,0,0]=3 2946 B17R1.178109 CCN(C(=O)C(=O)NC)c1ccc(cc1C)F 22a_100000221679_100011218921 [0,2,0,0,0,0|1,0,0]=3 2947 B17R1.178109 CCN(C(=O)C(=O)NC)c1ccc(cc1Cl)Cl 1626a_100160557746_100011218921 [0,2,0,0,0,0|2,0,0]=4 2948 B17R1.178109 CCN(C(=O)C(=O)OC)c1ccc(cc1C)F 11a_100000221679_100000024059 [0,2,0,0,0,0|1,0,0]=3 2949 B17R1.178109 CCN(C(=O)C(=O)OC)c1ccc(cc1C)F 1626a_100000221679_100000024059 [0,2,0,0,0,0|1,0,0]=3 2950 B17R1.178109 CCN(C(=O)C(=O)OC)c1ccc(cc1Cl)Cl 11a_100160557746_100000024059 [0,2,0,0,0,0|2,0,0]=4 2951 B17R1.178109 CCN(C(=O)C(=O)OC)c1ccc(cc1Cl)Cl 1626a_100160557746_100000024059 [0,2,0,0,0,0|2,0,0]=4 2952 B17R1.178109 CCN(C(=O)C(C)OC)c1ccc(cc1C)F 11a_100000221679_100000743197 [0,2,0,0,0,0|1,0,1]=4 2953 B17R1.178109 CCN(C(=O)C(C)OC)c1ccc(cc1C)F 1626a_100000221679_100000743197 [0,2,0,0,0,0|1,0,1]=4 2954 B17R1.178109 CCN(C(=O)C(C)OC)c1ccc(cc1C)F 22a_100000221679_100000743197 [0,2,0,0,0,0|1,0,1]=4 2955 B17R1.178109 CCN(C(=O)C(C)SC)c1ccc(cc1C)F 11a_100000221679_100000149566 [0,2,0,0,0,0|1,0,1]=4 2956 B17R1.178109 CCN(C(=O)C(C)SC)c1ccc(cc1C)F 1626a_100000221679_100000149566 [0,2,0,0,0,0|1,0,1]=4 2957 B17R1.178109 CCN(C(=O)C(C)SC)c1ccc(cc1C)F 22a_100000221679_100000149566 [0,2,0,0,0,0|1,0,1]=4 2958 B17R1.183798 C=CC(C)(C)C(=O)N(CC)c1ccccc1C 11a_100000211084_100012027013 [0,2,0,0,0,0|0,0,2]=4 2959 B17R1.183798 C=CC(C)(C)C(=O)N(CC)c1ccccc1C 1626a_100000211084_100012027013 [0,2,0,0,0,0|0,0,2]=4 2960 B17R1.183798 C=CC(C)(C)C(=O)N(CC)c1ccccc1C 22a_100000211084_100012027013 [0,2,0,0,0,0|0,0,2]=4 2961 B17R1.183798 CCN(C(=O)C(C)(C)CC)c1ccccc1C 11a_100000211084_100000749717 [0,2,0,0,0,0|0,0,2]=4 2962 B17R1.183798 CCN(C(=O)C(C)(C)CC)c1ccccc1C 1626a_100000211084_100000749717 [0,2,0,0,0,0|0,0,2]=4 2963 B17R1.183798 CCN(C(=O)C(C)(C)CC)c1ccccc1C 22a_100000211084_100000749717 [0,2,0,0,0,0|0,0,2]=4 2964 B17R1.183798 CCN(C(=O)C(C)(C)OC)c1ccccc1C 11a_100000211084_100000753492 [0,2,0,0,0,0|1,0,1]=4 2965 B17R1.183798 CCN(C(=O)C(C)(C)OC)c1ccccc1C 1626a_100000211084_100000753492 [0,2,0,0,0,0|1,0,1]=4 2966 B17R1.183798 CCN(C(=O)C(C)(C)OC)c1ccccc1C 22a_100000211084_100000753492 [0,2,0,0,0,0|1,0,1]=4 2967 B17R1.183798 CCN(C(=O)C(C)(O)CC)c1ccccc1C 22a_100000211084_100011219770 [0,2,0,0,0,0|0,0,2]=4 2968 B17R1.183798 CCN(C(=O)C(F)(F)CC)c1ccccc1C 11a_100000211084_100000061896 [0,2,0,0,0,0|0,0,2]=4 2969 B17R1.183798 CCN(C(=O)C(F)(F)CC)c1ccccc1C 1626a_100000211084_100000061896 [0,2,0,0,0,0|0,0,2]=4 2970 B17R1.183798 CCN(C(=O)C(F)(F)CC)c1ccccc1C 22a_100000211084_100000061896 [0,2,0,0,0,0|0,0,2]=4 2971 B17R1.2465 CCN(C(=O)C=C(C)C)c1cc(ccc1C)C 11a_100000743043_100000211388 [0,2,0,0,0,0|0,0,0]=2 2972 B17R1.2465 CCN(C(=O)C=C(C)C)c1cc(ccc1C)C 1626a_100000743043_100000211388 [0,2,0,0,0,0|0,0,0]=2 2973 B17R1.2465 CCN(C(=O)C=C(C)C)c1cc(ccc1C)C 22a_100000743043_100000211388 [0,2,0,0,0,0|0,0,0]=2 2974 B17R1.2465 CCN(C(=O)C=C(C)Cl)c1cc(ccc1C)C 11a_100000743043_200042562850 [0,2,0,0,0,0|0,0,0]=2 2975 B17R1.2465 CCN(C(=O)C=C(C)Cl)c1cc(ccc1C)C 1626a_100000743043_200042562850 [0,2,0,0,0,0|0,0,0]=2 2976 B17R1.2465 CCN(C(=O)C=C(C)Cl)c1cc(ccc1C)C 22a_100000743043_200042562850 [0,2,0,0,0,0|0,0,0]=2 2977 B17R1.2465 CCN(C(=O)C=C(C)I)c1cc(ccc1C)C 11a_100000743043_100025716642 [0,2,0,0,0,0|0,0,0]=2 2978 B17R1.2465 CCN(C(=O)C=C(C)I)c1cc(ccc1C)C 1626a_100000743043_100025716642 [0,2,0,0,0,0|0,0,0]=2 2979 B17R1.2465 CCN(C(=O)C=C(Cl)Cl)c1cc(ccc1C)C 1626a_100000743043_100000137448 [0,2,0,0,0,0|1,0,0]=3 2980 B17R1.2465 CCN(C(=O)CC(=O)N)c1cc(ccc1C)C 22a_100000743043_100134613110 [0,2,0,0,0,0|1,0,1]=4 2981 B17R1.2465 CCN(C(=O)CC(C)C)c1cc(ccc1C)C 11a_100000743043_100000210554 [0,2,0,0,0,0|0,0,2]=4 2982 B17R1.2465 CCN(C(=O)CC(C)C)c1cc(ccc1C)C 1626a_100000743043_100000210554 [0,2,0,0,0,0|0,0,2]=4 2983 B17R1.2465 CCN(C(=O)CC(C)C)c1cc(ccc1C)C 22a_100000743043_100000210554 [0,2,0,0,0,0|0,0,2]=4 2984 B17R1.2465 CCN(C(=O)CN(C)C)c1cc(ccc1C)C 11a_100000743043_100000750896 [0,2,0,0,0,0|1,0,1]=4 2985 B17R1.2465 CCN(C(=O)CN(C)C)c1cc(ccc1C)C 22a_100000743043_100000750896 [0,2,0,0,0,0|1,0,1]=4 2986 B17R1.2465 CCN(C(=O)C[C@@H](C)O)c1cc(ccc1C)C 22a_100000743043_100011933948 [0,2,0,0,0,0|0,0,2]=4 2987 B17R1.2465 CCN(C(=O)C[S+](C)C)c1cc(ccc1C)C 11a_100000743043_200159257847 [0,2,0,0,0,0|1,0,1]=4 2988 B17R1.2465 CCN(C(=O)C[S+](C)C)c1cc(ccc1C)C 1626a_100000743043_200159257847 [0,2,0,0,0,0|1,0,1]=4 2989 B17R1.2465 CCN(C(=O)C[S+](C)C)c1cc(ccc1C)C 22a_100000743043_200159257847 [0,2,0,0,0,0|1,0,1]=4 2990 B17R1.2465 CCN(C(=O)NC(C)C)c1cc(ccc1C)C 512a_100000743043_100138425928 [0,2,0,0,0,0|1,0,1]=4 2991 B17R1.2465 CCN(C(=O)NC(C)C)c1cc(ccc1C)C 512a_100138425928_100000743043 [0,2,0,0,0,0|1,0,1]=4 2992 B17R1.2465 CCN(C(=O)NC(C)C)c1cc(ccc1C)O 512a_100000211784_100138425928 [0,2,0,0,0,0|1,0,1]=4 2993 B17R1.3125 CCN(C(=O)CC(C)(C)C)c1ccccc1C 11a_100000211084_100000211214 [0,2,0,0,0,0|0,0,2]=4 2994 B17R1.3125 CCN(C(=O)CC(C)(C)C)c1ccccc1C 1626a_100000211084_100000211214 [0,2,0,0,0,0|0,0,2]=4 2995 B17R1.3125 CCN(C(=O)CC(C)(C)C)c1ccccc1C 22a_100000211084_100000211214 [0,2,0,0,0,0|0,0,2]=4 2996 B17R1.3125 CCN(C(=O)CC(C)(C)O)c1ccccc1C 22a_100000211084_100000693243 [0,2,0,0,0,0|0,0,2]=4 2997 B17R1.3125 CCN(C(=O)CS(=O)(=O)C)c1ccccc1C 11a_100000211084_100000744497 [0,2,0,0,0,0|1,0,1]=4 2998 B17R1.3125 CCN(C(=O)CS(=O)(=O)C)c1ccccc1C 22a_100000211084_100000744497 [0,2,0,0,0,0|1,0,1]=4 2999 B17R1.3125 CCN(C(=O)C[N+](C)(C)C)c1ccccc1C 11a_100000211084_100000033712 [0,2,0,0,0,0|1,0,1]=4 3000 B17R1.3125 CCN(C(=O)C[N+](C)(C)C)c1ccccc1C 1626a_100000211084_100000033712 [0,2,0,0,0,0|1,0,1]=4 3001 B17R1.3125 CCN(C(=O)C[N+](C)(C)C)c1ccccc1C 22a_100000211084_100000033712 [0,2,0,0,0,0|1,0,1]=4 3002 B17R1.3125 CCN(C(=O)C[Si](C)(C)C)c1ccccc1C 11a_100000211084_100011218504 [0,2,0,0,0,0|0,1,1]=4 3003 B17R1.3125 CCN(C(=O)C[Si](C)(C)C)c1ccccc1C 1626a_100000211084_100011218504 [0,2,0,0,0,0|0,1,1]=4 3004 B17R1.3125 CCN(C(=O)NC(C)(C)C)c1ccccc1C 512a_100000715429_100000211084 [0,2,0,0,0,0|1,0,1]=4 3005 B17R1.13890 C=C(C)CC(=O)C(c1ccccc1C)C(C)C 1458a_200011667393_100000748629 [0,2,0,0,0,0|1,0,1]=4 3006 B17R1.13890 CC(=CC(=O)N(c1ccccc1Br)C(C)C)C 1626a_100000219599_100000211388 [0,2,0,0,0,0|1,0,0]=3 3007 B17R1.13890 CC(=CC(=O)N(c1ccccc1Br)C(C)C)Cl 1626a_100000219599_200042562850 [0,2,0,0,0,0|1,0,0]=3 3008 B17R1.13890 CC(=CC(=O)N(c1ccccc1Br)C(C)C)I 1626a_100000219599_100025716642 [0,2,0,0,0,0|1,0,0]=3 3009 B17R1.13890 CC(=CC(=O)N(c1ccccc1C)C(C)C)C 11a_100000219700_100000211388 [0,2,0,0,0,0|0,0,0]=2 3010 B17R1.13890 CC(=CC(=O)N(c1ccccc1C)C(C)C)C 1626a_100000219700_100000211388 [0,2,0,0,0,0|0,0,0]=2 3011 B17R1.13890 CC(=CC(=O)N(c1ccccc1C)C(C)C)Cl 11a_100000219700_200042562850 [0,2,0,0,0,0|0,0,0]=2 3012 B17R1.13890 CC(=CC(=O)N(c1ccccc1C)C(C)C)Cl 1626a_100000219700_200042562850 [0,2,0,0,0,0|0,0,0]=2 3013 B17R1.13890 CC(=CC(=O)N(c1ccccc1C)C(C)C)I 11a_100000219700_100025716642 [0,2,0,0,0,0|0,0,0]=2 3014 B17R1.13890 CC(=CC(=O)N(c1ccccc1C)C(C)C)I 1626a_100000219700_100025716642 [0,2,0,0,0,0|0,0,0]=2 3015 B17R1.13890 CC(=CC(=O)N(c1ccccc1Cl)C(C)C)C 1626a_100000219376_100000211388 [0,2,0,0,0,0|1,0,0]=3 3016 B17R1.13890 CC(=CC(=O)N(c1ccccc1Cl)C(C)C)Cl 1626a_100000219376_200042562850 [0,2,0,0,0,0|1,0,0]=3 3017 B17R1.13890 CC(=CC(=O)N(c1ccccc1Cl)C(C)C)I 1626a_100000219376_100025716642 [0,2,0,0,0,0|1,0,0]=3 3018 B17R1.13890 CC(=CC(=O)N(c1ccccc1F)C(C)C)C 11a_100000220358_100000211388 [0,2,0,0,0,0|1,0,0]=3 3019 B17R1.13890 CC(=CC(=O)N(c1ccccc1F)C(C)C)C 1626a_100000220358_100000211388 [0,2,0,0,0,0|1,0,0]=3 3020 B17R1.13890 CC(=CC(=O)N(c1ccccc1F)C(C)C)Cl 11a_100000220358_200042562850 [0,2,0,0,0,0|1,0,0]=3 3021 B17R1.13890 CC(=CC(=O)N(c1ccccc1F)C(C)C)Cl 1626a_100000220358_200042562850 [0,2,0,0,0,0|1,0,0]=3 3022 B17R1.13890 CC(=CC(=O)N(c1ccccc1F)C(C)C)I 11a_100000220358_100025716642 [0,2,0,0,0,0|1,0,0]=3 3023 B17R1.13890 CC(=CC(=O)N(c1ccccc1F)C(C)C)I 1626a_100000220358_100025716642 [0,2,0,0,0,0|1,0,0]=3 3024 B17R1.13890 CC(C)N(C(=O)C=C(Cl)Cl)c1ccccc1Br 1626a_100000219599_100000137448 [0,2,0,0,0,0|2,0,0]=4 3025 B17R1.13890 CC(C)N(C(=O)C=C(Cl)Cl)c1ccccc1Cl 1626a_100000219376_100000137448 [0,2,0,0,0,0|2,0,0]=4 3026 B17R1.13890 CC(C)N(C(=O)C=C(Cl)Cl)c1ccccc1F 1626a_100000220358_100000137448 [0,2,0,0,0,0|2,0,0]=4 3027 B17R1.13890 Cc1ccccc1N(C(=O)C=C(Cl)Cl)C(C)C 1626a_100000219700_100000137448 [0,2,0,0,0,0|1,0,0]=3 3028 B17R1.13890 Cc1ccccc1N(C(=O)CC(C)C)C(C)C 11a_100000219700_100000210554 [0,2,0,0,0,0|0,0,2]=4 3029 B17R1.13890 Cc1ccccc1N(C(=O)CC(C)C)C(C)C 1626a_100000219700_100000210554 [0,2,0,0,0,0|0,0,2]=4 3030 B17R1.13890 Cc1ccccc1N(C(=O)CN(C)C)C(C)C 11a_100000219700_100000750896 [0,2,0,0,0,0|1,0,1]=4 3031 B17R1.13890 Cc1ccccc1N(C(=O)C[S+](C)C)C(C)C 11a_100000219700_200159257847 [0,2,0,0,0,0|1,0,1]=4 3032 B17R1.13890 Cc1ccccc1N(C(=O)C[S+](C)C)C(C)C 1626a_100000219700_200159257847 [0,2,0,0,0,0|1,0,1]=4 3033 B17R1.13890 Cc1ccccc1N(C(=O)NC(C)C)C(C)C 512a_100000219700_100138425928 [0,2,0,0,0,0|1,0,1]=4 3034 B17R1.19246 CCCN(C(=O)C=C(C)C)c1ccccc1F 11a_100011231789_100000211388 [0,2,0,0,0,0|1,0,0]=3 3035 B17R1.19246 CCCN(C(=O)C=C(C)C)c1ccccc1F 1626a_100011231789_100000211388 [0,2,0,0,0,0|1,0,0]=3 3036 B17R1.19246 CCCN(C(=O)C=C(C)Cl)c1ccccc1F 11a_100011231789_200042562850 [0,2,0,0,0,0|1,0,0]=3 3037 B17R1.19246 CCCN(C(=O)C=C(C)Cl)c1ccccc1F 1626a_100011231789_200042562850 [0,2,0,0,0,0|1,0,0]=3 3038 B17R1.19246 CCCN(C(=O)C=C(C)I)c1ccccc1F 11a_100011231789_100025716642 [0,2,0,0,0,0|1,0,0]=3 3039 B17R1.19246 CCCN(C(=O)C=C(C)I)c1ccccc1F 1626a_100011231789_100025716642 [0,2,0,0,0,0|1,0,0]=3 3040 B17R1.19246 CCCN(C(=O)C=C(Cl)Cl)c1ccccc1F 1626a_100011231789_100000137448 [0,2,0,0,0,0|2,0,0]=4 3041 B17R1.19246 Cc1ccccc1N(CCO)C(=O)NC(C)C 512a_100138425928_100011233185 [0,2,0,0,0,0|1,0,1]=4 3042 B17R1.20773 C#CC(=O)CC(=O)N(CC)c1ccccc1C 1458a_100000211873_100000239579 [0,2,0,0,0,0|0,0,2]=4 3043 B17R1.20773 C#CC(C)NC(=O)N(CC)c1ccccc1C 512a_100000211084_100000707721 [0,2,0,0,0,0|1,0,1]=4 3044 B17R1.20773 C#CC(C)NC(=O)N(CC)c1ccccc1C 512a_100000707721_100000211084 [0,2,0,0,0,0|1,0,1]=4 3045 B17R1.20773 C=CC(=O)CC(=O)N(CC)c1ccccc1C 1458a_100000185746_100000239579 [0,2,0,0,0,0|0,0,1]=3 3046 B17R1.20773 C=CC(C)CC(=O)N(CC)c1ccccc1C 11a_100000211084_100011934298 [0,2,0,0,0,0|0,0,2]=4 3047 B17R1.20773 C=CC(C)CC(=O)N(CC)c1ccccc1C 1626a_100000211084_100011934298 [0,2,0,0,0,0|0,0,2]=4 3048 B17R1.20773 C=CC(C)CC(=O)N(CC)c1ccccc1C 22a_100000211084_100011934298 [0,2,0,0,0,0|0,0,2]=4 3049 B17R1.20773 CCC(=CC(=O)N(CC)c1ccccc1Br)C 11a_114873767003_100020758463 [0,2,0,0,0,0|1,0,0]=3 3050 B17R1.20773 CCC(=CC(=O)N(CC)c1ccccc1Br)C 1626a_114873767003_100020758463 [0,2,0,0,0,0|1,0,0]=3 3051 B17R1.20773 CCC(=CC(=O)N(CC)c1ccccc1C)C 11a_100000211084_100020758463 [0,2,0,0,0,0|0,0,0]=2 3052 B17R1.20773 CCC(=CC(=O)N(CC)c1ccccc1C)C 1626a_100000211084_100020758463 [0,2,0,0,0,0|0,0,0]=2 3053 B17R1.20773 CCC(=CC(=O)N(CC)c1ccccc1C)C 22a_100000211084_100020758463 [0,2,0,0,0,0|0,0,0]=2 3054 B17R1.20773 CCC(=CC(=O)N(CC)c1ccccc1F)C 11a_100000220365_100020758463 [0,2,0,0,0,0|1,0,0]=3 3055 B17R1.20773 CCC(=CC(=O)N(CC)c1ccccc1F)C 1626a_100000220365_100020758463 [0,2,0,0,0,0|1,0,0]=3 3056 B17R1.20773 CCC(=CC(=O)N(CC)c1ccccc1O)C 22a_103624766699_100020758463 [0,2,0,0,0,0|1,0,0]=3 3057 B17R1.20773 CCC(=O)CC(=O)N(CC)c1ccccc1C 1458a_100000210414_100000239579 [0,2,0,0,0,0|0,0,1]=3 3058 B17R1.20773 CCC(C)CC(=O)N(CC)c1ccccc1C 11a_100000211084_100000708755 [0,2,0,0,0,0|0,0,2]=4 3059 B17R1.20773 CCC(C)CC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000708755 [0,2,0,0,0,0|0,0,2]=4 3060 B17R1.20773 CCC(C)CC(=O)N(CC)c1ccccc1C 22a_100000211084_100000708755 [0,2,0,0,0,0|0,0,2]=4 3061 B17R1.20773 CCC(C)NC(=O)N(CC)c1ccccc1C 512a_100000209981_100000211084 [0,2,0,0,0,0|0,0,2]=4 3062 B17R1.20773 CCC(C)NC(=O)N(CC)c1ccccc1C 512a_100000211084_100000209981 [0,2,0,0,0,0|0,0,2]=4 3063 B17R1.20773 CCC(O)CC(=O)N(CC)c1ccccc1C 1626a_100000211084_100011667805 [0,2,0,0,0,0|0,0,2]=4 3064 B17R1.20773 CCC(O)CC(=O)N(CC)c1ccccc1C 22a_100000211084_100011667805 [0,2,0,0,0,0|0,0,2]=4 3065 B17R1.20773 CCN(C(=O)CC(=O)CO)c1ccccc1C 1458a_100000210174_100000239579 [0,2,0,0,0,0|0,0,1]=3 3066 B17R1.20773 CCN(C(=O)CC(=O)OC)c1ccccc1C 22a_100000211084_100000211351 [0,2,0,0,0,0|0,0,1]=3 3067 B17R1.20773 CCN(C(=O)CC(=O)OC)c1ccccc1O 22a_103624766699_100000211351 [0,2,0,0,0,0|1,0,1]=4 3068 B17R1.20773 CCN(C(=O)NC(C)C#N)c1ccccc1C 512a_100000211084_100000737613 [0,2,0,0,0,0|1,0,1]=4 3069 B17R1.20773 CCN(C(=O)NC(C)C#N)c1ccccc1C 512a_100000737613_100000211084 [0,2,0,0,0,0|1,0,1]=4 3070 B17R1.20773 CCN(C(=O)N[C@H](C)CF)c1ccccc1C 512a_100000211084_100102880703 [0,2,0,0,0,0|1,0,1]=4 3071 B17R1.20773 CCN(C(=O)N[C@H](C)CF)c1ccccc1C 512a_100102880703_100000211084 [0,2,0,0,0,0|1,0,1]=4 3072 B17R1.20773 CCN(C(=O)N[C@H](C)CO)c1ccccc1C 512a_100000211084_100000737577 [0,2,0,0,0,0|1,0,1]=4 3073 B17R1.20773 CCN(C(=O)N[C@H](C)CO)c1ccccc1C 512a_100000737577_100000211084 [0,2,0,0,0,0|1,0,1]=4 3074 B17R1.20773 CCN(C)CC(=O)N(CC)c1ccccc1C 2230a_100000225621_100000239579 [0,2,0,0,0,0|0,0,2]=4 3075 B17R1.20773 CCN(C)CC(=O)N(CC)c1ccccc1C 22a_100000211084_100116209913 [0,2,0,0,0,0|0,0,2]=4 3076 B17R1.20773 CCN(C)CC(=O)N(CC)c1ccccc1C 269982a_100000225621_100000239579 [0,2,0,0,0,0|0,0,2]=4 3077 B17R1.27046 CCN(C(=O)C=C(C)C)c1ccccc1C#N 1626a_200000218880_100000211388 [0,2,0,0,0,0|0,0,1]=3 3078 B17R1.27046 CCN(C(=O)C=C(C)C)c1ccccc1OC 11a_100020603010_100000211388 [0,2,0,0,0,0|0,0,0]=2 3079 B17R1.27046 CCN(C(=O)C=C(C)C)c1ccccc1OC 1626a_100020603010_100000211388 [0,2,0,0,0,0|0,0,0]=2 3080 B17R1.27046 CCN(C(=O)C=C(C)C)c1ccccc1OC 22a_100020603010_100000211388 [0,2,0,0,0,0|0,0,0]=2 3081 B17R1.27046 CCN(C(=O)C=C(C)Cl)c1ccccc1C#N 1626a_200000218880_200042562850 [0,2,0,0,0,0|0,0,1]=3 3082 B17R1.27046 CCN(C(=O)C=C(C)Cl)c1ccccc1OC 11a_100020603010_200042562850 [0,2,0,0,0,0|0,0,0]=2 3083 B17R1.27046 CCN(C(=O)C=C(C)Cl)c1ccccc1OC 1626a_100020603010_200042562850 [0,2,0,0,0,0|0,0,0]=2 3084 B17R1.27046 CCN(C(=O)C=C(C)Cl)c1ccccc1OC 22a_100020603010_200042562850 [0,2,0,0,0,0|0,0,0]=2 3085 B17R1.27046 CCN(C(=O)C=C(C)I)c1ccccc1C#N 1626a_200000218880_100025716642 [0,2,0,0,0,0|0,0,1]=3 3086 B17R1.27046 CCN(C(=O)C=C(C)I)c1ccccc1OC 11a_100020603010_100025716642 [0,2,0,0,0,0|0,0,0]=2 3087 B17R1.27046 CCN(C(=O)C=C(C)I)c1ccccc1OC 1626a_100020603010_100025716642 [0,2,0,0,0,0|0,0,0]=2 3088 B17R1.27046 CCN(C(=O)C=C(Cl)Cl)c1ccccc1C#N 1626a_200000218880_100000137448 [0,2,0,0,0,0|1,0,1]=4 3089 B17R1.27046 CCN(C(=O)C=C(Cl)Cl)c1ccccc1OC 1626a_100020603010_100000137448 [0,2,0,0,0,0|1,0,0]=3 3090 B17R1.27046 CCN(C(=O)CC(=O)N)c1ccccc1OC 22a_100020603010_100134613110 [0,2,0,0,0,0|1,0,1]=4 3091 B17R1.27046 CCN(C(=O)CC(C)C)c1ccccc1OC 11a_100020603010_100000210554 [0,2,0,0,0,0|0,0,2]=4 3092 B17R1.27046 CCN(C(=O)CC(C)C)c1ccccc1OC 1626a_100020603010_100000210554 [0,2,0,0,0,0|0,0,2]=4 3093 B17R1.27046 CCN(C(=O)CC(C)C)c1ccccc1OC 22a_100020603010_100000210554 [0,2,0,0,0,0|0,0,2]=4 3094 B17R1.27046 CCN(C(=O)CN(C)C)c1ccccc1OC 11a_100020603010_100000750896 [0,2,0,0,0,0|1,0,1]=4 3095 B17R1.27046 CCN(C(=O)CN(C)C)c1ccccc1OC 22a_100020603010_100000750896 [0,2,0,0,0,0|1,0,1]=4 3096 B17R1.27046 CCN(C(=O)C[C@@H](C)O)c1ccccc1OC 22a_100020603010_100011933948 [0,2,0,0,0,0|0,0,2]=4 3097 B17R1.27046 CCN(C(=O)C[S+](C)C)c1ccccc1OC 11a_100020603010_200159257847 [0,2,0,0,0,0|1,0,1]=4 3098 B17R1.27046 CCN(C(=O)C[S+](C)C)c1ccccc1OC 1626a_100020603010_200159257847 [0,2,0,0,0,0|1,0,1]=4 3099 B17R1.27046 CCN(C(=O)C[S+](C)C)c1ccccc1OC 22a_100020603010_200159257847 [0,2,0,0,0,0|1,0,1]=4 3100 B17R1.183141 CCN(C(=O)C=C(C)C)c1ccc(cc1C)F 11a_100000221679_100000211388 [0,2,0,0,0,0|0,0,0]=2 3101 B17R1.183141 CCN(C(=O)C=C(C)C)c1ccc(cc1C)F 1626a_100000221679_100000211388 [0,2,0,0,0,0|0,0,0]=2 3102 B17R1.183141 CCN(C(=O)C=C(C)C)c1ccc(cc1C)F 22a_100000221679_100000211388 [0,2,0,0,0,0|0,0,0]=2 3103 B17R1.183141 CCN(C(=O)C=C(C)C)c1ccc(cc1Cl)Cl 11a_100160557746_100000211388 [0,2,0,0,0,0|1,0,0]=3 3104 B17R1.183141 CCN(C(=O)C=C(C)C)c1ccc(cc1Cl)Cl 1626a_100160557746_100000211388 [0,2,0,0,0,0|1,0,0]=3 3105 B17R1.183141 CCN(C(=O)C=C(C)Cl)c1ccc(cc1C)F 11a_100000221679_200042562850 [0,2,0,0,0,0|0,0,0]=2 3106 B17R1.183141 CCN(C(=O)C=C(C)Cl)c1ccc(cc1C)F 1626a_100000221679_200042562850 [0,2,0,0,0,0|0,0,0]=2 3107 B17R1.183141 CCN(C(=O)C=C(C)Cl)c1ccc(cc1C)F 22a_100000221679_200042562850 [0,2,0,0,0,0|0,0,0]=2 3108 B17R1.183141 CCN(C(=O)C=C(C)Cl)c1ccc(cc1Cl)Cl 11a_100160557746_200042562850 [0,2,0,0,0,0|1,0,0]=3 3109 B17R1.183141 CCN(C(=O)C=C(C)Cl)c1ccc(cc1Cl)Cl 1626a_100160557746_200042562850 [0,2,0,0,0,0|1,0,0]=3 3110 B17R1.183141 CCN(C(=O)C=C(C)I)c1ccc(cc1C)F 11a_100000221679_100025716642 [0,2,0,0,0,0|0,0,0]=2 3111 B17R1.183141 CCN(C(=O)C=C(C)I)c1ccc(cc1C)F 1626a_100000221679_100025716642 [0,2,0,0,0,0|0,0,0]=2 3112 B17R1.183141 CCN(C(=O)C=C(C)I)c1ccc(cc1Cl)Cl 11a_100160557746_100025716642 [0,2,0,0,0,0|1,0,0]=3 3113 B17R1.183141 CCN(C(=O)C=C(C)I)c1ccc(cc1Cl)Cl 1626a_100160557746_100025716642 [0,2,0,0,0,0|1,0,0]=3 3114 B17R1.183141 CCN(C(=O)C=C(Cl)Cl)c1ccc(cc1C)F 1626a_100000221679_100000137448 [0,2,0,0,0,0|1,0,0]=3 3115 B17R1.183141 CCN(C(=O)C=C(Cl)Cl)c1ccc(cc1Cl)Cl 1626a_100160557746_100000137448 [0,2,0,0,0,0|2,0,0]=4 3116 B17R1.183141 CCN(C(=O)CC(=O)N)c1ccc(cc1C)F 22a_100000221679_100134613110 [0,2,0,0,0,0|1,0,1]=4 3117 B17R1.183141 CCN(C(=O)CC(C)C)c1ccc(cc1C)F 11a_100000221679_100000210554 [0,2,0,0,0,0|0,0,2]=4 3118 B17R1.183141 CCN(C(=O)CC(C)C)c1ccc(cc1C)F 1626a_100000221679_100000210554 [0,2,0,0,0,0|0,0,2]=4 3119 B17R1.183141 CCN(C(=O)CC(C)C)c1ccc(cc1C)F 22a_100000221679_100000210554 [0,2,0,0,0,0|0,0,2]=4 3120 B17R1.183141 CCN(C(=O)CN(C)C)c1ccc(cc1C)F 11a_100000221679_100000750896 [0,2,0,0,0,0|1,0,1]=4 3121 B17R1.183141 CCN(C(=O)CN(C)C)c1ccc(cc1C)F 22a_100000221679_100000750896 [0,2,0,0,0,0|1,0,1]=4 3122 B17R1.183141 CCN(C(=O)C[C@@H](C)O)c1ccc(cc1C)F 22a_100000221679_100011933948 [0,2,0,0,0,0|0,0,2]=4 3123 B17R1.183141 CCN(C(=O)C[S+](C)C)c1ccc(cc1C)F 11a_100000221679_200159257847 [0,2,0,0,0,0|1,0,1]=4 3124 B17R1.183141 CCN(C(=O)C[S+](C)C)c1ccc(cc1C)F 1626a_100000221679_200159257847 [0,2,0,0,0,0|1,0,1]=4 3125 B17R1.183141 CCN(C(=O)C[S+](C)C)c1ccc(cc1C)F 22a_100000221679_200159257847 [0,2,0,0,0,0|1,0,1]=4 3126 B17R1.183141 CCN(C(=O)NC(C)C)c1ccc(cc1C)F 512a_100000221679_100138425928 [0,2,0,0,0,0|1,0,1]=4 3127 B17R1.183141 CCN(C(=O)NC(C)C)c1ccc(cc1C)F 512a_100138425928_100000221679 [0,2,0,0,0,0|1,0,1]=4 3128 B17R1.9784 C/C=C/CC(=O)C(c1ccccc1C)C(C)C 1458a_200011667393_100102629194 [0,2,0,0,0,0|1,0,0]=3 3129 B17R1.9784 C/C=C/CC(=O)C(c1ccccc1C)N(C)C 1458a_200015186453_100102629194 [0,2,0,0,0,0|2,0,0]=4 3130 B17R1.9784 C=CC=CC(=O)N(c1ccccc1Br)C(C)C 1626a_100000219599_100016291481 [0,2,0,0,0,0|1,0,1]=4 3131 B17R1.9784 C=CC=CC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100016291481 [0,2,0,0,0,0|0,0,1]=3 3132 B17R1.9784 C=CC=CC(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100016291481 [0,2,0,0,0,0|1,0,1]=4 3133 B17R1.9784 C=CC=CC(=O)N(c1ccccc1F)C(C)C 1626a_100000220358_100016291481 [0,2,0,0,0,0|1,0,1]=4 3134 B17R1.9784 C=CCCC(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000749702 [0,2,0,0,0,0|0,0,2]=4 3135 B17R1.9784 C=CCCC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000749702 [0,2,0,0,0,0|0,0,2]=4 3136 B17R1.9784 C=CCNC(=O)N(c1ccccc1C)C(C)C 512a_100000219700_100020586998 [0,2,0,0,0,0|0,0,2]=4 3137 B17R1.9784 CC=CCC(=O)C(c1ccccc1C)C(C)C 1458a_200011667393_100000070051 [0,2,0,0,0,0|1,0,0]=3 3138 B17R1.9784 CC=CCC(=O)C(c1ccccc1C)N(C)C 1458a_200015186453_100000070051 [0,2,0,0,0,0|2,0,0]=4 3139 B17R1.9784 CC=CCC(=O)N(c1ccccc1Br)C(C)C 1626a_100000219599_100121576822 [0,2,0,0,0,0|1,0,0]=3 3140 B17R1.9784 CC=CCC(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100121576822 [0,2,0,0,0,0|0,0,0]=2 3141 B17R1.9784 CC=CCC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100121576822 [0,2,0,0,0,0|0,0,0]=2 3142 B17R1.9784 CC=CCC(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100121576822 [0,2,0,0,0,0|1,0,0]=3 3143 B17R1.9784 CC=CCC(=O)N(c1ccccc1F)C(C)C 11a_100000220358_100121576822 [0,2,0,0,0,0|1,0,0]=3 3144 B17R1.9784 CC=CCC(=O)N(c1ccccc1F)C(C)C 1626a_100000220358_100121576822 [0,2,0,0,0,0|1,0,0]=3 3145 B17R1.9784 CCC=CC(=O)N(c1ccccc1Br)C(C)C 1626a_100000219599_100000212282 [0,2,0,0,0,0|1,0,0]=3 3146 B17R1.9784 CCC=CC(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000212282 [0,2,0,0,0,0|0,0,0]=2 3147 B17R1.9784 CCC=CC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000212282 [0,2,0,0,0,0|0,0,0]=2 3148 B17R1.9784 CCC=CC(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100000212282 [0,2,0,0,0,0|1,0,0]=3 3149 B17R1.9784 CCC=CC(=O)N(c1ccccc1F)C(C)C 11a_100000220358_100000212282 [0,2,0,0,0,0|1,0,0]=3 3150 B17R1.9784 CCC=CC(=O)N(c1ccccc1F)C(C)C 1626a_100000220358_100000212282 [0,2,0,0,0,0|1,0,0]=3 3151 B17R1.9784 CCCCC(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000210183 [0,2,0,0,0,0|0,0,2]=4 3152 B17R1.9784 CCCCC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000210183 [0,2,0,0,0,0|0,0,2]=4 3153 B17R1.9784 CCCNC(=O)N(c1ccccc1C)C(C)C 512a_100000219700_100020643023 [0,2,0,0,0,0|0,0,2]=4 3154 B17R1.9784 CCNNC(=O)N(c1ccccc1C)C(C)C 512a_100000219700_100000756455 [0,2,0,0,0,0|1,0,1]=4 3155 B17R1.9784 CCOCC(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000211967 [0,2,0,0,0,0|0,0,2]=4 3156 B17R1.9784 CCOCC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000211967 [0,2,0,0,0,0|0,0,2]=4 3157 B17R1.9784 CCSCC(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000230394 [0,2,0,0,0,0|0,0,2]=4 3158 B17R1.9784 CCSCC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000230394 [0,2,0,0,0,0|0,0,2]=4 3159 B17R1.9784 COC=CC(=O)N(c1ccccc1Br)C(C)C 1626a_100000219599_100016268678 [0,2,0,0,0,0|1,0,0]=3 3160 B17R1.9784 COC=CC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100016268678 [0,2,0,0,0,0|0,0,0]=2 3161 B17R1.9784 COC=CC(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100016268678 [0,2,0,0,0,0|1,0,0]=3 3162 B17R1.9784 COC=CC(=O)N(c1ccccc1F)C(C)C 1626a_100000220358_100016268678 [0,2,0,0,0,0|1,0,0]=3 3163 B17R1.9784 COCCC(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000749529 [0,2,0,0,0,0|0,0,2]=4 3164 B17R1.9784 COCCC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000749529 [0,2,0,0,0,0|0,0,2]=4 3165 B17R1.9784 CSCCC(=O)N(c1ccccc1C)C(C)C 11a_100000219700_100000174002 [0,2,0,0,0,0|0,0,2]=4 3166 B17R1.9784 CSCCC(=O)N(c1ccccc1C)C(C)C 1626a_100000219700_100000174002 [0,2,0,0,0,0|0,0,2]=4 3167 B17R1.9784 Cc1ccccc1N(C(=O)NCCF)C(C)C 512a_100000219700_100000724931 [0,2,0,0,0,0|1,0,1]=4 3168 B17R1.9784 Cc1ccccc1N(C(=O)NCCO)C(C)C 512a_100000219700_100000210304 [0,2,0,0,0,0|1,0,1]=4 3169 B17R1.19204 C=CCC(=O)N(c1cc(ccc1C)Br)C(C)C 11a_200000714908_100000210193 [0,2,0,0,0,0|0,0,2]=4 3170 B17R1.19204 C=CCC(=O)N(c1cc(ccc1C)Br)C(C)C 1626a_200000714908_100000210193 [0,2,0,0,0,0|0,0,2]=4 3171 B17R1.19204 C=CCC(=O)N(c1cc(ccc1C)C)C(C)C 11a_100000219444_100000210193 [0,2,0,0,0,0|0,0,2]=4 3172 B17R1.19204 C=CCC(=O)N(c1cc(ccc1C)C)C(C)C 1626a_100000219444_100000210193 [0,2,0,0,0,0|0,0,2]=4 3173 B17R1.19204 C=CCC(=O)N(c1cc(ccc1C)Cl)C(C)C 11a_100000221441_100000210193 [0,2,0,0,0,0|0,0,2]=4 3174 B17R1.19204 C=CCC(=O)N(c1cc(ccc1C)Cl)C(C)C 1626a_100000221441_100000210193 [0,2,0,0,0,0|0,0,2]=4 3175 B17R1.19204 CC(C)N(C(=O)C=CBr)c1cc(ccc1Cl)Br 1626a_100000710355_100016273825 [0,2,0,0,0,0|2,0,0]=4 3176 B17R1.19204 CC(C)N(C(=O)C=CCl)c1cc(ccc1Cl)Br 11a_100000710355_200016279998 [0,2,0,0,0,0|2,0,0]=4 3177 B17R1.19204 CC(C)N(C(=O)C=CCl)c1cc(ccc1Cl)Br 1626a_100000710355_200016279998 [0,2,0,0,0,0|2,0,0]=4 3178 B17R1.19204 CC(C)N(C(=O)C=CI)c1cc(ccc1Cl)Br 1626a_100000710355_100016256311 [0,2,0,0,0,0|2,0,0]=4 3179 B17R1.19204 CC=CC(=O)N(c1cc(ccc1C)Br)C(C)C 11a_200000714908_100000210699 [0,2,0,0,0,0|0,0,0]=2 3180 B17R1.19204 CC=CC(=O)N(c1cc(ccc1C)Br)C(C)C 1626a_200000714908_100000210699 [0,2,0,0,0,0|0,0,0]=2 3181 B17R1.19204 CC=CC(=O)N(c1cc(ccc1C)C)C(C)C 11a_100000219444_100000210699 [0,2,0,0,0,0|0,0,0]=2 3182 B17R1.19204 CC=CC(=O)N(c1cc(ccc1C)C)C(C)C 1626a_100000219444_100000210699 [0,2,0,0,0,0|0,0,0]=2 3183 B17R1.19204 CC=CC(=O)N(c1cc(ccc1C)Cl)C(C)C 11a_100000221441_100000210699 [0,2,0,0,0,0|0,0,0]=2 3184 B17R1.19204 CC=CC(=O)N(c1cc(ccc1C)Cl)C(C)C 1626a_100000221441_100000210699 [0,2,0,0,0,0|0,0,0]=2 3185 B17R1.19204 CC=CC(=O)N(c1cc(ccc1Cl)Br)C(C)C 11a_100000710355_100000210699 [0,2,0,0,0,0|1,0,0]=3 3186 B17R1.19204 CC=CC(=O)N(c1cc(ccc1Cl)Br)C(C)C 1626a_100000710355_100000210699 [0,2,0,0,0,0|1,0,0]=3 3187 B17R1.19204 CCCC(=O)N(c1cc(ccc1C)Br)C(C)C 11a_200000714908_100000211992 [0,2,0,0,0,0|0,0,2]=4 3188 B17R1.19204 CCCC(=O)N(c1cc(ccc1C)Br)C(C)C 1626a_200000714908_100000211992 [0,2,0,0,0,0|0,0,2]=4 3189 B17R1.19204 CCCC(=O)N(c1cc(ccc1C)C)C(C)C 11a_100000219444_100000211992 [0,2,0,0,0,0|0,0,2]=4 3190 B17R1.19204 CCCC(=O)N(c1cc(ccc1C)C)C(C)C 1626a_100000219444_100000211992 [0,2,0,0,0,0|0,0,2]=4 3191 B17R1.19204 CCCC(=O)N(c1cc(ccc1C)Cl)C(C)C 11a_100000221441_100000211992 [0,2,0,0,0,0|0,0,2]=4 3192 B17R1.19204 CCCC(=O)N(c1cc(ccc1C)Cl)C(C)C 1626a_100000221441_100000211992 [0,2,0,0,0,0|0,0,2]=4 3193 B17R1.19204 CCNC(=O)N(c1cc(ccc1C)Br)C(C)C 512a_200000714908_100015525214 [0,2,0,0,0,0|1,0,1]=4 3194 B17R1.19204 CCNC(=O)N(c1cc(ccc1C)C)C(C)C 512a_100000219444_100015525214 [0,2,0,0,0,0|1,0,1]=4 3195 B17R1.19204 CCNC(=O)N(c1cc(ccc1C)Cl)C(C)C 512a_100000221441_100015525214 [0,2,0,0,0,0|1,0,1]=4 3196 B17R1.19204 CNNC(=O)N(c1cc(ccc1C)Br)C(C)C 512a_200000714908_100016993582 [0,2,0,0,0,0|2,0,0]=4 3197 B17R1.19204 CNNC(=O)N(c1cc(ccc1C)C)C(C)C 512a_100000219444_100016993582 [0,2,0,0,0,0|2,0,0]=4 3198 B17R1.19204 CNNC(=O)N(c1cc(ccc1C)Cl)C(C)C 512a_100000221441_100016993582 [0,2,0,0,0,0|2,0,0]=4 3199 B17R1.19204 COCC(=O)N(c1cc(ccc1C)Br)C(C)C 11a_200000714908_100000210968 [0,2,0,0,0,0|1,0,1]=4 3200 B17R1.19204 COCC(=O)N(c1cc(ccc1C)Br)C(C)C 1626a_200000714908_100000210968 [0,2,0,0,0,0|1,0,1]=4 3201 B17R1.19204 COCC(=O)N(c1cc(ccc1C)C)C(C)C 11a_100000219444_100000210968 [0,2,0,0,0,0|1,0,1]=4 3202 B17R1.19204 COCC(=O)N(c1cc(ccc1C)C)C(C)C 1626a_100000219444_100000210968 [0,2,0,0,0,0|1,0,1]=4 3203 B17R1.19204 COCC(=O)N(c1cc(ccc1C)Cl)C(C)C 11a_100000221441_100000210968 [0,2,0,0,0,0|1,0,1]=4 3204 B17R1.19204 COCC(=O)N(c1cc(ccc1C)Cl)C(C)C 1626a_100000221441_100000210968 [0,2,0,0,0,0|1,0,1]=4 3205 B17R1.19204 CSCC(=O)N(c1cc(ccc1C)Br)C(C)C 11a_200000714908_100000184570 [0,2,0,0,0,0|1,0,1]=4 3206 B17R1.19204 CSCC(=O)N(c1cc(ccc1C)Br)C(C)C 1626a_200000714908_100000184570 [0,2,0,0,0,0|1,0,1]=4 3207 B17R1.19204 CSCC(=O)N(c1cc(ccc1C)C)C(C)C 11a_100000219444_100000184570 [0,2,0,0,0,0|1,0,1]=4 3208 B17R1.19204 CSCC(=O)N(c1cc(ccc1C)C)C(C)C 1626a_100000219444_100000184570 [0,2,0,0,0,0|1,0,1]=4 3209 B17R1.19204 CSCC(=O)N(c1cc(ccc1C)Cl)C(C)C 11a_100000221441_100000184570 [0,2,0,0,0,0|1,0,1]=4 3210 B17R1.19204 CSCC(=O)N(c1cc(ccc1C)Cl)C(C)C 1626a_100000221441_100000184570 [0,2,0,0,0,0|1,0,1]=4 3211 B17R1.19204 Cc1ccc(c(c1)N(C(=O)C=CBr)C(C)C)C 1626a_100000219444_100016273825 [0,2,0,0,0,0|1,0,0]=3 3212 B17R1.19204 Cc1ccc(c(c1)N(C(=O)C=CCl)C(C)C)C 11a_100000219444_200016279998 [0,2,0,0,0,0|1,0,0]=3 3213 B17R1.19204 Cc1ccc(c(c1)N(C(=O)C=CCl)C(C)C)C 1626a_100000219444_200016279998 [0,2,0,0,0,0|1,0,0]=3 3214 B17R1.19204 Cc1ccc(c(c1)N(C(=O)C=CI)C(C)C)C 1626a_100000219444_100016256311 [0,2,0,0,0,0|1,0,0]=3 3215 B17R1.19204 Cc1ccc(cc1N(C(=O)C=CBr)C(C)C)Br 1626a_200000714908_100016273825 [0,2,0,0,0,0|1,0,0]=3 3216 B17R1.19204 Cc1ccc(cc1N(C(=O)C=CBr)C(C)C)Cl 1626a_100000221441_100016273825 [0,2,0,0,0,0|1,0,0]=3 3217 B17R1.19204 Cc1ccc(cc1N(C(=O)C=CCl)C(C)C)Br 11a_200000714908_200016279998 [0,2,0,0,0,0|1,0,0]=3 3218 B17R1.19204 Cc1ccc(cc1N(C(=O)C=CCl)C(C)C)Br 1626a_200000714908_200016279998 [0,2,0,0,0,0|1,0,0]=3 3219 B17R1.19204 Cc1ccc(cc1N(C(=O)C=CCl)C(C)C)Cl 11a_100000221441_200016279998 [0,2,0,0,0,0|1,0,0]=3 3220 B17R1.19204 Cc1ccc(cc1N(C(=O)C=CCl)C(C)C)Cl 1626a_100000221441_200016279998 [0,2,0,0,0,0|1,0,0]=3 3221 B17R1.19204 Cc1ccc(cc1N(C(=O)C=CI)C(C)C)Br 1626a_200000714908_100016256311 [0,2,0,0,0,0|1,0,0]=3 3222 B17R1.19204 Cc1ccc(cc1N(C(=O)C=CI)C(C)C)Cl 1626a_100000221441_100016256311 [0,2,0,0,0,0|1,0,0]=3 3223 B17R1.119082 CC(C)N(C(=O)C=CBr)c1ccc(cc1Cl)F 1626a_100000220947_100016273825 [0,2,0,0,0,0|2,0,0]=4 3224 B17R1.119082 CC(C)N(C(=O)C=CCl)c1ccc(cc1Cl)F 11a_100000220947_200016279998 [0,2,0,0,0,0|2,0,0]=4 3225 B17R1.119082 CC(C)N(C(=O)C=CCl)c1ccc(cc1Cl)F 1626a_100000220947_200016279998 [0,2,0,0,0,0|2,0,0]=4 3226 B17R1.119082 CC(C)N(C(=O)C=CI)c1ccc(cc1Cl)F 1626a_100000220947_100016256311 [0,2,0,0,0,0|2,0,0]=4 3227 B17R1.119082 CC=CC(=O)N(c1ccc(cc1Cl)F)C(C)C 11a_100000220947_100000210699 [0,2,0,0,0,0|1,0,0]=3 3228 B17R1.119082 CC=CC(=O)N(c1ccc(cc1Cl)F)C(C)C 1626a_100000220947_100000210699 [0,2,0,0,0,0|1,0,0]=3 3229 B17R1.29954 C=CC=CC(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100016291481 [0,2,0,0,0,0|0,0,1]=3 3230 B17R1.29954 C=CC=CC(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100016291481 [0,2,0,0,0,0|0,0,1]=3 3231 B17R1.29954 C=CCCC(=O)N(CC)c1cc(ccc1C)C 11a_100000743043_100000749702 [0,2,0,0,0,0|0,0,2]=4 3232 B17R1.29954 C=CCCC(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100000749702 [0,2,0,0,0,0|0,0,2]=4 3233 B17R1.29954 C=CCCC(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100000749702 [0,2,0,0,0,0|0,0,2]=4 3234 B17R1.29954 C=CCNC(=O)N(CC)c1cc(ccc1C)C 512a_100000743043_100020586998 [0,2,0,0,0,0|0,0,2]=4 3235 B17R1.29954 C=CCNC(=O)N(CC)c1cc(ccc1C)C 512a_100020586998_100000743043 [0,2,0,0,0,0|0,0,2]=4 3236 B17R1.29954 C=CCNC(=O)N(CC)c1cc(ccc1C)O 512a_100000211784_100020586998 [0,2,0,0,0,0|0,0,2]=4 3237 B17R1.29954 CC=CCC(=O)N(CC)c1cc(ccc1C)C 11a_100000743043_100121576822 [0,2,0,0,0,0|0,0,0]=2 3238 B17R1.29954 CC=CCC(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100121576822 [0,2,0,0,0,0|0,0,0]=2 3239 B17R1.29954 CC=CCC(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100121576822 [0,2,0,0,0,0|0,0,0]=2 3240 B17R1.29954 CCC#CC(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100011827653 [0,2,0,0,0,0|0,0,2]=4 3241 B17R1.29954 CCC=CC(=O)N(CC)c1cc(ccc1C)C 11a_100000743043_100000212282 [0,2,0,0,0,0|0,0,0]=2 3242 B17R1.29954 CCC=CC(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100000212282 [0,2,0,0,0,0|0,0,0]=2 3243 B17R1.29954 CCC=CC(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100000212282 [0,2,0,0,0,0|0,0,0]=2 3244 B17R1.29954 CCCCC(=O)N(CC)c1cc(ccc1C)C 11a_100000743043_100000210183 [0,2,0,0,0,0|0,0,2]=4 3245 B17R1.29954 CCCCC(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100000210183 [0,2,0,0,0,0|0,0,2]=4 3246 B17R1.29954 CCCCC(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100000210183 [0,2,0,0,0,0|0,0,2]=4 3247 B17R1.29954 CCCNC(=O)N(CC)c1cc(ccc1C)C 512a_100000743043_100020643023 [0,2,0,0,0,0|0,0,2]=4 3248 B17R1.29954 CCCNC(=O)N(CC)c1cc(ccc1C)C 512a_100020643023_100000743043 [0,2,0,0,0,0|0,0,2]=4 3249 B17R1.29954 CCCNC(=O)N(CC)c1cc(ccc1C)O 512a_100000211784_100020643023 [0,2,0,0,0,0|0,0,2]=4 3250 B17R1.29954 CCN(C(=O)C=COC)c1cc(ccc1C)C 1626a_100000743043_100016268678 [0,2,0,0,0,0|0,0,0]=2 3251 B17R1.29954 CCN(C(=O)C=COC)c1cc(ccc1C)C 22a_100000743043_100016268678 [0,2,0,0,0,0|0,0,0]=2 3252 B17R1.29954 CCN(C(=O)CCOC)c1cc(ccc1C)C 11a_100000743043_100000749529 [0,2,0,0,0,0|0,0,2]=4 3253 B17R1.29954 CCN(C(=O)CCOC)c1cc(ccc1C)C 1626a_100000743043_100000749529 [0,2,0,0,0,0|0,0,2]=4 3254 B17R1.29954 CCN(C(=O)CCOC)c1cc(ccc1C)C 22a_100000743043_100000749529 [0,2,0,0,0,0|0,0,2]=4 3255 B17R1.29954 CCN(C(=O)CCSC)c1cc(ccc1C)C 11a_100000743043_100000174002 [0,2,0,0,0,0|0,0,2]=4 3256 B17R1.29954 CCN(C(=O)CCSC)c1cc(ccc1C)C 1626a_100000743043_100000174002 [0,2,0,0,0,0|0,0,2]=4 3257 B17R1.29954 CCN(C(=O)CCSC)c1cc(ccc1C)C 22a_100000743043_100000174002 [0,2,0,0,0,0|0,0,2]=4 3258 B17R1.29954 CCN(C(=O)NCCF)c1cc(ccc1C)C 512a_100000743043_100000724931 [0,2,0,0,0,0|1,0,1]=4 3259 B17R1.29954 CCN(C(=O)NCCF)c1cc(ccc1C)O 512a_100000211784_100000724931 [0,2,0,0,0,0|1,0,1]=4 3260 B17R1.29954 CCN(C(=O)NCCO)c1cc(ccc1C)C 512a_100000743043_100000210304 [0,2,0,0,0,0|1,0,1]=4 3261 B17R1.29954 CCN(C(=O)NCCO)c1cc(ccc1C)O 512a_100000211784_100000210304 [0,2,0,0,0,0|1,0,1]=4 3262 B17R1.29954 CCNNC(=O)N(CC)c1cc(ccc1C)C 512a_100000743043_100000756455 [0,2,0,0,0,0|1,0,1]=4 3263 B17R1.29954 CCNNC(=O)N(CC)c1cc(ccc1C)C 512a_100000756455_100000743043 [0,2,0,0,0,0|1,0,1]=4 3264 B17R1.29954 CCNNC(=O)N(CC)c1cc(ccc1C)O 512a_100000211784_100000756455 [0,2,0,0,0,0|1,0,1]=4 3265 B17R1.29954 CCOCC(=O)N(CC)c1cc(ccc1C)C 11a_100000743043_100000211967 [0,2,0,0,0,0|0,0,2]=4 3266 B17R1.29954 CCOCC(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100000211967 [0,2,0,0,0,0|0,0,2]=4 3267 B17R1.29954 CCOCC(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100000211967 [0,2,0,0,0,0|0,0,2]=4 3268 B17R1.29954 CCSCC(=O)N(CC)c1cc(ccc1C)C 11a_100000743043_100000230394 [0,2,0,0,0,0|0,0,2]=4 3269 B17R1.29954 CCSCC(=O)N(CC)c1cc(ccc1C)C 1626a_100000743043_100000230394 [0,2,0,0,0,0|0,0,2]=4 3270 B17R1.29954 CCSCC(=O)N(CC)c1cc(ccc1C)C 22a_100000743043_100000230394 [0,2,0,0,0,0|0,0,2]=4 3271 B17R1.29973 C=CC=CC(=O)N(CC)c1ccccc1C#N 1626a_200000218880_100016291481 [0,2,0,0,0,0|0,0,2]=4 3272 B17R1.29973 C=CC=CC(=O)N(CC)c1ccccc1OC 1626a_100020603010_100016291481 [0,2,0,0,0,0|0,0,1]=3 3273 B17R1.29973 C=CC=CC(=O)N(CC)c1ccccc1OC 22a_100020603010_100016291481 [0,2,0,0,0,0|0,0,1]=3 3274 B17R1.29973 C=CCCC(=O)N(CC)c1ccccc1OC 11a_100020603010_100000749702 [0,2,0,0,0,0|0,0,2]=4 3275 B17R1.29973 C=CCCC(=O)N(CC)c1ccccc1OC 1626a_100020603010_100000749702 [0,2,0,0,0,0|0,0,2]=4 3276 B17R1.29973 C=CCCC(=O)N(CC)c1ccccc1OC 22a_100020603010_100000749702 [0,2,0,0,0,0|0,0,2]=4 3277 B17R1.29973 CC=CCC(=O)N(CC)c1ccccc1C#N 1626a_200000218880_100121576822 [0,2,0,0,0,0|0,0,1]=3 3278 B17R1.29973 CC=CCC(=O)N(CC)c1ccccc1OC 11a_100020603010_100121576822 [0,2,0,0,0,0|0,0,0]=2 3279 B17R1.29973 CC=CCC(=O)N(CC)c1ccccc1OC 1626a_100020603010_100121576822 [0,2,0,0,0,0|0,0,0]=2 3280 B17R1.29973 CC=CCC(=O)N(CC)c1ccccc1OC 22a_100020603010_100121576822 [0,2,0,0,0,0|0,0,0]=2 3281 B17R1.29973 CCC#CC(=O)N(CC)c1ccccc1OC 22a_100020603010_100011827653 [0,2,0,0,0,0|0,0,2]=4 3282 B17R1.29973 CCC=CC(=O)N(CC)c1ccccc1C#N 1626a_200000218880_100000212282 [0,2,0,0,0,0|0,0,1]=3 3283 B17R1.29973 CCC=CC(=O)N(CC)c1ccccc1OC 11a_100020603010_100000212282 [0,2,0,0,0,0|0,0,0]=2 3284 B17R1.29973 CCC=CC(=O)N(CC)c1ccccc1OC 1626a_100020603010_100000212282 [0,2,0,0,0,0|0,0,0]=2 3285 B17R1.29973 CCC=CC(=O)N(CC)c1ccccc1OC 22a_100020603010_100000212282 [0,2,0,0,0,0|0,0,0]=2 3286 B17R1.29973 CCCCC(=O)N(CC)c1ccccc1OC 11a_100020603010_100000210183 [0,2,0,0,0,0|0,0,2]=4 3287 B17R1.29973 CCCCC(=O)N(CC)c1ccccc1OC 1626a_100020603010_100000210183 [0,2,0,0,0,0|0,0,2]=4 3288 B17R1.29973 CCCCC(=O)N(CC)c1ccccc1OC 22a_100020603010_100000210183 [0,2,0,0,0,0|0,0,2]=4 3289 B17R1.29973 CCN(C(=O)C=COC)c1ccccc1C#N 1626a_200000218880_100016268678 [0,2,0,0,0,0|0,0,1]=3 3290 B17R1.29973 CCN(C(=O)C=COC)c1ccccc1OC 1626a_100020603010_100016268678 [0,2,0,0,0,0|0,0,0]=2 3291 B17R1.29973 CCN(C(=O)C=COC)c1ccccc1OC 22a_100020603010_100016268678 [0,2,0,0,0,0|0,0,0]=2 3292 B17R1.29973 CCN(C(=O)CCOC)c1ccccc1OC 11a_100020603010_100000749529 [0,2,0,0,0,0|0,0,2]=4 3293 B17R1.29973 CCN(C(=O)CCOC)c1ccccc1OC 1626a_100020603010_100000749529 [0,2,0,0,0,0|0,0,2]=4 3294 B17R1.29973 CCN(C(=O)CCOC)c1ccccc1OC 22a_100020603010_100000749529 [0,2,0,0,0,0|0,0,2]=4 3295 B17R1.29973 CCN(C(=O)CCSC)c1ccccc1OC 11a_100020603010_100000174002 [0,2,0,0,0,0|0,0,2]=4 3296 B17R1.29973 CCN(C(=O)CCSC)c1ccccc1OC 1626a_100020603010_100000174002 [0,2,0,0,0,0|0,0,2]=4 3297 B17R1.29973 CCN(C(=O)CCSC)c1ccccc1OC 22a_100020603010_100000174002 [0,2,0,0,0,0|0,0,2]=4 3298 B17R1.29973 CCOCC(=O)N(CC)c1ccccc1OC 11a_100020603010_100000211967 [0,2,0,0,0,0|0,0,2]=4 3299 B17R1.29973 CCOCC(=O)N(CC)c1ccccc1OC 1626a_100020603010_100000211967 [0,2,0,0,0,0|0,0,2]=4 3300 B17R1.29973 CCOCC(=O)N(CC)c1ccccc1OC 22a_100020603010_100000211967 [0,2,0,0,0,0|0,0,2]=4 3301 B17R1.29973 CCSCC(=O)N(CC)c1ccccc1OC 11a_100020603010_100000230394 [0,2,0,0,0,0|0,0,2]=4 3302 B17R1.29973 CCSCC(=O)N(CC)c1ccccc1OC 1626a_100020603010_100000230394 [0,2,0,0,0,0|0,0,2]=4 3303 B17R1.29973 CCSCC(=O)N(CC)c1ccccc1OC 22a_100020603010_100000230394 [0,2,0,0,0,0|0,0,2]=4 3304 B17R1.119007 CC=CC(=O)N(CCC)c1ccccc1C#N 1626a_200000219117_100000210699 [0,2,0,0,0,0|0,0,1]=3 3305 B17R1.119007 CCCN(C(=O)C=CBr)c1ccccc1C#N 1626a_200000219117_100016273825 [0,2,0,0,0,0|1,0,1]=4 3306 B17R1.119007 CCCN(C(=O)C=CCl)c1ccccc1C#N 1626a_200000219117_200016279998 [0,2,0,0,0,0|1,0,1]=4 3307 B17R1.119007 CCCN(C(=O)C=CI)c1ccccc1C#N 1626a_200000219117_100016256311 [0,2,0,0,0,0|1,0,1]=4 3308 B17R1.3109 C=C(C)CCC(=O)N(CC)c1ccccc1Br 11a_114873767003_200000688413 [0,2,0,0,0,0|1,0,1]=4 3309 B17R1.3109 C=C(C)CCC(=O)N(CC)c1ccccc1Br 1626a_114873767003_200000688413 [0,2,0,0,0,0|1,0,1]=4 3310 B17R1.3109 C=C(C)CCC(=O)N(CC)c1ccccc1C 11a_100000211084_200000688413 [0,2,0,0,0,0|0,0,1]=3 3311 B17R1.3109 C=C(C)CCC(=O)N(CC)c1ccccc1C 1626a_100000211084_200000688413 [0,2,0,0,0,0|0,0,1]=3 3312 B17R1.3109 C=C(C)CCC(=O)N(CC)c1ccccc1C 22a_100000211084_200000688413 [0,2,0,0,0,0|0,0,1]=3 3313 B17R1.3109 C=C(C)CCC(=O)N(CC)c1ccccc1F 11a_100000220365_200000688413 [0,2,0,0,0,0|1,0,1]=4 3314 B17R1.3109 C=C(C)CCC(=O)N(CC)c1ccccc1F 1626a_100000220365_200000688413 [0,2,0,0,0,0|1,0,1]=4 3315 B17R1.3109 C=C(C)CCC(=O)N(CC)c1ccccc1O 22a_103624766699_200000688413 [0,2,0,0,0,0|1,0,1]=4 3316 B17R1.3109 C=C(C)CNC(=O)N(CC)c1ccccc1Br 512a_114873767003_100000765925 [0,2,0,0,0,0|1,0,1]=4 3317 B17R1.3109 C=C(C)CNC(=O)N(CC)c1ccccc1C 512a_100000211084_100000765925 [0,2,0,0,0,0|0,0,1]=3 3318 B17R1.3109 C=C(C)CNC(=O)N(CC)c1ccccc1C 512a_100000765925_100000211084 [0,2,0,0,0,0|0,0,1]=3 3319 B17R1.3109 C=C(C)CNC(=O)N(CC)c1ccccc1F 512a_100000220365_100000765925 [0,2,0,0,0,0|1,0,1]=4 3320 B17R1.3109 CCC(C(=O)CC=C(C)C)c1ccccc1Cl 1458a_100011667493_100000761012 [0,2,0,0,0,0|2,0,0]=4 3321 B17R1.3109 CCN(C(=O)C=CC(C)C)c1ccccc1Br 11a_114873767003_100016268746 [0,2,0,0,0,0|1,0,0]=3 3322 B17R1.3109 CCN(C(=O)C=CC(C)C)c1ccccc1Br 1626a_114873767003_100016268746 [0,2,0,0,0,0|1,0,0]=3 3323 B17R1.3109 CCN(C(=O)C=CC(C)C)c1ccccc1C 11a_100000211084_100016268746 [0,2,0,0,0,0|0,0,0]=2 3324 B17R1.3109 CCN(C(=O)C=CC(C)C)c1ccccc1C 1626a_100000211084_100016268746 [0,2,0,0,0,0|0,0,0]=2 3325 B17R1.3109 CCN(C(=O)C=CC(C)C)c1ccccc1C 22a_100000211084_100016268746 [0,2,0,0,0,0|0,0,0]=2 3326 B17R1.3109 CCN(C(=O)C=CC(C)C)c1ccccc1F 11a_100000220365_100016268746 [0,2,0,0,0,0|1,0,0]=3 3327 B17R1.3109 CCN(C(=O)C=CC(C)C)c1ccccc1F 1626a_100000220365_100016268746 [0,2,0,0,0,0|1,0,0]=3 3328 B17R1.3109 CCN(C(=O)C=CC(C)C)c1ccccc1O 22a_103624766699_100016268746 [0,2,0,0,0,0|1,0,0]=3 3329 B17R1.3109 CCN(C(=O)CC=C(C)C)c1ccccc1Br 11a_114873767003_100011220947 [0,2,0,0,0,0|1,0,0]=3 3330 B17R1.3109 CCN(C(=O)CC=C(C)C)c1ccccc1Br 1626a_114873767003_100011220947 [0,2,0,0,0,0|1,0,0]=3 3331 B17R1.3109 CCN(C(=O)CC=C(C)C)c1ccccc1C 11a_100000211084_100011220947 [0,2,0,0,0,0|0,0,0]=2 3332 B17R1.3109 CCN(C(=O)CC=C(C)C)c1ccccc1C 1626a_100000211084_100011220947 [0,2,0,0,0,0|0,0,0]=2 3333 B17R1.3109 CCN(C(=O)CC=C(C)C)c1ccccc1C 22a_100000211084_100011220947 [0,2,0,0,0,0|0,0,0]=2 3334 B17R1.3109 CCN(C(=O)CC=C(C)C)c1ccccc1F 11a_100000220365_100011220947 [0,2,0,0,0,0|1,0,0]=3 3335 B17R1.3109 CCN(C(=O)CC=C(C)C)c1ccccc1F 1626a_100000220365_100011220947 [0,2,0,0,0,0|1,0,0]=3 3336 B17R1.3109 CCN(C(=O)CC=C(C)C)c1ccccc1O 22a_103624766699_100011220947 [0,2,0,0,0,0|1,0,0]=3 3337 B17R1.3109 CCN(C(=O)CCC(=O)N)c1ccccc1C 22a_100000211084_100011215257 [0,2,0,0,0,0|1,0,1]=4 3338 B17R1.3109 CCN(C(=O)CCC(C)C)c1ccccc1C 11a_100000211084_100000181311 [0,2,0,0,0,0|0,0,2]=4 3339 B17R1.3109 CCN(C(=O)CCC(C)C)c1ccccc1C 1626a_100000211084_100000181311 [0,2,0,0,0,0|0,0,2]=4 3340 B17R1.3109 CCN(C(=O)CCC(C)C)c1ccccc1C 22a_100000211084_100000181311 [0,2,0,0,0,0|0,0,2]=4 3341 B17R1.3109 CCN(C(=O)CCC(C)O)c1ccccc1C 1626a_100000211084_100000718519 [0,2,0,0,0,0|0,0,2]=4 3342 B17R1.3109 CCN(C(=O)CCN(C)C)c1ccccc1C 11a_100000211084_100000689311 [0,2,0,0,0,0|0,0,2]=4 3343 B17R1.3109 CCN(C(=O)CCN(C)C)c1ccccc1C 2230a_100102631434_200011208507 [0,2,0,0,0,0|0,0,2]=4 3344 B17R1.3109 CCN(C(=O)CCN(C)C)c1ccccc1C 22a_100000211084_100000689311 [0,2,0,0,0,0|0,0,2]=4 3345 B17R1.3109 CCN(C(=O)CCN(C)C)c1ccccc1C 269982a_100102631434_200011208507 [0,2,0,0,0,0|0,0,2]=4 3346 B17R1.3109 CCN(C(=O)CC[S+](C)C)c1ccccc1C 11a_100000211084_100009452791 [0,2,0,0,0,0|0,0,2]=4 3347 B17R1.3109 CCN(C(=O)CC[S+](C)C)c1ccccc1C 1626a_100000211084_100009452791 [0,2,0,0,0,0|0,0,2]=4 3348 B17R1.3109 CCN(C(=O)CC[S+](C)C)c1ccccc1C 22a_100000211084_100009452791 [0,2,0,0,0,0|0,0,2]=4 3349 B17R1.3109 CCN(C(=O)CNC(=O)C)c1ccccc1Br 11a_114873767003_100000194580 [0,2,0,0,0,0|1,0,1]=4 3350 B17R1.3109 CCN(C(=O)CNC(=O)C)c1ccccc1Br 1626a_114873767003_100000194580 [0,2,0,0,0,0|1,0,1]=4 3351 B17R1.3109 CCN(C(=O)CNC(=O)C)c1ccccc1C 11a_100000211084_100000194580 [0,2,0,0,0,0|0,0,1]=3 3352 B17R1.3109 CCN(C(=O)CNC(=O)C)c1ccccc1C 1626a_100000211084_100000194580 [0,2,0,0,0,0|0,0,1]=3 3353 B17R1.3109 CCN(C(=O)CNC(=O)C)c1ccccc1C 22a_100000211084_100000194580 [0,2,0,0,0,0|0,0,1]=3 3354 B17R1.3109 CCN(C(=O)CNC(=O)C)c1ccccc1F 11a_100000220365_100000194580 [0,2,0,0,0,0|1,0,1]=4 3355 B17R1.3109 CCN(C(=O)CNC(=O)C)c1ccccc1F 1626a_100000220365_100000194580 [0,2,0,0,0,0|1,0,1]=4 3356 B17R1.3109 CCN(C(=O)CNC(=O)C)c1ccccc1O 22a_103624766699_100000194580 [0,2,0,0,0,0|1,0,1]=4 3357 B17R1.3109 CCN(C(=O)CNC(=O)N)c1ccccc1C 22a_100000211084_100000184981 [0,2,0,0,0,0|1,0,1]=4 3358 B17R1.3109 CCN(C(=O)CNC(C)C)c1ccccc1C 2230a_100138425928_100000239579 [0,2,0,0,0,0|0,0,2]=4 3359 B17R1.3109 CCN(C(=O)CNC(C)C)c1ccccc1C 34a_100138425928_100000239579 [0,2,0,0,0,0|0,0,2]=4 3360 B17R1.3109 CCN(C(=O)COC(=O)C)c1ccccc1Br 1626a_114873767003_100000183556 [0,2,0,0,0,0|1,0,1]=4 3361 B17R1.3109 CCN(C(=O)COC(=O)C)c1ccccc1C 1626a_100000211084_100000183556 [0,2,0,0,0,0|0,0,1]=3 3362 B17R1.3109 CCN(C(=O)COC(=O)C)c1ccccc1C 22a_100000211084_100000183556 [0,2,0,0,0,0|0,0,1]=3 3363 B17R1.3109 CCN(C(=O)COC(=O)C)c1ccccc1F 1626a_100000220365_100000183556 [0,2,0,0,0,0|1,0,1]=4 3364 B17R1.3109 CCN(C(=O)COC(=O)C)c1ccccc1O 22a_103624766699_100000183556 [0,2,0,0,0,0|1,0,1]=4 3365 B17R1.3109 CCN(C(=O)COC(C)C)c1ccccc1C 11a_100000211084_100000745533 [0,2,0,0,0,0|0,0,2]=4 3366 B17R1.3109 CCN(C(=O)COC(C)C)c1ccccc1C 1626a_100000211084_100000745533 [0,2,0,0,0,0|0,0,2]=4 3367 B17R1.3109 CCN(C(=O)COC(C)C)c1ccccc1C 22a_100000211084_100000745533 [0,2,0,0,0,0|0,0,2]=4 3368 B17R1.3109 CCN(C(=O)COC(C)C)c1ccccc1C 34a_100000212225_100000239579 [0,2,0,0,0,0|0,0,2]=4 3369 B17R1.3109 CCN(C(=O)COC(F)F)c1ccccc1C 11a_100000211084_200000719455 [0,2,0,0,0,0|1,0,1]=4 3370 B17R1.3109 CCN(C(=O)COC(F)F)c1ccccc1C 1626a_100000211084_200000719455 [0,2,0,0,0,0|1,0,1]=4 3371 B17R1.3109 CCN(C(=O)COC(F)F)c1ccccc1C 22a_100000211084_200000719455 [0,2,0,0,0,0|1,0,1]=4 3372 B17R1.3109 CCN(C(=O)CSC(=O)C)c1ccccc1Br 11a_114873767003_100000049016 [0,2,0,0,0,0|1,0,1]=4 3373 B17R1.3109 CCN(C(=O)CSC(=O)C)c1ccccc1Br 1626a_114873767003_100000049016 [0,2,0,0,0,0|1,0,1]=4 3374 B17R1.3109 CCN(C(=O)CSC(=O)C)c1ccccc1C 11a_100000211084_100000049016 [0,2,0,0,0,0|0,0,1]=3 3375 B17R1.3109 CCN(C(=O)CSC(=O)C)c1ccccc1C 1626a_100000211084_100000049016 [0,2,0,0,0,0|0,0,1]=3 3376 B17R1.3109 CCN(C(=O)CSC(=O)C)c1ccccc1F 11a_100000220365_100000049016 [0,2,0,0,0,0|1,0,1]=4 3377 B17R1.3109 CCN(C(=O)CSC(=O)C)c1ccccc1F 1626a_100000220365_100000049016 [0,2,0,0,0,0|1,0,1]=4 3378 B17R1.3109 CCN(C(=O)CSC(C)C)c1ccccc1C 11a_100000211084_100000241585 [0,2,0,0,0,0|0,0,2]=4 3379 B17R1.3109 CCN(C(=O)CSC(C)C)c1ccccc1C 1626a_100000211084_100000241585 [0,2,0,0,0,0|0,0,2]=4 3380 B17R1.3109 CCN(C(=O)CSC(C)C)c1ccccc1C 22a_100000211084_100000241585 [0,2,0,0,0,0|0,0,2]=4 3381 B17R1.3109 CCN(C(=O)CSC(C)C)c1ccccc1C 62a_100000210206_100000239579 [0,2,0,0,0,0|0,0,2]=4 3382 B17R1.3109 CCN(C(=O)CSC(F)F)c1ccccc1C 11a_100000211084_114828291038 [0,2,0,0,0,0|1,0,1]=4 3383 B17R1.3109 CCN(C(=O)CSC(F)F)c1ccccc1C 1626a_100000211084_114828291038 [0,2,0,0,0,0|1,0,1]=4 3384 B17R1.3109 CCN(C(=O)CSC(F)F)c1ccccc1C 22a_100000211084_114828291038 [0,2,0,0,0,0|1,0,1]=4 3385 B17R1.3109 CCN(C(=O)NCC(=O)N)c1ccccc1C 512a_100000211084_100000711301 [0,2,0,0,0,0|1,0,1]=4 3386 B17R1.3109 CCN(C(=O)NCC(C)C)c1ccccc1C 512a_100000210953_100000211084 [0,2,0,0,0,0|0,0,2]=4 3387 B17R1.3109 CCN(C(=O)NCC(C)C)c1ccccc1C 512a_100000211084_100000210953 [0,2,0,0,0,0|0,0,2]=4 3388 B17R1.3109 CCN(C(=O)NCC(C)O)c1ccccc1C 512a_100000210904_100000211084 [0,2,0,0,0,0|0,0,2]=4 3389 B17R1.3109 CCN(C(=O)NCC(C)O)c1ccccc1C 512a_100000211084_100000210904 [0,2,0,0,0,0|0,0,2]=4 3390 B17R1.3109 CCN(C(=O)NCC(F)F)c1ccccc1C 512a_100000211084_100000765723 [0,2,0,0,0,0|1,0,1]=4 3391 B17R1.3109 CCN(C(=O)NCC(F)F)c1ccccc1C 512a_100000765723_100000211084 [0,2,0,0,0,0|1,0,1]=4 3392 B17R1.3109 CCN(C(=O)NNC(=O)C)c1ccccc1C 512a_100000189765_100000211084 [0,2,0,0,0,0|1,0,0]=3 3393 B17R1.3109 CCN(C(=O)NNC(C)C)c1ccccc1C 512a_100000211084_100000741168 [0,2,0,0,0,0|1,0,1]=4 3394 B17R1.3109 CCN(C(=O)NNC(C)C)c1ccccc1C 512a_100000741168_100000211084 [0,2,0,0,0,0|1,0,1]=4 3395 B17R1.3109 COC(C(=O)CC=C(C)C)c1ccccc1C 1458a_100012277922_100000761012 [0,2,0,0,0,0|2,0,0]=4 3396 B17R1.3353 C#CCCCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000690238 [0,2,0,0,0,0|0,0,2]=4 3397 B17R1.3353 C#CCCCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000690238 [0,2,0,0,0,0|0,0,2]=4 3398 B17R1.3353 C#CCCCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000690238 [0,2,0,0,0,0|0,0,2]=4 3399 B17R1.3353 C#CCCNC(=O)N(CC)c1ccccc1C 512a_100000211084_100000755551 [0,2,0,0,0,0|1,0,1]=4 3400 B17R1.3353 C#CCCNC(=O)N(CC)c1ccccc1C 512a_100000755551_100000211084 [0,2,0,0,0,0|1,0,1]=4 3401 B17R1.3353 C#CCNCC(=O)N(CC)c1ccccc1C 34a_100000212058_100000239579 [0,2,0,0,0,0|1,0,1]=4 3402 B17R1.3353 C#CCOCC(=O)N(CC)c1ccccc1C 11a_100000211084_100011251226 [0,2,0,0,0,0|1,0,1]=4 3403 B17R1.3353 C#CCOCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100011251226 [0,2,0,0,0,0|1,0,1]=4 3404 B17R1.3353 C#CCOCC(=O)N(CC)c1ccccc1C 22a_100000211084_100011251226 [0,2,0,0,0,0|1,0,1]=4 3405 B17R1.3353 C#CCOCC(=O)N(CC)c1ccccc1C 34a_100000210247_100000239579 [0,2,0,0,0,0|1,0,1]=4 3406 B17R1.3353 C#CCSCC(=O)N(CC)c1ccccc1C 62a_100000038162_100000239579 [0,2,0,0,0,0|1,0,1]=4 3407 B17R1.3353 C/C=C/C=CC(=O)N(CC)c1ccccc1Br 11a_114873767003_100000185730 [0,2,0,0,0,0|1,0,0]=3 3408 B17R1.3353 C/C=C/C=CC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000185730 [0,2,0,0,0,0|1,0,0]=3 3409 B17R1.3353 C/C=C/C=CC(=O)N(CC)c1ccccc1C 11a_100000211084_100000185730 [0,2,0,0,0,0|0,0,0]=2 3410 B17R1.3353 C/C=C/C=CC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000185730 [0,2,0,0,0,0|0,0,0]=2 3411 B17R1.3353 C/C=C/C=CC(=O)N(CC)c1ccccc1C 22a_100000211084_100000185730 [0,2,0,0,0,0|0,0,0]=2 3412 B17R1.3353 C/C=C/C=CC(=O)N(CC)c1ccccc1F 11a_100000220365_100000185730 [0,2,0,0,0,0|1,0,0]=3 3413 B17R1.3353 C/C=C/C=CC(=O)N(CC)c1ccccc1F 1626a_100000220365_100000185730 [0,2,0,0,0,0|1,0,0]=3 3414 B17R1.3353 C/C=C/C=CC(=O)N(CC)c1ccccc1O 22a_103624766699_100000185730 [0,2,0,0,0,0|1,0,0]=3 3415 B17R1.3353 C=CCCCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000766728 [0,2,0,0,0,0|0,0,2]=4 3416 B17R1.3353 C=CCCCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000766728 [0,2,0,0,0,0|0,0,2]=4 3417 B17R1.3353 C=CCCCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000766728 [0,2,0,0,0,0|0,0,2]=4 3418 B17R1.3353 C=CCCNC(=O)N(CC)c1ccccc1C 512a_100000211084_100015191253 [0,2,0,0,0,0|0,0,2]=4 3419 B17R1.3353 C=CCCNC(=O)N(CC)c1ccccc1C 512a_100015191253_100000211084 [0,2,0,0,0,0|0,0,2]=4 3420 B17R1.3353 C=CCNCC(=O)N(CC)c1ccccc1C 2230a_100020586998_100000239579 [0,2,0,0,0,0|0,0,2]=4 3421 B17R1.3353 C=CCNNC(=O)N(CC)c1ccccc1C 512a_100000211084_100020588587 [0,2,0,0,0,0|0,0,2]=4 3422 B17R1.3353 C=CCNNC(=O)N(CC)c1ccccc1C 512a_100020588587_100000211084 [0,2,0,0,0,0|0,0,2]=4 3423 B17R1.3353 C=CCOCC(=O)N(CC)c1ccccc1C 34a_200000210373_100000239579 [0,2,0,0,0,0|0,0,2]=4 3424 B17R1.3353 C=CCSCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000230395 [0,2,0,0,0,0|0,0,2]=4 3425 B17R1.3353 C=CCSCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000230395 [0,2,0,0,0,0|0,0,2]=4 3426 B17R1.3353 C=CCSCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000230395 [0,2,0,0,0,0|0,0,2]=4 3427 B17R1.3353 C=CCSCC(=O)N(CC)c1ccccc1C 62a_100000210623_100000239579 [0,2,0,0,0,0|0,0,2]=4 3428 B17R1.3353 CC#CCNC(=O)N(CC)c1ccccc1C 512a_100000211084_100000685387 [0,2,0,0,0,0|0,0,2]=4 3429 B17R1.3353 CC#CCNC(=O)N(CC)c1ccccc1C 512a_100000685387_100000211084 [0,2,0,0,0,0|0,0,2]=4 3430 B17R1.3353 CC/C=C/CC(=O)N(CC)c1ccccc1Br 11a_114873767003_100016274230 [0,2,0,0,0,0|1,0,0]=3 3431 B17R1.3353 CC/C=C/CC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100016274230 [0,2,0,0,0,0|1,0,0]=3 3432 B17R1.3353 CC/C=C/CC(=O)N(CC)c1ccccc1C 11a_100000211084_100016274230 [0,2,0,0,0,0|0,0,0]=2 3433 B17R1.3353 CC/C=C/CC(=O)N(CC)c1ccccc1C 1626a_100000211084_100016274230 [0,2,0,0,0,0|0,0,0]=2 3434 B17R1.3353 CC/C=C/CC(=O)N(CC)c1ccccc1C 22a_100000211084_100016274230 [0,2,0,0,0,0|0,0,0]=2 3435 B17R1.3353 CC/C=C/CC(=O)N(CC)c1ccccc1F 11a_100000220365_100016274230 [0,2,0,0,0,0|1,0,0]=3 3436 B17R1.3353 CC/C=C/CC(=O)N(CC)c1ccccc1F 1626a_100000220365_100016274230 [0,2,0,0,0,0|1,0,0]=3 3437 B17R1.3353 CC/C=C/CC(=O)N(CC)c1ccccc1O 22a_103624766699_100016274230 [0,2,0,0,0,0|1,0,0]=3 3438 B17R1.3353 CC/C=C\CC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100103147603 [0,2,0,0,0,0|2,0,0]=4 3439 B17R1.3353 CC/C=C\CC(=O)C(OC)c1ccccc1C 1458a_100012277922_100103147603 [0,2,0,0,0,0|2,0,0]=4 3440 B17R1.3353 CCCC#CC(=O)N(CC)c1ccccc1C 22a_100000211084_200011218047 [0,2,0,0,0,0|0,0,2]=4 3441 B17R1.3353 CCCC=CC(=O)N(CC)c1ccccc1Br 11a_114873767003_100000212230 [0,2,0,0,0,0|1,0,0]=3 3442 B17R1.3353 CCCC=CC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000212230 [0,2,0,0,0,0|1,0,0]=3 3443 B17R1.3353 CCCC=CC(=O)N(CC)c1ccccc1C 11a_100000211084_100000212230 [0,2,0,0,0,0|0,0,0]=2 3444 B17R1.3353 CCCC=CC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000212230 [0,2,0,0,0,0|0,0,0]=2 3445 B17R1.3353 CCCC=CC(=O)N(CC)c1ccccc1C 22a_100000211084_100000212230 [0,2,0,0,0,0|0,0,0]=2 3446 B17R1.3353 CCCC=CC(=O)N(CC)c1ccccc1F 11a_100000220365_100000212230 [0,2,0,0,0,0|1,0,0]=3 3447 B17R1.3353 CCCC=CC(=O)N(CC)c1ccccc1F 1626a_100000220365_100000212230 [0,2,0,0,0,0|1,0,0]=3 3448 B17R1.3353 CCCC=CC(=O)N(CC)c1ccccc1O 22a_103624766699_100000212230 [0,2,0,0,0,0|1,0,0]=3 3449 B17R1.3353 CCCCCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000212188 [0,2,0,0,0,0|0,0,2]=4 3450 B17R1.3353 CCCCCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000212188 [0,2,0,0,0,0|0,0,2]=4 3451 B17R1.3353 CCCCCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000212188 [0,2,0,0,0,0|0,0,2]=4 3452 B17R1.3353 CCCCNC(=O)N(CC)c1ccccc1C 512a_100000102301_100000211084 [0,2,0,0,0,0|0,0,2]=4 3453 B17R1.3353 CCCCNC(=O)N(CC)c1ccccc1C 512a_100000211084_100000102301 [0,2,0,0,0,0|0,0,2]=4 3454 B17R1.3353 CCCNNC(=O)N(CC)c1ccccc1C 512a_100000211084_100000740057 [0,2,0,0,0,0|0,0,2]=4 3455 B17R1.3353 CCCNNC(=O)N(CC)c1ccccc1C 512a_100000740057_100000211084 [0,2,0,0,0,0|0,0,2]=4 3456 B17R1.3353 CCCOCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000745993 [0,2,0,0,0,0|0,0,2]=4 3457 B17R1.3353 CCCOCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000745993 [0,2,0,0,0,0|0,0,2]=4 3458 B17R1.3353 CCCOCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000745993 [0,2,0,0,0,0|0,0,2]=4 3459 B17R1.3353 CCCOCC(=O)N(CC)c1ccccc1C 34a_100000210258_100000239579 [0,2,0,0,0,0|0,0,2]=4 3460 B17R1.3353 CCCSCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000217233 [0,2,0,0,0,0|0,0,2]=4 3461 B17R1.3353 CCCSCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000217233 [0,2,0,0,0,0|0,0,2]=4 3462 B17R1.3353 CCCSCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000217233 [0,2,0,0,0,0|0,0,2]=4 3463 B17R1.3353 CCCSCC(=O)N(CC)c1ccccc1C 62a_100000210303_100000239579 [0,2,0,0,0,0|0,0,2]=4 3464 B17R1.3353 CCN(C(=O)C=CCOC)c1ccccc1Br 11a_114873767003_100016285016 [0,2,0,0,0,0|1,0,0]=3 3465 B17R1.3353 CCN(C(=O)C=CCOC)c1ccccc1Br 1626a_114873767003_100016285016 [0,2,0,0,0,0|1,0,0]=3 3466 B17R1.3353 CCN(C(=O)C=CCOC)c1ccccc1C 11a_100000211084_100016285016 [0,2,0,0,0,0|0,0,0]=2 3467 B17R1.3353 CCN(C(=O)C=CCOC)c1ccccc1C 1626a_100000211084_100016285016 [0,2,0,0,0,0|0,0,0]=2 3468 B17R1.3353 CCN(C(=O)C=CCOC)c1ccccc1C 22a_100000211084_100016285016 [0,2,0,0,0,0|0,0,0]=2 3469 B17R1.3353 CCN(C(=O)C=CCOC)c1ccccc1F 11a_100000220365_100016285016 [0,2,0,0,0,0|1,0,0]=3 3470 B17R1.3353 CCN(C(=O)C=CCOC)c1ccccc1F 1626a_100000220365_100016285016 [0,2,0,0,0,0|1,0,0]=3 3471 B17R1.3353 CCN(C(=O)C=CCOC)c1ccccc1O 22a_103624766699_100016285016 [0,2,0,0,0,0|1,0,0]=3 3472 B17R1.3353 CCN(C(=O)CCCC#N)c1ccccc1C 11a_100000211084_100000075515 [0,2,0,0,0,0|0,0,2]=4 3473 B17R1.3353 CCN(C(=O)CCCC#N)c1ccccc1C 1626a_100000211084_100000075515 [0,2,0,0,0,0|0,0,2]=4 3474 B17R1.3353 CCN(C(=O)CCCC#N)c1ccccc1C 22a_100000211084_100000075515 [0,2,0,0,0,0|0,0,2]=4 3475 B17R1.3353 CCN(C(=O)CCCCO)c1ccccc1C 1626a_100000211084_100000695505 [0,2,0,0,0,0|0,0,2]=4 3476 B17R1.3353 CCN(C(=O)CCCOC)c1ccccc1C 11a_100000211084_100000741012 [0,2,0,0,0,0|0,0,2]=4 3477 B17R1.3353 CCN(C(=O)CCCOC)c1ccccc1C 1626a_100000211084_100000741012 [0,2,0,0,0,0|0,0,2]=4 3478 B17R1.3353 CCN(C(=O)CCCOC)c1ccccc1C 22a_100000211084_100000741012 [0,2,0,0,0,0|0,0,2]=4 3479 B17R1.3353 CCN(C(=O)CCCSC)c1ccccc1C 11a_100000211084_100000173376 [0,2,0,0,0,0|0,0,2]=4 3480 B17R1.3353 CCN(C(=O)CCCSC)c1ccccc1C 1626a_100000211084_100000173376 [0,2,0,0,0,0|0,0,2]=4 3481 B17R1.3353 CCN(C(=O)CCCSC)c1ccccc1C 22a_100000211084_100000173376 [0,2,0,0,0,0|0,0,2]=4 3482 B17R1.3353 CCN(C(=O)CCSCF)c1ccccc1C 62a_100015361967_200011208507 [0,2,0,0,0,0|0,0,2]=4 3483 B17R1.3353 CCN(C(=O)CNCCF)c1ccccc1C 34a_100000724931_100000239579 [0,2,0,0,0,0|0,0,2]=4 3484 B17R1.3353 CCN(C(=O)CNCCO)c1ccccc1C 2230a_100016997473_100000239579 [0,2,0,0,0,0|0,0,2]=4 3485 B17R1.3353 CCN(C(=O)CNCCO)c1ccccc1C 34a_100016990907_100000239579 [0,2,0,0,0,0|0,0,2]=4 3486 B17R1.3353 CCN(C(=O)COCCBr)c1ccccc1C 34a_100000211926_100000239579 [0,2,0,0,0,0|0,0,2]=4 3487 B17R1.3353 CCN(C(=O)COCCN)c1ccccc1C 34a_100000210304_100000239579 [0,2,0,0,0,0|0,0,2]=4 3488 B17R1.3353 CCN(C(=O)COCCO)c1ccccc1C 1626a_100000211084_100000708028 [0,2,0,0,0,0|0,0,2]=4 3489 B17R1.3353 CCN(C(=O)CSCC#N)c1ccccc1C 11a_100000211084_100000150266 [0,2,0,0,0,0|1,0,1]=4 3490 B17R1.3353 CCN(C(=O)CSCC#N)c1ccccc1C 1626a_100000211084_100000150266 [0,2,0,0,0,0|1,0,1]=4 3491 B17R1.3353 CCN(C(=O)CSCC#N)c1ccccc1C 22a_100000211084_100000150266 [0,2,0,0,0,0|1,0,1]=4 3492 B17R1.3353 CCN(C(=O)CSCC#N)c1ccccc1C 62a_100011215382_100000239579 [0,2,0,0,0,0|1,0,1]=4 3493 B17R1.3353 CCN(C(=O)CSCC=O)c1ccccc1C 62a_200015260668_100000239579 [0,2,0,0,0,0|1,0,1]=4 3494 B17R1.3353 CCN(C(=O)CSCCF)c1ccccc1C 62a_100011217306_100000239579 [0,2,0,0,0,0|0,0,2]=4 3495 B17R1.3353 CCN(C(=O)CSCCO)c1ccccc1C 62a_100000211926_100000239579 [0,2,0,0,0,0|0,0,2]=4 3496 B17R1.3353 CCN(C(=O)CSCOC)c1ccccc1C 62a_100000766300_100000239579 [0,2,0,0,0,0|0,0,2]=4 3497 B17R1.3353 CCN(C(=O)CSCSC)c1ccccc1C 62a_100011218213_100000239579 [0,2,0,0,0,0|0,0,2]=4 3498 B17R1.3353 CCN(C(=O)NCCC#N)c1ccccc1C 512a_100000211084_100000720768 [0,2,0,0,0,0|1,0,1]=4 3499 B17R1.3353 CCN(C(=O)NCCC#N)c1ccccc1C 512a_100000720768_100000211084 [0,2,0,0,0,0|1,0,1]=4 3500 B17R1.3353 CCN(C(=O)NCCCF)c1ccccc1C 512a_100000211084_100015189416 [0,2,0,0,0,0|0,0,2]=4 3501 B17R1.3353 CCN(C(=O)NCCCF)c1ccccc1C 512a_100015189416_100000211084 [0,2,0,0,0,0|0,0,2]=4 3502 B17R1.3353 CCN(C(=O)NCCCO)c1ccccc1C 512a_100000211084_100000182051 [0,2,0,0,0,0|0,0,2]=4 3503 B17R1.3353 CCN(C(=O)NCCSC)c1ccccc1C 512a_100000211084_100020590264 [0,2,0,0,0,0|0,0,2]=4 3504 B17R1.3353 CCN(C(=O)NCCSC)c1ccccc1C 512a_100020590264_100000211084 [0,2,0,0,0,0|0,0,2]=4 3505 B17R1.3353 CCN(C(=O)NNCCO)c1ccccc1C 512a_100000211084_100000210001 [0,2,0,0,0,0|1,0,1]=4 3506 B17R1.3353 CCNCCC(=O)N(CC)c1ccccc1C 2230a_100015525214_200011208507 [0,2,0,0,0,0|0,0,2]=4 3507 B17R1.3353 CCOC=CC(=O)N(CC)c1ccccc1Br 11a_114873767003_100016266692 [0,2,0,0,0,0|1,0,0]=3 3508 B17R1.3353 CCOC=CC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100016266692 [0,2,0,0,0,0|1,0,0]=3 3509 B17R1.3353 CCOC=CC(=O)N(CC)c1ccccc1C 11a_100000211084_100016266692 [0,2,0,0,0,0|0,0,0]=2 3510 B17R1.3353 CCOC=CC(=O)N(CC)c1ccccc1C 1626a_100000211084_100016266692 [0,2,0,0,0,0|0,0,0]=2 3511 B17R1.3353 CCOC=CC(=O)N(CC)c1ccccc1C 22a_100000211084_100016266692 [0,2,0,0,0,0|0,0,0]=2 3512 B17R1.3353 CCOC=CC(=O)N(CC)c1ccccc1F 11a_100000220365_100016266692 [0,2,0,0,0,0|1,0,0]=3 3513 B17R1.3353 CCOC=CC(=O)N(CC)c1ccccc1F 1626a_100000220365_100016266692 [0,2,0,0,0,0|1,0,0]=3 3514 B17R1.3353 CCOC=CC(=O)N(CC)c1ccccc1O 22a_103624766699_100016266692 [0,2,0,0,0,0|1,0,0]=3 3515 B17R1.3353 CCOCCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000749530 [0,2,0,0,0,0|0,0,2]=4 3516 B17R1.3353 CCOCCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000749530 [0,2,0,0,0,0|0,0,2]=4 3517 B17R1.3353 CCOCCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000749530 [0,2,0,0,0,0|0,0,2]=4 3518 B17R1.3353 CCOCCC(=O)N(CC)c1ccccc1C 34a_100121572206_200011208507 [0,2,0,0,0,0|0,0,2]=4 3519 B17R1.3353 CCSCCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000230768 [0,2,0,0,0,0|0,0,2]=4 3520 B17R1.3353 CCSCCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000230768 [0,2,0,0,0,0|0,0,2]=4 3521 B17R1.3353 CCSCCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000230768 [0,2,0,0,0,0|0,0,2]=4 3522 B17R1.3353 CCSCCC(=O)N(CC)c1ccccc1C 62a_100000210202_200011208507 [0,2,0,0,0,0|0,0,2]=4 3523 B17R1.107495 C=CC=CC(=O)N(CCC)c1ccccc1F 1626a_100011231789_100016291481 [0,2,0,0,0,0|1,0,1]=4 3524 B17R1.107495 C=CCNC(=O)N(CCO)c1ccccc1C 512a_100020586998_100011233185 [0,2,0,0,0,0|0,0,2]=4 3525 B17R1.107495 CC=CCC(=O)N(CCC)c1ccccc1F 11a_100011231789_100121576822 [0,2,0,0,0,0|1,0,0]=3 3526 B17R1.107495 CC=CCC(=O)N(CCC)c1ccccc1F 1626a_100011231789_100121576822 [0,2,0,0,0,0|1,0,0]=3 3527 B17R1.107495 CCC=CC(=O)N(CCC)c1ccccc1F 11a_100011231789_100000212282 [0,2,0,0,0,0|1,0,0]=3 3528 B17R1.107495 CCC=CC(=O)N(CCC)c1ccccc1F 1626a_100011231789_100000212282 [0,2,0,0,0,0|1,0,0]=3 3529 B17R1.107495 CCCN(C(=O)C=COC)c1ccccc1F 1626a_100011231789_100016268678 [0,2,0,0,0,0|1,0,0]=3 3530 B17R1.107495 CCCNC(=O)N(CCO)c1ccccc1C 512a_100020643023_100011233185 [0,2,0,0,0,0|0,0,2]=4 3531 B17R1.107495 CCNNC(=O)N(CCO)c1ccccc1C 512a_100000756455_100011233185 [0,2,0,0,0,0|1,0,1]=4 3532 B17R1.169661 C=CC=CC(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100016291481 [0,2,0,0,0,0|0,0,1]=3 3533 B17R1.169661 C=CC=CC(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100016291481 [0,2,0,0,0,0|0,0,1]=3 3534 B17R1.169661 C=CC=CC(=O)N(CC)c1ccc(cc1Cl)Cl 1626a_100160557746_100016291481 [0,2,0,0,0,0|1,0,1]=4 3535 B17R1.169661 C=CCCC(=O)N(CC)c1ccc(cc1C)F 11a_100000221679_100000749702 [0,2,0,0,0,0|0,0,2]=4 3536 B17R1.169661 C=CCCC(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100000749702 [0,2,0,0,0,0|0,0,2]=4 3537 B17R1.169661 C=CCCC(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100000749702 [0,2,0,0,0,0|0,0,2]=4 3538 B17R1.169661 C=CCNC(=O)N(CC)c1ccc(cc1C)F 512a_100000221679_100020586998 [0,2,0,0,0,0|0,0,2]=4 3539 B17R1.169661 C=CCNC(=O)N(CC)c1ccc(cc1C)F 512a_100020586998_100000221679 [0,2,0,0,0,0|0,0,2]=4 3540 B17R1.169661 CC=CCC(=O)N(CC)c1ccc(cc1C)F 11a_100000221679_100121576822 [0,2,0,0,0,0|0,0,0]=2 3541 B17R1.169661 CC=CCC(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100121576822 [0,2,0,0,0,0|0,0,0]=2 3542 B17R1.169661 CC=CCC(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100121576822 [0,2,0,0,0,0|0,0,0]=2 3543 B17R1.169661 CC=CCC(=O)N(CC)c1ccc(cc1Cl)Cl 11a_100160557746_100121576822 [0,2,0,0,0,0|1,0,0]=3 3544 B17R1.169661 CC=CCC(=O)N(CC)c1ccc(cc1Cl)Cl 1626a_100160557746_100121576822 [0,2,0,0,0,0|1,0,0]=3 3545 B17R1.169661 CCC#CC(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100011827653 [0,2,0,0,0,0|0,0,2]=4 3546 B17R1.169661 CCC=CC(=O)N(CC)c1ccc(cc1C)F 11a_100000221679_100000212282 [0,2,0,0,0,0|0,0,0]=2 3547 B17R1.169661 CCC=CC(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100000212282 [0,2,0,0,0,0|0,0,0]=2 3548 B17R1.169661 CCC=CC(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100000212282 [0,2,0,0,0,0|0,0,0]=2 3549 B17R1.169661 CCC=CC(=O)N(CC)c1ccc(cc1Cl)Cl 11a_100160557746_100000212282 [0,2,0,0,0,0|1,0,0]=3 3550 B17R1.169661 CCC=CC(=O)N(CC)c1ccc(cc1Cl)Cl 1626a_100160557746_100000212282 [0,2,0,0,0,0|1,0,0]=3 3551 B17R1.169661 CCCCC(=O)N(CC)c1ccc(cc1C)F 11a_100000221679_100000210183 [0,2,0,0,0,0|0,0,2]=4 3552 B17R1.169661 CCCCC(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100000210183 [0,2,0,0,0,0|0,0,2]=4 3553 B17R1.169661 CCCCC(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100000210183 [0,2,0,0,0,0|0,0,2]=4 3554 B17R1.169661 CCCNC(=O)N(CC)c1ccc(cc1C)F 512a_100000221679_100020643023 [0,2,0,0,0,0|0,0,2]=4 3555 B17R1.169661 CCCNC(=O)N(CC)c1ccc(cc1C)F 512a_100020643023_100000221679 [0,2,0,0,0,0|0,0,2]=4 3556 B17R1.169661 CCN(C(=O)C=COC)c1ccc(cc1C)F 1626a_100000221679_100016268678 [0,2,0,0,0,0|0,0,0]=2 3557 B17R1.169661 CCN(C(=O)C=COC)c1ccc(cc1C)F 22a_100000221679_100016268678 [0,2,0,0,0,0|0,0,0]=2 3558 B17R1.169661 CCN(C(=O)C=COC)c1ccc(cc1Cl)Cl 1626a_100160557746_100016268678 [0,2,0,0,0,0|1,0,0]=3 3559 B17R1.169661 CCN(C(=O)CCOC)c1ccc(cc1C)F 11a_100000221679_100000749529 [0,2,0,0,0,0|0,0,2]=4 3560 B17R1.169661 CCN(C(=O)CCOC)c1ccc(cc1C)F 1626a_100000221679_100000749529 [0,2,0,0,0,0|0,0,2]=4 3561 B17R1.169661 CCN(C(=O)CCOC)c1ccc(cc1C)F 22a_100000221679_100000749529 [0,2,0,0,0,0|0,0,2]=4 3562 B17R1.169661 CCN(C(=O)CCSC)c1ccc(cc1C)F 11a_100000221679_100000174002 [0,2,0,0,0,0|0,0,2]=4 3563 B17R1.169661 CCN(C(=O)CCSC)c1ccc(cc1C)F 1626a_100000221679_100000174002 [0,2,0,0,0,0|0,0,2]=4 3564 B17R1.169661 CCN(C(=O)CCSC)c1ccc(cc1C)F 22a_100000221679_100000174002 [0,2,0,0,0,0|0,0,2]=4 3565 B17R1.169661 CCN(C(=O)NCCF)c1ccc(cc1C)F 512a_100000221679_100000724931 [0,2,0,0,0,0|1,0,1]=4 3566 B17R1.169661 CCN(C(=O)NCCO)c1ccc(cc1C)F 512a_100000221679_100000210304 [0,2,0,0,0,0|1,0,1]=4 3567 B17R1.169661 CCNNC(=O)N(CC)c1ccc(cc1C)F 512a_100000221679_100000756455 [0,2,0,0,0,0|1,0,1]=4 3568 B17R1.169661 CCNNC(=O)N(CC)c1ccc(cc1C)F 512a_100000756455_100000221679 [0,2,0,0,0,0|1,0,1]=4 3569 B17R1.169661 CCOCC(=O)N(CC)c1ccc(cc1C)F 11a_100000221679_100000211967 [0,2,0,0,0,0|0,0,2]=4 3570 B17R1.169661 CCOCC(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100000211967 [0,2,0,0,0,0|0,0,2]=4 3571 B17R1.169661 CCOCC(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100000211967 [0,2,0,0,0,0|0,0,2]=4 3572 B17R1.169661 CCSCC(=O)N(CC)c1ccc(cc1C)F 11a_100000221679_100000230394 [0,2,0,0,0,0|0,0,2]=4 3573 B17R1.169661 CCSCC(=O)N(CC)c1ccc(cc1C)F 1626a_100000221679_100000230394 [0,2,0,0,0,0|0,0,2]=4 3574 B17R1.169661 CCSCC(=O)N(CC)c1ccc(cc1C)F 22a_100000221679_100000230394 [0,2,0,0,0,0|0,0,2]=4 3575 B17R1.9791 CC=CC(=O)N(CCC#N)c1ccccc1Cl 11a_200000219389_100000210699 [0,2,0,0,0,0|1,0,0]=3 3576 B17R1.9791 CC=CC(=O)N(CCC#N)c1ccccc1Cl 1626a_200000219389_100000210699 [0,2,0,0,0,0|1,0,0]=3 3577 B17R1.9791 CC=CC(=O)N(CCC#N)c1ccccc1F 11a_100000182403_100000210699 [0,2,0,0,0,0|1,0,0]=3 3578 B17R1.9791 CC=CC(=O)N(CCC#N)c1ccccc1F 1626a_100000182403_100000210699 [0,2,0,0,0,0|1,0,0]=3 3579 B17R1.9791 N#CCCN(C(=O)C=CBr)c1ccccc1Cl 1626a_200000219389_100016273825 [0,2,0,0,0,0|2,0,0]=4 3580 B17R1.9791 N#CCCN(C(=O)C=CBr)c1ccccc1F 1626a_100000182403_100016273825 [0,2,0,0,0,0|2,0,0]=4 3581 B17R1.9791 N#CCCN(C(=O)C=CCl)c1ccccc1Cl 11a_200000219389_200016279998 [0,2,0,0,0,0|2,0,0]=4 3582 B17R1.9791 N#CCCN(C(=O)C=CCl)c1ccccc1Cl 1626a_200000219389_200016279998 [0,2,0,0,0,0|2,0,0]=4 3583 B17R1.9791 N#CCCN(C(=O)C=CCl)c1ccccc1F 11a_100000182403_200016279998 [0,2,0,0,0,0|2,0,0]=4 3584 B17R1.9791 N#CCCN(C(=O)C=CCl)c1ccccc1F 1626a_100000182403_200016279998 [0,2,0,0,0,0|2,0,0]=4 3585 B17R1.9791 N#CCCN(C(=O)C=CI)c1ccccc1Cl 1626a_200000219389_100016256311 [0,2,0,0,0,0|2,0,0]=4 3586 B17R1.9791 N#CCCN(C(=O)C=CI)c1ccccc1F 1626a_100000182403_100016256311 [0,2,0,0,0,0|2,0,0]=4 3587 B17R1.125864 CC(C)CN(C(=O)C=CBr)c1ccccc1Cl 1626a_100011231759_100016273825 [0,2,0,0,0,0|2,0,0]=4 3588 B17R1.125864 CC(C)CN(C(=O)C=CCl)c1ccccc1Cl 11a_100011231759_200016279998 [0,2,0,0,0,0|2,0,0]=4 3589 B17R1.125864 CC(C)CN(C(=O)C=CCl)c1ccccc1Cl 1626a_100011231759_200016279998 [0,2,0,0,0,0|2,0,0]=4 3590 B17R1.125864 CC(C)CN(C(=O)C=CI)c1ccccc1Cl 1626a_100011231759_100016256311 [0,2,0,0,0,0|2,0,0]=4 3591 B17R1.125864 CC=CC(=O)N(CC(C)C)c1ccccc1Cl 11a_100011231759_100000210699 [0,2,0,0,0,0|1,0,0]=3 3592 B17R1.125864 CC=CC(=O)N(CC(C)C)c1ccccc1Cl 1626a_100011231759_100000210699 [0,2,0,0,0,0|1,0,0]=3 3593 B17R1.358338 CC=CC(=O)N(CCC)c1ccc(cc1Cl)Br 11a_100102671017_100000210699 [0,2,0,0,0,0|1,0,0]=3 3594 B17R1.358338 CC=CC(=O)N(CCC)c1ccc(cc1Cl)Br 1626a_100102671017_100000210699 [0,2,0,0,0,0|1,0,0]=3 3595 B17R1.358338 CCCN(C(=O)C=CBr)c1ccc(cc1Cl)Br 1626a_100102671017_100016273825 [0,2,0,0,0,0|2,0,0]=4 3596 B17R1.358338 CCCN(C(=O)C=CCl)c1ccc(cc1Cl)Br 11a_100102671017_200016279998 [0,2,0,0,0,0|2,0,0]=4 3597 B17R1.358338 CCCN(C(=O)C=CCl)c1ccc(cc1Cl)Br 1626a_100102671017_200016279998 [0,2,0,0,0,0|2,0,0]=4 3598 B17R1.358338 CCCN(C(=O)C=CI)c1ccc(cc1Cl)Br 1626a_100102671017_100016256311 [0,2,0,0,0,0|2,0,0]=4 3599 B15R1.640 CC=CC(=O)N(CC)Cc1ccccc1 11a_100000186914_100000210699 [0,0,1,1,0,0|0,0,2]=4 3600 B15R1.640 CC=CC(=O)N(CC)Cc1ccccc1 1626a_100000186914_100000210699 [0,0,1,1,0,0|0,0,2]=4 3601 B15R1.640 CC=CC(=O)N(CC)Cc1ccccc1 240690a_100000186914_100000210699 [0,0,1,1,0,0|0,0,2]=4 3602 B15R1.640 CC=CC(=O)N(CC)Cc1ccccn1 11a_100000201164_100000210699 [0,0,1,1,0,0|1,0,1]=4 3603 B15R1.640 CC=CC(=O)N(CC)Cc1ccccn1 1626a_100000201164_100000210699 [0,0,1,1,0,0|1,0,1]=4 3604 B15R1.640 CC=CC(=O)N(CC)Cc1ccccn1 240690a_100000201164_100000210699 [0,0,1,1,0,0|1,0,1]=4 3605 B15R2.73 CNCC(=O)N1CCc2c1cccc2 2230a_106832991635_100000183021 [1,0,0,1,0,0|1,0,1]=4 3606 B15R2.73 CNCC(=O)N1CCc2c1cccc2 34a_100102657272_100000183021 [1,0,0,1,0,0|1,0,1]=4 3607 B15R2.73 CNCC(=O)N1CCc2c1cccc2 7a_106832991635_100000183021 [1,0,0,1,0,0|1,0,1]=4 3608 B15R2.73 COCC(=O)N1CCc2c1cccc2 34a_100138415774_100000183021 [1,0,0,1,0,0|1,0,1]=4 3609 B15R2.73 CSCC(=O)N1CCc2c1cccc2 62a_100000183021_200000210301 [1,0,0,1,0,0|1,0,1]=4 3610 B15R2.73 CSCC(=O)N1CCc2c1cccc2 62a_200000210301_100000183021 [1,0,0,1,0,0|1,0,1]=4 3611 B15R2.73 [13CH3]SCC(=O)N1CCc2c1cccc2 62a_100000183021_200025704644 [1,0,0,1,0,0|1,0,1]=4 3612 B15R2.73 [13CH3]SCC(=O)N1CCc2c1cccc2 62a_200025704644_100000183021 [1,0,0,1,0,0|1,0,1]=4 3613 B15R2.389 CN1CCN(C(=O)C1)c2ccccc2 2230a_100000707252_200000210301 [1,0,0,1,0,0|1,0,1]=4 3614 B15R2.389 CN1CCN(C(=O)C1)c2ccccc2 269982a_100000707252_200000210301 [1,0,0,1,0,0|1,0,1]=4 3615 B15R2.389 [13CH3]N1CCN(C(=O)C1)c2ccccc2 2230a_100000707252_200025704644 [1,0,0,1,0,0|1,0,1]=4 3616 B15R2.389 [13CH3]N1CCN(C(=O)C1)c2ccccc2 269982a_100000707252_200025704644 [1,0,0,1,0,0|1,0,1]=4 3617 B15R2.3870 CCN(C(=O)C1CC1)c2ccccc2 11a_100000210013_100000210395 [1,0,0,1,0,0|0,0,2]=4 3618 B15R2.3870 CCN(C(=O)C1CC1)c2ccccc2 1626a_100000210013_100000210395 [1,0,0,1,0,0|0,0,2]=4 3619 B15R2.3870 CCN(C(=O)C1CC1)c2ccccc2 22a_100000210013_100000210395 [1,0,0,1,0,0|0,0,2]=4 3620 B15R2.3870 CCN(C(=O)C1CO1)c2ccccc2 11a_100000210013_100000701028 [1,0,0,1,0,0|1,0,1]=4 3621 B15R2.3870 CCN(C(=O)C1CO1)c2ccccc2 1626a_100000210013_100000701028 [1,0,0,1,0,0|1,0,1]=4 3622 B15R2.3870 CCN(C(=O)C1CO1)c2ccccc2 22a_100000210013_100000701028 [1,0,0,1,0,0|1,0,1]=4 3623 B15R2.4808 CNC1CCN(C1=O)c2ccccc2 2230a_106832991635_100000754165 [1,0,0,1,0,0|1,0,1]=4 3624 B15R2.4808 CNC1CCN(C1=O)c2ccccc2 2230a_200000754093_200000210301 [1,0,0,1,0,0|1,0,1]=4 3625 B15R2.4808 CNC1CCN(C1=O)c2ccccc2 34a_100102657272_100000754165 [1,0,0,1,0,0|1,0,1]=4 3626 B15R2.4808 CNC1CCN(C1=O)c2ccccc2 34a_200000754093_200000210301 [1,0,0,1,0,0|1,0,1]=4 3627 B15R2.4808 CNC1CCN(C1=O)c2ccccc2 7a_106832991635_100000754165 [1,0,0,1,0,0|1,0,1]=4 3628 B15R2.4808 COC1CCN(C1=O)c2ccccc2 34a_100138415774_100000754165 [1,0,0,1,0,0|1,0,1]=4 3629 B15R2.4808 CSC1CCN(C1=O)c2ccccc2 62a_100000754165_200000210301 [1,0,0,1,0,0|1,0,1]=4 3630 B15R2.4808 CSC1CCN(C1=O)c2ccccc2 62a_200000210301_100000754165 [1,0,0,1,0,0|1,0,1]=4 3631 B15R2.4808 [13CH3]NC1CCN(C1=O)c2ccccc2 2230a_200000754093_200025704644 [1,0,0,1,0,0|1,0,1]=4 3632 B15R2.4808 [13CH3]NC1CCN(C1=O)c2ccccc2 34a_200000754093_200025704644 [1,0,0,1,0,0|1,0,1]=4 3633 B15R2.4808 [13CH3]SC1CCN(C1=O)c2ccccc2 62a_100000754165_200025704644 [1,0,0,1,0,0|1,0,1]=4 3634 B15R2.4808 [13CH3]SC1CCN(C1=O)c2ccccc2 62a_200025704644_100000754165 [1,0,0,1,0,0|1,0,1]=4 3635 B15R2.308 CC1=CCN(CC1)c2ccncc2C 27a_100000693516_100000765111 [1,0,0,1,0,0|1,0,1]=4 3636 B15R2.7441 Cc1ccccc1N(C)C(=O)C2CC2 11a_100000219699_100000210395 [1,0,0,1,0,0|0,0,2]=4 3637 B15R2.7441 Cc1ccccc1N(C)C(=O)C2CC2 1626a_100000219699_100000210395 [1,0,0,1,0,0|0,0,2]=4 3638 B15R2.7441 Cc1ccccc1N(C)C(=O)C2CC2 22a_100000219699_100000210395 [1,0,0,1,0,0|0,0,2]=4 3639 B15R2.7441 Cc1ccccc1N(C)C(=O)C2CO2 11a_100000219699_100000701028 [1,0,0,1,0,0|1,0,1]=4 3640 B15R2.7441 Cc1ccccc1N(C)C(=O)C2CO2 1626a_100000219699_100000701028 [1,0,0,1,0,0|1,0,1]=4 3641 B15R2.7441 Cc1ccccc1N(C)C(=O)C2CO2 22a_100000219699_100000701028 [1,0,0,1,0,0|1,0,1]=4 3642 B15R2.37842 CNC1C(=O)N(c2c1cccc2C)C 34a_200015184559_200000210301 [1,0,0,1,0,0|1,0,1]=4 3643 B15R2.37842 Cc1cccc2c1N(C(=O)C2N[13CH3])C 34a_200015184559_200025704644 [1,0,0,1,0,0|1,0,1]=4 3644 B15R2.79765 CCC(=O)C1CCCc2c1cccc2 1458a_100011198263_100000210202 [1,0,0,1,0,0|1,0,1]=4 3645 B15R2.79765 CNC(=O)C1CCCc2c1cccc2 11a_106832991635_100011198263 [1,0,0,1,0,0|2,0,0]=4 3646 B15R2.79765 CNC(=O)C1CCCc2c1cccc2 1626a_100102657272_100011198263 [1,0,0,1,0,0|2,0,0]=4 3647 B15R2.79765 CNC(=O)C1CCCc2c1cccc2 240690a_100102657272_100011198263 [1,0,0,1,0,0|2,0,0]=4 3648 B15R2.79765 CNC(=O)C1CCCc2c1cccc2 527a_100102657272_100011198263 [1,0,0,1,0,0|2,0,0]=4 3649 B17R2.7864 CCN(c1ccccc1C)C2CCCC2=O 2230a_100000211084_100000211823 [0,0,0,1,0,1|0,0,2]=4 3650 B17R2.7864 CCN(c1ccccc1C)C2CCCC2=O 269982a_100000211084_100000211823 [0,0,0,1,0,1|0,0,2]=4 3651 B17R2.7864 CCN(c1ccccc1C)C2CCCC2=O 34a_100000211084_100000709159 [0,0,0,1,0,1|0,0,2]=4 3652 B17R2.7864 CCN(c1ccccc1C)C2CCOC2=O 2230a_100000211084_100000211211 [0,0,0,1,0,1|1,0,1]=4 3653 B17R2.7864 CCN(c1ccccc1C)C2CCOC2=O 269982a_100000211084_100000211211 [0,0,0,1,0,1|1,0,1]=4 3654 B17R2.7864 CCN(c1ccccc1C)C2CCOC2=O 34a_100000211084_100000211211 [0,0,0,1,0,1|1,0,1]=4 3655 B17R2.48520 CCN(Cc1ccn[nH]1)c2ccccc2C 2230a_100000211084_100000728653 [0,0,0,1,0,1|2,0,0]=4 3656 B17R2.48520 CCN(Cc1ccn[nH]1)c2ccccc2C 269982a_100000211084_100000728653 [0,0,0,1,0,1|2,0,0]=4 3657 B17R2.48520 CCN(Cc1ccn[nH]1)c2ccccc2C 34a_100000211084_100000728653 [0,0,0,1,0,1|2,0,0]=4 3658 B17R2.48520 CCN(Cc1ccon1)c2ccccc2C 2230a_100000211084_100000234950 [0,0,0,1,0,1|2,0,0]=4 3659 B17R2.48520 CCN(Cc1ccon1)c2ccccc2C 269982a_100000211084_100000234950 [0,0,0,1,0,1|2,0,0]=4 3660 B17R2.48520 CCN(Cc1ccon1)c2ccccc2C 34a_100000211084_100000234950 [0,0,0,1,0,1|2,0,0]=4 3661 B17R2.48520 CCN(Cc1ccsc1)c2ccccc2C 2230a_100000211084_100011261437 [0,0,0,1,0,1|2,0,0]=4 3662 B17R2.48520 CCN(Cc1ccsc1)c2ccccc2C 269982a_100000211084_100011233845 [0,0,0,1,0,1|2,0,0]=4 3663 B17R2.48520 CCN(Cc1ccsc1)c2ccccc2C 34a_100000211084_100011261437 [0,0,0,1,0,1|2,0,0]=4 3664 B17R2.49529 CC=CC(=O)N[C@H]1c2ccccc2C[C@H]1O 11a_100000744645_100000210699 [0,0,0,1,0,1|2,0,0]=4 3665 B17R2.49529 CC=CC(=O)N[C@H]1c2ccccc2C[C@H]1O 240690a_100000744645_100000210699 [0,0,0,1,0,1|2,0,0]=4 3666 B17R2.75208 CC=CC(=O)NC1(CC1)c2ccccc2Br 11a_200000691159_100000210699 [0,0,0,1,0,1|2,0,0]=4 3667 B17R2.75208 CC=CC(=O)NC1(CC1)c2ccccc2Br 1626a_200000691159_100000210699 [0,0,0,1,0,1|2,0,0]=4 3668 B17R2.75208 CC=CC(=O)NC1(CC1)c2ccccc2Br 240690a_200000691159_100000210699 [0,0,0,1,0,1|2,0,0]=4 3669 B17R2.75208 CC=CC(=O)NC1(CC1)c2ccccc2Cl 11a_100015187805_100000210699 [0,0,0,1,0,1|2,0,0]=4 3670 B17R2.75208 CC=CC(=O)NC1(CC1)c2ccccc2Cl 1626a_100015187805_100000210699 [0,0,0,1,0,1|2,0,0]=4 3671 B17R2.75208 CC=CC(=O)NC1(CC1)c2ccccc2Cl 240690a_100015187805_100000210699 [0,0,0,1,0,1|2,0,0]=4 3672 B17R2.75208 CC=CC(=O)NC1(CC1)c2ccccc2F 11a_100000757808_100000210699 [0,0,0,1,0,1|2,0,0]=4 3673 B17R2.75208 CC=CC(=O)NC1(CC1)c2ccccc2F 1626a_100000757808_100000210699 [0,0,0,1,0,1|2,0,0]=4 3674 B17R2.75208 CC=CC(=O)NC1(CC1)c2ccccc2F 240690a_100000757808_100000210699 [0,0,0,1,0,1|2,0,0]=4 3675 B17R2.295698 CCN(CC(=O)C1CC1)c2ccccc2C 2230a_100000211084_100000746382 [0,0,0,1,0,1|0,0,2]=4 3676 B17R2.295698 CCN(CC(=O)C1CC1)c2ccccc2C 269982a_100000211084_100000746382 [0,0,0,1,0,1|0,0,2]=4 3677 B17R2.295698 CCN(CC(=O)C1CC1)c2ccccc2C 34a_100000211084_100000746382 [0,0,0,1,0,1|0,0,2]=4 3678 B17R2.322318 CC=CC(=O)NC1CCCc2c1ccnc2 11a_100020634316_100000210699 [0,0,0,1,0,1|2,0,0]=4 3679 B17R2.322318 CC=CC(=O)NC1CCCc2c1ccnc2 1626a_100020634316_100000210699 [0,0,0,1,0,1|2,0,0]=4 3680 B17R2.322318 CC=CC(=O)NC1CCCc2c1ccnc2 240690a_100020634316_100000210699 [0,0,0,1,0,1|2,0,0]=4 3681 B17R2.322318 CC=CC(=O)NC1CCCc2c1nccc2 11a_100011259139_100000210699 [0,0,0,1,0,1|2,0,0]=4 3682 B17R2.322318 CC=CC(=O)NC1CCCc2c1nccc2 1626a_100011259139_100000210699 [0,0,0,1,0,1|2,0,0]=4 3683 B17R2.322318 CC=CC(=O)NC1CCCc2c1nccc2 240690a_100011259139_100000210699 [0,0,0,1,0,1|2,0,0]=4 3684 B17R2.322318 CC=CC(=O)NC1CCOc2c1cccc2 11a_100015190321_100000210699 [0,0,0,1,0,1|2,0,0]=4 3685 B17R2.322318 CC=CC(=O)NC1CCOc2c1cccc2 1626a_100015190321_100000210699 [0,0,0,1,0,1|2,0,0]=4 3686 B17R2.322318 CC=CC(=O)NC1CCOc2c1cccc2 240690a_100015190321_100000210699 [0,0,0,1,0,1|2,0,0]=4 3687 B17R2.322318 CC=CC(=O)N[C@H]1CCCc2c1cccc2 11a_100020654734_100000210699 [0,0,0,1,0,1|1,0,0]=3 3688 B17R2.322318 CC=CC(=O)N[C@H]1CCCc2c1cccc2 1626a_100020654734_100000210699 [0,0,0,1,0,1|1,0,0]=3 3689 B17R2.322318 CC=CC(=O)N[C@H]1CCCc2c1cccc2 240690a_100020654734_100000210699 [0,0,0,1,0,1|1,0,0]=3 3690 B17R2.322318 O=C(C=CBr)N[C@H]1CCCc2c1cccc2 1626a_100020654734_100016273825 [0,0,0,1,0,1|2,0,0]=4 3691 B17R2.322318 O=C(C=CBr)N[C@H]1CCCc2c1cccc2 240690a_100020654734_100016273825 [0,0,0,1,0,1|2,0,0]=4 3692 B17R2.322318 O=C(C=CCl)N[C@H]1CCCc2c1cccc2 11a_100020654734_200016279998 [0,0,0,1,0,1|2,0,0]=4 3693 B17R2.322318 O=C(C=CCl)N[C@H]1CCCc2c1cccc2 1626a_100020654734_200016279998 [0,0,0,1,0,1|2,0,0]=4 3694 B17R2.322318 O=C(C=CCl)N[C@H]1CCCc2c1cccc2 240690a_100020654734_200016279998 [0,0,0,1,0,1|2,0,0]=4 3695 B17R2.322318 O=C(C=CI)N[C@H]1CCCc2c1cccc2 1626a_100020654734_100016256311 [0,0,0,1,0,1|2,0,0]=4 3696 B17R2.443997 CC=CC(=O)NC1CCc2c1c(ccc2)Br 11a_100103168669_100000210699 [0,0,0,1,0,1|2,0,0]=4 3697 B17R2.443997 CC=CC(=O)NC1CCc2c1c(ccc2)Br 1626a_100103168669_100000210699 [0,0,0,1,0,1|2,0,0]=4 3698 B17R2.443997 CC=CC(=O)NC1CCc2c1c(ccc2)Br 240690a_100103168669_100000210699 [0,0,0,1,0,1|2,0,0]=4 3699 B17R2.6202 CC=CC(=O)N1CCc2cccc(c2C1)Br 11a_100000687140_100000210699 [0,0,0,1,0,1|1,0,0]=3 3700 B17R2.6202 CC=CC(=O)N1CCc2cccc(c2C1)Br 1626a_100000687140_100000210699 [0,0,0,1,0,1|1,0,0]=3 3701 B17R2.6202 CC=CC(=O)N1CCc2cccc(c2C1)Br 240690a_100000687140_100000210699 [0,0,0,1,0,1|1,0,0]=3 3702 B17R2.6202 CC=CC(=O)N1CCc2cccc(c2C1)Cl 11a_100011273781_100000210699 [0,0,0,1,0,1|1,0,0]=3 3703 B17R2.6202 CC=CC(=O)N1CCc2cccc(c2C1)Cl 1626a_100011273781_100000210699 [0,0,0,1,0,1|1,0,0]=3 3704 B17R2.6202 CC=CC(=O)N1CCc2cccc(c2C1)Cl 240690a_100011273781_100000210699 [0,0,0,1,0,1|1,0,0]=3 3705 B17R2.6202 CC=CC(=O)N1CCc2cccc(c2C1)F 11a_100000695702_100000210699 [0,0,0,1,0,1|1,0,0]=3 3706 B17R2.6202 CC=CC(=O)N1CCc2cccc(c2C1)F 1626a_100000695702_100000210699 [0,0,0,1,0,1|1,0,0]=3 3707 B17R2.6202 CC=CC(=O)N1CCc2cccc(c2C1)F 240690a_100000695702_100000210699 [0,0,0,1,0,1|1,0,0]=3 3708 B17R2.6202 CC=CC(=O)N1CCc2cccc(c2C1)O 240690a_100016995156_100000210699 [0,0,0,1,0,1|1,0,0]=3 3709 B17R2.6202 O=C(C=CBr)N1CCc2cccc(c2C1)Br 1626a_100000687140_100016273825 [0,0,0,1,0,1|2,0,0]=4 3710 B17R2.6202 O=C(C=CBr)N1CCc2cccc(c2C1)Br 240690a_100000687140_100016273825 [0,0,0,1,0,1|2,0,0]=4 3711 B17R2.6202 O=C(C=CBr)N1CCc2cccc(c2C1)Cl 1626a_100011273781_100016273825 [0,0,0,1,0,1|2,0,0]=4 3712 B17R2.6202 O=C(C=CBr)N1CCc2cccc(c2C1)Cl 240690a_100011273781_100016273825 [0,0,0,1,0,1|2,0,0]=4 3713 B17R2.6202 O=C(C=CBr)N1CCc2cccc(c2C1)F 1626a_100000695702_100016273825 [0,0,0,1,0,1|2,0,0]=4 3714 B17R2.6202 O=C(C=CBr)N1CCc2cccc(c2C1)F 240690a_100000695702_100016273825 [0,0,0,1,0,1|2,0,0]=4 3715 B17R2.6202 O=C(C=CBr)N1CCc2cccc(c2C1)O 240690a_100016995156_100016273825 [0,0,0,1,0,1|2,0,0]=4 3716 B17R2.6202 O=C(C=CCl)N1CCc2cccc(c2C1)Br 11a_100000687140_200016279998 [0,0,0,1,0,1|2,0,0]=4 3717 B17R2.6202 O=C(C=CCl)N1CCc2cccc(c2C1)Br 1626a_100000687140_200016279998 [0,0,0,1,0,1|2,0,0]=4 3718 B17R2.6202 O=C(C=CCl)N1CCc2cccc(c2C1)Br 240690a_100000687140_200016279998 [0,0,0,1,0,1|2,0,0]=4 3719 B17R2.6202 O=C(C=CCl)N1CCc2cccc(c2C1)Cl 11a_100011273781_200016279998 [0,0,0,1,0,1|2,0,0]=4 3720 B17R2.6202 O=C(C=CCl)N1CCc2cccc(c2C1)Cl 1626a_100011273781_200016279998 [0,0,0,1,0,1|2,0,0]=4 3721 B17R2.6202 O=C(C=CCl)N1CCc2cccc(c2C1)Cl 240690a_100011273781_200016279998 [0,0,0,1,0,1|2,0,0]=4 3722 B17R2.6202 O=C(C=CCl)N1CCc2cccc(c2C1)F 11a_100000695702_200016279998 [0,0,0,1,0,1|2,0,0]=4 3723 B17R2.6202 O=C(C=CCl)N1CCc2cccc(c2C1)F 1626a_100000695702_200016279998 [0,0,0,1,0,1|2,0,0]=4 3724 B17R2.6202 O=C(C=CCl)N1CCc2cccc(c2C1)F 240690a_100000695702_200016279998 [0,0,0,1,0,1|2,0,0]=4 3725 B17R2.6202 O=C(C=CCl)N1CCc2cccc(c2C1)O 240690a_100016995156_200016279998 [0,0,0,1,0,1|2,0,0]=4 3726 B17R2.6202 O=C(C=CI)N1CCc2cccc(c2C1)Br 1626a_100000687140_100016256311 [0,0,0,1,0,1|2,0,0]=4 3727 B17R2.6202 O=C(C=CI)N1CCc2cccc(c2C1)Cl 1626a_100011273781_100016256311 [0,0,0,1,0,1|2,0,0]=4 3728 B17R2.6202 O=C(C=CI)N1CCc2cccc(c2C1)F 1626a_100000695702_100016256311 [0,0,0,1,0,1|2,0,0]=4 3729 B17R2.6203 C=CCC(=O)N1CCCc2ccccc2C1 11a_100000059810_100000210193 [0,0,0,1,0,1|0,0,2]=4 3730 B17R2.6203 C=CCC(=O)N1CCCc2ccccc2C1 1626a_100000059810_100000210193 [0,0,0,1,0,1|0,0,2]=4 3731 B17R2.6203 C=CCC(=O)N1CCCc2ccccc2C1 240690a_100000059810_100000210193 [0,0,0,1,0,1|0,0,2]=4 3732 B17R2.6203 C=CCC(=O)N1CCCc2ccccc2C1 527a_100000059810_100000210193 [0,0,0,1,0,1|0,0,2]=4 3733 B17R2.6203 CC=CC(=O)N1CCCc2ccccc2C1 11a_100000059810_100000210699 [0,0,0,1,0,1|0,0,0]=2 3734 B17R2.6203 CC=CC(=O)N1CCCc2ccccc2C1 1626a_100000059810_100000210699 [0,0,0,1,0,1|0,0,0]=2 3735 B17R2.6203 CC=CC(=O)N1CCCc2ccccc2C1 240690a_100000059810_100000210699 [0,0,0,1,0,1|0,0,0]=2 3736 B17R2.6203 CC=CC(=O)N1CCOc2ccccc2C1 11a_100000744108_100000210699 [0,0,0,1,0,1|1,0,0]=3 3737 B17R2.6203 CC=CC(=O)N1CCOc2ccccc2C1 1626a_100000744108_100000210699 [0,0,0,1,0,1|1,0,0]=3 3738 B17R2.6203 CC=CC(=O)N1CCOc2ccccc2C1 240690a_100000744108_100000210699 [0,0,0,1,0,1|1,0,0]=3 3739 B17R2.6203 CCCC(=O)N1CCCc2ccccc2C1 11a_100000059810_100000211992 [0,0,0,1,0,1|0,0,2]=4 3740 B17R2.6203 CCCC(=O)N1CCCc2ccccc2C1 1626a_100000059810_100000211992 [0,0,0,1,0,1|0,0,2]=4 3741 B17R2.6203 CCCC(=O)N1CCCc2ccccc2C1 240690a_100000059810_100000211992 [0,0,0,1,0,1|0,0,2]=4 3742 B17R2.6203 CCCC(=O)N1CCCc2ccccc2C1 527a_100000059810_100000211992 [0,0,0,1,0,1|0,0,2]=4 3743 B17R2.6203 CCNC(=O)N1CCCc2ccccc2C1 2708a_100015525214_100000059810 [0,0,0,1,0,1|1,0,1]=4 3744 B17R2.6203 CCNC(=O)N1CCCc2ccccc2C1 273464a_100015525214_100000059810 [0,0,0,1,0,1|1,0,1]=4 3745 B17R2.6203 COCC(=O)N1CCCc2ccccc2C1 11a_100000059810_100000210968 [0,0,0,1,0,1|1,0,1]=4 3746 B17R2.6203 COCC(=O)N1CCCc2ccccc2C1 1626a_100000059810_100000210968 [0,0,0,1,0,1|1,0,1]=4 3747 B17R2.6203 COCC(=O)N1CCCc2ccccc2C1 240690a_100000059810_100000210968 [0,0,0,1,0,1|1,0,1]=4 3748 B17R2.6203 COCC(=O)N1CCCc2ccccc2C1 527a_100000059810_100000210968 [0,0,0,1,0,1|1,0,1]=4 3749 B17R2.6203 CSCC(=O)N1CCCc2ccccc2C1 11a_100000059810_100000184570 [0,0,0,1,0,1|1,0,1]=4 3750 B17R2.6203 CSCC(=O)N1CCCc2ccccc2C1 1626a_100000059810_100000184570 [0,0,0,1,0,1|1,0,1]=4 3751 B17R2.6203 CSCC(=O)N1CCCc2ccccc2C1 240690a_100000059810_100000184570 [0,0,0,1,0,1|1,0,1]=4 3752 B17R2.6203 CSCC(=O)N1CCCc2ccccc2C1 527a_100000059810_100000184570 [0,0,0,1,0,1|1,0,1]=4 3753 B17R2.6203 O=C(C=CBr)N1CCCc2ccccc2C1 1626a_100000059810_100016273825 [0,0,0,1,0,1|1,0,0]=3 3754 B17R2.6203 O=C(C=CBr)N1CCCc2ccccc2C1 240690a_100000059810_100016273825 [0,0,0,1,0,1|1,0,0]=3 3755 B17R2.6203 O=C(C=CBr)N1CCOc2ccccc2C1 1626a_100000744108_100016273825 [0,0,0,1,0,1|2,0,0]=4 3756 B17R2.6203 O=C(C=CBr)N1CCOc2ccccc2C1 240690a_100000744108_100016273825 [0,0,0,1,0,1|2,0,0]=4 3757 B17R2.6203 O=C(C=CCl)N1CCCc2ccccc2C1 11a_100000059810_200016279998 [0,0,0,1,0,1|1,0,0]=3 3758 B17R2.6203 O=C(C=CCl)N1CCCc2ccccc2C1 1626a_100000059810_200016279998 [0,0,0,1,0,1|1,0,0]=3 3759 B17R2.6203 O=C(C=CCl)N1CCCc2ccccc2C1 240690a_100000059810_200016279998 [0,0,0,1,0,1|1,0,0]=3 3760 B17R2.6203 O=C(C=CCl)N1CCOc2ccccc2C1 11a_100000744108_200016279998 [0,0,0,1,0,1|2,0,0]=4 3761 B17R2.6203 O=C(C=CCl)N1CCOc2ccccc2C1 1626a_100000744108_200016279998 [0,0,0,1,0,1|2,0,0]=4 3762 B17R2.6203 O=C(C=CCl)N1CCOc2ccccc2C1 240690a_100000744108_200016279998 [0,0,0,1,0,1|2,0,0]=4 3763 B17R2.6203 O=C(C=CI)N1CCCc2ccccc2C1 1626a_100000059810_100016256311 [0,0,0,1,0,1|1,0,0]=3 3764 B17R2.6203 O=C(C=CI)N1CCOc2ccccc2C1 1626a_100000744108_100016256311 [0,0,0,1,0,1|2,0,0]=4 3765 B17R2.48606 CCN(Cc1ccccc1C)C(=O)C2CC2 11a_100000201206_100000210395 [0,0,0,1,0,1|0,0,2]=4 3766 B17R2.48606 CCN(Cc1ccccc1C)C(=O)C2CC2 1626a_100000201206_100000210395 [0,0,0,1,0,1|0,0,2]=4 3767 B17R2.48606 CCN(Cc1ccccc1C)C(=O)C2CC2 240690a_100000201206_100000210395 [0,0,0,1,0,1|0,0,2]=4 3768 B17R2.48606 CCN(Cc1ccccc1C)C(=O)C2CC2 527a_100000201206_100000210395 [0,0,0,1,0,1|0,0,2]=4 3769 B17R2.48606 CCN(Cc1ccccc1C)C(=O)C2CO2 11a_100000201206_100000701028 [0,0,0,1,0,1|1,0,1]=4 3770 B17R2.48606 CCN(Cc1ccccc1C)C(=O)C2CO2 1626a_100000201206_100000701028 [0,0,0,1,0,1|1,0,1]=4 3771 B17R2.48606 CCN(Cc1ccccc1C)C(=O)C2CO2 240690a_100000201206_100000701028 [0,0,0,1,0,1|1,0,1]=4 3772 B17R2.48606 CCN(Cc1ccccc1C)C(=O)C2CO2 527a_100000201206_100000701028 [0,0,0,1,0,1|1,0,1]=4 3773 B17R2.7740 CCN(C(=O)C1CC1)c2cccc(c2C)C 11a_100000219776_100000210395 [0,1,0,1,0,0|0,0,2]=4 3774 B17R2.7740 CCN(C(=O)C1CC1)c2cccc(c2C)C 1626a_100000219776_100000210395 [0,1,0,1,0,0|0,0,2]=4 3775 B17R2.7740 CCN(C(=O)C1CC1)c2cccc(c2C)C 22a_100000219776_100000210395 [0,1,0,1,0,0|0,0,2]=4 3776 B17R2.7740 CCN(C(=O)C1CO1)c2cccc(c2C)C 11a_100000219776_100000701028 [0,1,0,1,0,0|1,0,1]=4 3777 B17R2.7740 CCN(C(=O)C1CO1)c2cccc(c2C)C 1626a_100000219776_100000701028 [0,1,0,1,0,0|1,0,1]=4 3778 B17R2.7740 CCN(C(=O)C1CO1)c2cccc(c2C)C 22a_100000219776_100000701028 [0,1,0,1,0,0|1,0,1]=4 3779 B17R2.7169 CC(S[13CH3])C(=O)N1c2ccccc2CC1C 62a_100000183930_200025704644 [0,1,0,1,0,0|1,0,1]=4 3780 B17R2.7169 CC(S[13CH3])C(=O)N1c2ccccc2CC1C 62a_200025704644_100000183930 [0,1,0,1,0,0|1,0,1]=4 3781 B17R2.7169 CC1Cc2ccccc2N1C(=O)C(=O)CF 1458a_200011297242_100015361967 [0,1,0,1,0,0|1,0,1]=4 3782 B17R2.7169 CCC(=O)C(=O)N1c2ccccc2CC1C 1458a_200011297242_100000210202 [0,1,0,1,0,0|0,0,1]=3 3783 B17R2.7169 CNC(=O)C(=O)N1c2ccccc2CC1C 1626a_100102657272_200011297242 [0,1,0,1,0,0|1,0,0]=3 3784 B17R2.7169 CNC(=O)C(=O)N1c2ccccc2CC1C 240690a_100102657272_200011297242 [0,1,0,1,0,0|1,0,0]=3 3785 B17R2.7169 CNC(=O)C(=O)N1c2ccccc2CC1C 527a_100102657272_200011297242 [0,1,0,1,0,0|1,0,0]=3 3786 B17R2.7169 CNC(C)C(=O)N1c2ccccc2CC1C 2230a_106832991635_100000183930 [0,1,0,1,0,0|1,0,1]=4 3787 B17R2.7169 CNC(C)C(=O)N1c2ccccc2CC1C 34a_100102657272_100000183930 [0,1,0,1,0,0|1,0,1]=4 3788 B17R2.7169 CNC(C)C(=O)N1c2ccccc2CC1C 7a_106832991635_100000183930 [0,1,0,1,0,0|1,0,1]=4 3789 B17R2.7169 COC(C)C(=O)N1c2ccccc2CC1C 34a_100138415774_100000183930 [0,1,0,1,0,0|1,0,1]=4 3790 B17R2.7169 CSC(C)C(=O)N1c2ccccc2CC1C 62a_100000183930_200000210301 [0,1,0,1,0,0|1,0,1]=4 3791 B17R2.7169 CSC(C)C(=O)N1c2ccccc2CC1C 62a_200000210301_100000183930 [0,1,0,1,0,0|1,0,1]=4 3792 B17R2.7877 CCN(C(=O)C1CC1C)c2ccccc2C 11a_100000211084_100000211227 [0,1,0,1,0,0|0,0,2]=4 3793 B17R2.7877 CCN(C(=O)C1CC1C)c2ccccc2C 1626a_100000211084_100000211227 [0,1,0,1,0,0|0,0,2]=4 3794 B17R2.7877 CCN(C(=O)C1CC1C)c2ccccc2C 22a_100000211084_100000211227 [0,1,0,1,0,0|0,0,2]=4 3795 B17R2.7877 CCN(C(=O)[C@@H]1C[C@@H]1F)c2ccccc2C 11a_100000211084_100015396687 [0,1,0,1,0,0|0,0,2]=4 3796 B17R2.7877 CCN(C(=O)[C@@H]1C[C@@H]1F)c2ccccc2C 22a_100000211084_100015396687 [0,1,0,1,0,0|0,0,2]=4 3797 B17R2.449490 CC(S[13CH3])C(=O)N1CCCc2c1cccc2 62a_100000184320_200025704644 [0,1,0,1,0,0|1,0,1]=4 3798 B17R2.449490 CC(S[13CH3])C(=O)N1CCCc2c1cccc2 62a_200025704644_100000184320 [0,1,0,1,0,0|1,0,1]=4 3799 B17R2.449490 CCC(=O)C(=O)N1CCCc2c1cccc2 1458a_100011297286_100000210202 [0,1,0,1,0,0|0,0,1]=3 3800 B17R2.449490 CNC(=O)C(=O)N1CCCc2c1cccc2 240690a_100102657272_100011297286 [0,1,0,1,0,0|1,0,0]=3 3801 B17R2.449490 CNC(=O)C(=O)N1CCCc2c1cccc2 527a_100102657272_100011297286 [0,1,0,1,0,0|1,0,0]=3 3802 B17R2.449490 CNC(C)C(=O)N1CCCc2c1cccc2 2230a_106832991635_100000184320 [0,1,0,1,0,0|1,0,1]=4 3803 B17R2.449490 CNC(C)C(=O)N1CCCc2c1cccc2 34a_100102657272_100000184320 [0,1,0,1,0,0|1,0,1]=4 3804 B17R2.449490 CNC(C)C(=O)N1CCCc2c1cccc2 7a_106832991635_100000184320 [0,1,0,1,0,0|1,0,1]=4 3805 B17R2.449490 COC(C)C(=O)N1CCCc2c1cccc2 34a_100138415774_100000184320 [0,1,0,1,0,0|1,0,1]=4 3806 B17R2.449490 CSC(C)C(=O)N1CCCc2c1cccc2 62a_100000184320_200000210301 [0,1,0,1,0,0|1,0,1]=4 3807 B17R2.449490 CSC(C)C(=O)N1CCCc2c1cccc2 62a_200000210301_100000184320 [0,1,0,1,0,0|1,0,1]=4 3808 B17R2.449490 O=C(CF)C(=O)N1CCCc2c1cccc2 1458a_100011297286_100015361967 [0,1,0,1,0,0|1,0,1]=4 3809 B17R2.455535 CCN(C(=O)C1CCC1)c2ccccc2C 11a_100000211084_100000209988 [0,1,0,1,0,0|0,0,2]=4 3810 B17R2.455535 CCN(C(=O)C1CCC1)c2ccccc2C 1626a_100000211084_100000209988 [0,1,0,1,0,0|0,0,2]=4 3811 B17R2.455535 CCN(C(=O)C1CCC1)c2ccccc2C 22a_100000211084_100000209988 [0,1,0,1,0,0|0,0,2]=4 3812 B17R2.455535 CCN(C(=O)C1CCO1)c2ccccc2C 11a_100000211084_100000089072 [0,1,0,1,0,0|0,0,2]=4 3813 B17R2.455535 CCN(C(=O)C1CCO1)c2ccccc2C 1626a_100000211084_100000089072 [0,1,0,1,0,0|0,0,2]=4 3814 B17R2.455535 CCN(C(=O)C1CCO1)c2ccccc2C 22a_100000211084_100000089072 [0,1,0,1,0,0|0,0,2]=4 3815 B17R2.455535 CCN(C(=O)C1COC1)c2ccccc2C 11a_100000211084_100000758290 [0,1,0,1,0,0|0,0,2]=4 3816 B17R2.455535 CCN(C(=O)C1COC1)c2ccccc2C 1626a_100000211084_100000758290 [0,1,0,1,0,0|0,0,2]=4 3817 B17R2.455535 CCN(C(=O)C1COC1)c2ccccc2C 22a_100000211084_100000758290 [0,1,0,1,0,0|0,0,2]=4 3818 B17R2.455536 CCN(C(=O)C1(CC1)C)c2ccccc2C 11a_100000211084_100000756474 [0,1,0,1,0,0|0,0,2]=4 3819 B17R2.455536 CCN(C(=O)C1(CC1)C)c2ccccc2C 1626a_100000211084_100000756474 [0,1,0,1,0,0|0,0,2]=4 3820 B17R2.455536 CCN(C(=O)C1(CC1)C)c2ccccc2C 22a_100000211084_100000756474 [0,1,0,1,0,0|0,0,2]=4 3821 B17R2.455536 CCN(C(=O)C1(CC1)F)c2ccccc2C 11a_100000211084_100000055089 [0,1,0,1,0,0|0,0,2]=4 3822 B17R2.455536 CCN(C(=O)C1(CC1)F)c2ccccc2C 1626a_100000211084_100000055089 [0,1,0,1,0,0|0,0,2]=4 3823 B17R2.455536 CCN(C(=O)C1(CC1)F)c2ccccc2C 22a_100000211084_100000055089 [0,1,0,1,0,0|0,0,2]=4 3824 B17R2.455536 CCN(C(=O)C1(CC1)O)c2ccccc2C 22a_100000211084_100000241761 [0,1,0,1,0,0|0,0,2]=4 3825 B17R2.5002 CC(=O)CC(=O)N1c2ccccc2CC1C 1458a_100000070787_100000183016 [0,1,0,1,0,0|0,0,1]=3 3826 B17R2.5002 CC1Cc2ccccc2N1C(=O)CN(C)C 2230a_100102631434_100000183016 [0,1,0,1,0,0|1,0,1]=4 3827 B17R2.5002 CC1Cc2ccccc2N1C(=O)CN(C)C 269982a_100102631434_100000183016 [0,1,0,1,0,0|1,0,1]=4 3828 B17R2.7555 CCN(c1nc(ns1)C)c2ccccc2C 27a_100000211084_100000709739 [0,1,0,1,0,0|1,1,0]=4 3829 B17R2.7555 CCN(c1nnc(o1)C)c2ccccc2C 27a_100000211084_100000708914 [0,1,0,1,0,0|1,0,1]=4 3830 B17R2.7555 CCN(c1nnc(s1)C)c2ccccc2C 27a_100000211084_100000686958 [0,1,0,1,0,0|1,1,0]=4 3831 B17R2.7555 CCN(c1noc(n1)C)c2ccccc2C 27a_100000211084_100012003639 [0,1,0,1,0,0|1,0,1]=4 3832 B17R2.20674 CC(=O)C1CCN(C1=O)c2ccccc2C 1458a_200011210746_200000210301 [0,1,0,1,0,0|0,0,1]=3 3833 B17R2.20674 CC(=O)C1CCN(C1=O)c2ccccc2F 1458a_200011210741_200000210301 [0,1,0,1,0,0|1,0,1]=4 3834 B17R2.20674 Cc1ccccc1N2CCC(C2=O)C(=O)[13CH3] 1458a_200011210746_200025704644 [0,1,0,1,0,0|0,0,1]=3 3835 B17R2.20674 [13CH3]C(=O)C1CCN(C1=O)c2ccccc2F 1458a_200011210741_200025704644 [0,1,0,1,0,0|1,0,1]=4 3836 B17R2.91528 CCN(C(=O)CC1CC1)c2ccccc2C 11a_100000211084_100000738066 [0,1,0,1,0,0|0,0,2]=4 3837 B17R2.91528 CCN(C(=O)CC1CC1)c2ccccc2C 1626a_100000211084_100000738066 [0,1,0,1,0,0|0,0,2]=4 3838 B17R2.91528 CCN(C(=O)CC1CC1)c2ccccc2C 22a_100000211084_100000738066 [0,1,0,1,0,0|0,0,2]=4 3839 B17R2.91528 CCN(C(=O)NC1CC1)c2ccccc2C 512a_100000212008_100000211084 [0,1,0,1,0,0|0,0,2]=4 3840 B17R2.712041 C=C(C)CC(=O)C1CCCc2c1cccc2 1458a_100011198263_100000748629 [0,1,0,1,0,0|1,0,1]=4 3841 B17R2.712041 CC(=O)CC(=O)N1CCCc2c1cccc2 1458a_100000070787_100000183537 [0,1,0,1,0,0|0,0,1]=3 3842 B17R2.712041 CC(=O)CC(=O)N1CCOc2c1cccc2 1458a_100000070787_100011294157 [0,1,0,1,0,0|1,0,1]=4 3843 B17R2.712041 CC(=O)CC(=O)N1CCSc2c1cccc2 1458a_100000070787_100000198521 [0,1,0,1,0,0|1,0,1]=4 3844 B17R2.712041 CN(C)CC(=O)N1CCCc2c1cccc2 2230a_100102631434_100000183537 [0,1,0,1,0,0|1,0,1]=4 3845 B17R2.712041 CN(C)CC(=O)N1CCCc2c1cccc2 269982a_100102631434_100000183537 [0,1,0,1,0,0|1,0,1]=4 3846 B17R2.2274 CCN(c1ccccc1C)C2C=CCCC2 2230a_100000211084_100000751183 [0,1,0,1,0,0|1,0,1]=4 3847 B17R2.2274 CCN(c1ccccc1C)C2C=CCCC2 269982a_100000211084_100000751183 [0,1,0,1,0,0|1,0,1]=4 3848 B17R2.2274 CCN(c1cccnn1)c2ccccc2C 27a_100000211084_100016991348 [0,1,0,1,0,0|1,0,1]=4 3849 B17R2.2274 CCN(c1ccncn1)c2ccccc2C 27a_100000211084_100000703185 [0,1,0,1,0,0|1,0,1]=4 3850 B17R2.2274 CCN(c1cnccn1)c2ccccc2C 27a_100000211084_100000211759 [0,1,0,1,0,0|1,0,1]=4 3851 B17R2.2274 CCN(c1ncccn1)c2ccccc2C 27a_100000211084_100000211032 [0,1,0,1,0,0|1,0,1]=4 3852 B17R2.37131 Cc1ccccc1N(C(=O)C2CC2)C(C)C 11a_100000219700_100000210395 [0,1,0,1,0,0|0,0,2]=4 3853 B17R2.37131 Cc1ccccc1N(C(=O)C2CC2)C(C)C 1626a_100000219700_100000210395 [0,1,0,1,0,0|0,0,2]=4 3854 B17R2.37131 Cc1ccccc1N(C(=O)C2CO2)C(C)C 11a_100000219700_100000701028 [0,1,0,1,0,0|1,0,1]=4 3855 B17R2.37131 Cc1ccccc1N(C(=O)C2CO2)C(C)C 1626a_100000219700_100000701028 [0,1,0,1,0,0|1,0,1]=4 3856 B17R2.50138 CC1CCc2ccccc2N1C(=O)CS[13CH3] 62a_100000239582_200025704644 [0,1,0,1,0,0|1,0,1]=4 3857 B17R2.50138 CC1CCc2ccccc2N1C(=O)CS[13CH3] 62a_200025704644_100000239582 [0,1,0,1,0,0|1,0,1]=4 3858 B17R2.50138 CNCC(=O)N1c2ccccc2CCC1C 2230a_106832991635_100000239582 [0,1,0,1,0,0|1,0,1]=4 3859 B17R2.50138 CNCC(=O)N1c2ccccc2CCC1C 34a_100102657272_100000239582 [0,1,0,1,0,0|1,0,1]=4 3860 B17R2.50138 CNCC(=O)N1c2ccccc2CCC1C 7a_106832991635_100000239582 [0,1,0,1,0,0|1,0,1]=4 3861 B17R2.50138 COCC(=O)N1c2ccccc2CCC1C 34a_100138415774_100000239582 [0,1,0,1,0,0|1,0,1]=4 3862 B17R2.50138 CSCC(=O)N1c2ccccc2CCC1C 62a_100000239582_200000210301 [0,1,0,1,0,0|1,0,1]=4 3863 B17R2.50138 CSCC(=O)N1c2ccccc2CCC1C 62a_200000210301_100000239582 [0,1,0,1,0,0|1,0,1]=4 3864 B17R2.7503 CCN(C(=O)C1CC1)c2cc(ccc2C)C 11a_100000743043_100000210395 [0,1,0,1,0,0|0,0,2]=4 3865 B17R2.7503 CCN(C(=O)C1CC1)c2cc(ccc2C)C 1626a_100000743043_100000210395 [0,1,0,1,0,0|0,0,2]=4 3866 B17R2.7503 CCN(C(=O)C1CC1)c2cc(ccc2C)C 22a_100000743043_100000210395 [0,1,0,1,0,0|0,0,2]=4 3867 B17R2.7503 CCN(C(=O)C1CO1)c2cc(ccc2C)C 11a_100000743043_100000701028 [0,1,0,1,0,0|1,0,1]=4 3868 B17R2.7503 CCN(C(=O)C1CO1)c2cc(ccc2C)C 1626a_100000743043_100000701028 [0,1,0,1,0,0|1,0,1]=4 3869 B17R2.7503 CCN(C(=O)C1CO1)c2cc(ccc2C)C 22a_100000743043_100000701028 [0,1,0,1,0,0|1,0,1]=4 3870 B17R2.62886 CCN(C(=O)C1CC1)c2ccccc2OC 11a_100020603010_100000210395 [0,1,0,1,0,0|0,0,2]=4 3871 B17R2.62886 CCN(C(=O)C1CC1)c2ccccc2OC 1626a_100020603010_100000210395 [0,1,0,1,0,0|0,0,2]=4 3872 B17R2.62886 CCN(C(=O)C1CC1)c2ccccc2OC 22a_100020603010_100000210395 [0,1,0,1,0,0|0,0,2]=4 3873 B17R2.62886 CCN(C(=O)C1CO1)c2ccccc2OC 11a_100020603010_100000701028 [0,1,0,1,0,0|1,0,1]=4 3874 B17R2.62886 CCN(C(=O)C1CO1)c2ccccc2OC 1626a_100020603010_100000701028 [0,1,0,1,0,0|1,0,1]=4 3875 B17R2.62886 CCN(C(=O)C1CO1)c2ccccc2OC 22a_100020603010_100000701028 [0,1,0,1,0,0|1,0,1]=4 3876 B17R2.74748 CC1Cc2ccccc2N1C(=O)CSCF 62a_100000183016_100015361967 [0,1,0,1,0,0|1,0,1]=4 3877 B17R2.74748 CC1Cc2ccccc2N1C(=O)CSCF 62a_100015361967_100000183016 [0,1,0,1,0,0|1,0,1]=4 3878 B17R2.74748 CCNCC(=O)N1c2ccccc2CC1C 2230a_100015525214_100000183016 [0,1,0,1,0,0|0,0,2]=4 3879 B17R2.74748 CCOCC(=O)N1c2ccccc2CC1C 34a_100121572206_100000183016 [0,1,0,1,0,0|0,0,2]=4 3880 B17R2.74748 CCSCC(=O)N1c2ccccc2CC1C 62a_100000183016_100000210202 [0,1,0,1,0,0|0,0,2]=4 3881 B17R2.74748 CCSCC(=O)N1c2ccccc2CC1C 62a_100000210202_100000183016 [0,1,0,1,0,0|0,0,2]=4 3882 B17R2.74780 C/C=C/CC(=O)C1(CC1)c2ccccc2Br 1458a_100000707476_100102629194 [0,1,0,1,0,0|2,0,0]=4 3883 B17R2.74780 C/C=C/CC(=O)C1(CC1)c2ccccc2Cl 1458a_100011549969_100102629194 [0,1,0,1,0,0|2,0,0]=4 3884 B17R2.74780 C/C=C/CC(=O)C1(CC1)c2ccccc2F 1458a_100000757711_100102629194 [0,1,0,1,0,0|2,0,0]=4 3885 B17R2.74780 CC=CCC(=O)C1(CC1)c2ccccc2Br 1458a_100000707476_100000070051 [0,1,0,1,0,0|2,0,0]=4 3886 B17R2.74780 CC=CCC(=O)C1(CC1)c2ccccc2Cl 1458a_100011549969_100000070051 [0,1,0,1,0,0|2,0,0]=4 3887 B17R2.74780 CC=CCC(=O)C1(CC1)c2ccccc2F 1458a_100000757711_100000070051 [0,1,0,1,0,0|2,0,0]=4 3888 B17R2.440810 C/C=C/CC(=O)C1CCCc2c1cccc2 1458a_100011198263_100102629194 [0,1,0,1,0,0|1,0,0]=3 3889 B17R2.440810 C/C=C/CC(=O)C1OCCc2c1cccc2 1458a_100000026751_100102629194 [0,1,0,1,0,0|2,0,0]=4 3890 B17R2.440810 CC=CCC(=O)C1CCCc2c1cccc2 1458a_100011198263_100000070051 [0,1,0,1,0,0|1,0,0]=3 3891 B17R2.440810 CC=CCC(=O)C1OCCc2c1cccc2 1458a_100000026751_100000070051 [0,1,0,1,0,0|2,0,0]=4 3892 B17R2.440810 CCNCC(=O)N1CCCc2c1cccc2 2230a_100000744866_100000210202 [0,1,0,1,0,0|0,0,2]=4 3893 B17R2.440810 CCNCC(=O)N1CCCc2c1cccc2 2230a_100015525214_100000183537 [0,1,0,1,0,0|0,0,2]=4 3894 B17R2.440810 CCOCC(=O)N1CCCc2c1cccc2 34a_100121572206_100000183537 [0,1,0,1,0,0|0,0,2]=4 3895 B17R2.440810 CCSCC(=O)N1CCCc2c1cccc2 62a_100000183537_100000210202 [0,1,0,1,0,0|0,0,2]=4 3896 B17R2.440810 CCSCC(=O)N1CCCc2c1cccc2 62a_100000210202_100000183537 [0,1,0,1,0,0|0,0,2]=4 3897 B17R2.440810 CNCCC(=O)N1CCCc2c1cccc2 2230a_100000740918_200000210301 [0,1,0,1,0,0|0,0,2]=4 3898 B17R2.440810 CNCCC(=O)N1CCCc2c1cccc2 2230a_106832991635_200011194607 [0,1,0,1,0,0|0,0,2]=4 3899 B17R2.440810 CNCCC(=O)N1CCCc2c1cccc2 34a_100102657272_200011194607 [0,1,0,1,0,0|0,0,2]=4 3900 B17R2.440810 CNCCC(=O)N1CCCc2c1cccc2 7a_106832991635_200011194607 [0,1,0,1,0,0|0,0,2]=4 3901 B17R2.440810 COCCC(=O)N1CCCc2c1cccc2 34a_100138415774_200011194607 [0,1,0,1,0,0|0,0,2]=4 3902 B17R2.440810 CSCCC(=O)N1CCCc2c1cccc2 62a_200000210301_200011194607 [0,1,0,1,0,0|0,0,2]=4 3903 B17R2.440810 CSCCC(=O)N1CCCc2c1cccc2 62a_200011194607_200000210301 [0,1,0,1,0,0|0,0,2]=4 3904 B17R2.440810 O=C(CSCF)N1CCCc2c1cccc2 62a_100000183537_100015361967 [0,1,0,1,0,0|1,0,1]=4 3905 B17R2.440810 O=C(CSCF)N1CCCc2c1cccc2 62a_100015361967_100000183537 [0,1,0,1,0,0|1,0,1]=4 3906 B17R2.440810 [13CH3]NCCC(=O)N1CCCc2c1cccc2 2230a_100000740918_200025704644 [0,1,0,1,0,0|0,0,2]=4 3907 B17R2.440810 [13CH3]SCCC(=O)N1CCCc2c1cccc2 62a_200011194607_200025704644 [0,1,0,1,0,0|0,0,2]=4 3908 B17R2.440810 [13CH3]SCCC(=O)N1CCCc2c1cccc2 62a_200025704644_200011194607 [0,1,0,1,0,0|0,0,2]=4 3909 B17R2.49958 CNCC(=O)N1CCCc2c1ccc(c2)C 2230a_106832991635_100011214760 [0,1,0,1,0,0|1,0,1]=4 3910 B17R2.49958 CNCC(=O)N1CCCc2c1ccc(c2)C 34a_100102657272_100011214760 [0,1,0,1,0,0|1,0,1]=4 3911 B17R2.49958 CNCC(=O)N1CCCc2c1ccc(c2)C 7a_106832991635_100011214760 [0,1,0,1,0,0|1,0,1]=4 3912 B17R2.49958 COCC(=O)N1CCCc2c1ccc(c2)C 34a_100138415774_100011214760 [0,1,0,1,0,0|1,0,1]=4 3913 B17R2.49958 CSCC(=O)N1CCCc2c1ccc(c2)C 62a_100011214760_200000210301 [0,1,0,1,0,0|1,0,1]=4 3914 B17R2.49958 CSCC(=O)N1CCCc2c1ccc(c2)C 62a_200000210301_100011214760 [0,1,0,1,0,0|1,0,1]=4 3915 B17R2.49958 Cc1ccc2c(c1)CCCN2C(=O)CS[13CH3] 62a_100011214760_200025704644 [0,1,0,1,0,0|1,0,1]=4 3916 B17R2.49958 Cc1ccc2c(c1)CCCN2C(=O)CS[13CH3] 62a_200025704644_100011214760 [0,1,0,1,0,0|1,0,1]=4 3917 B17R2.454903 CCN(C(=O)C1CC1)c2ccc(cc2C)F 11a_100000221679_100000210395 [0,1,0,1,0,0|0,0,2]=4 3918 B17R2.454903 CCN(C(=O)C1CC1)c2ccc(cc2C)F 1626a_100000221679_100000210395 [0,1,0,1,0,0|0,0,2]=4 3919 B17R2.454903 CCN(C(=O)C1CC1)c2ccc(cc2C)F 22a_100000221679_100000210395 [0,1,0,1,0,0|0,0,2]=4 3920 B17R2.454903 CCN(C(=O)C1CO1)c2ccc(cc2C)F 11a_100000221679_100000701028 [0,1,0,1,0,0|1,0,1]=4 3921 B17R2.454903 CCN(C(=O)C1CO1)c2ccc(cc2C)F 1626a_100000221679_100000701028 [0,1,0,1,0,0|1,0,1]=4 3922 B17R2.454903 CCN(C(=O)C1CO1)c2ccc(cc2C)F 22a_100000221679_100000701028 [0,1,0,1,0,0|1,0,1]=4 3923 B15R1.1257 C=COC(=O)CN(CC)c1ccccc1 2230a_100000210013_100000036128 [1,0,0,0,0,1|1,0,1]=4 3924 B15R1.1257 C=COC(=O)CN(CC)c1ccccc1 269982a_100000210013_100000036128 [1,0,0,0,0,1|1,0,1]=4 3925 B15R1.1257 C=COC(=O)CN(CC)c1ccccc1 34a_100000210013_100000036128 [1,0,0,0,0,1|1,0,1]=4 3926 B15R1.1257 CC=CC(=O)NC(CC)c1ccccc1 11a_100000737752_100000210699 [1,0,0,0,0,1|1,0,0]=3 3927 B15R1.1257 CC=CC(=O)NC(CC)c1ccccc1 1626a_100000737752_100000210699 [1,0,0,0,0,1|1,0,0]=3 3928 B15R1.1257 CC=CC(=O)NC(CC)c1ccccc1 240690a_100000737752_100000210699 [1,0,0,0,0,1|1,0,0]=3 3929 B15R1.1257 CC=CC(=O)NC(CC)c1ccccn1 11a_100015186561_100000210699 [1,0,0,0,0,1|2,0,0]=4 3930 B15R1.1257 CC=CC(=O)NC(CC)c1ccccn1 1626a_100015186561_100000210699 [1,0,0,0,0,1|2,0,0]=4 3931 B15R1.1257 CC=CC(=O)NC(CC)c1ccccn1 240690a_100015186561_100000210699 [1,0,0,0,0,1|2,0,0]=4 3932 B15R1.1257 CC=CC(=O)NC(CC)c1cccnc1 11a_100000246009_100000210699 [1,0,0,0,0,1|2,0,0]=4 3933 B15R1.1257 CC=CC(=O)NC(CC)c1cccnc1 1626a_100000246009_100000210699 [1,0,0,0,0,1|2,0,0]=4 3934 B15R1.1257 CC=CC(=O)NC(CC)c1cccnc1 240690a_100000246009_100000210699 [1,0,0,0,0,1|2,0,0]=4 3935 B15R1.1257 CC=CC(=O)NC(CC)c1ccncc1 11a_100000246010_100000210699 [1,0,0,0,0,1|2,0,0]=4 3936 B15R1.1257 CC=CC(=O)NC(CC)c1ccncc1 1626a_100000246010_100000210699 [1,0,0,0,0,1|2,0,0]=4 3937 B15R1.1257 CC=CC(=O)NC(CC)c1ccncc1 240690a_100000246010_100000210699 [1,0,0,0,0,1|2,0,0]=4 3938 B15R1.1257 CC=CC(=O)N[C@H](CO)c1ccccc1 240690a_100000751927_100000210699 [1,0,0,0,0,1|2,0,0]=4 3939 B15R1.1257 CCC(NC(=O)C=CBr)c1ccccc1 1626a_100000737752_100016273825 [1,0,0,0,0,1|2,0,0]=4 3940 B15R1.1257 CCC(NC(=O)C=CBr)c1ccccc1 240690a_100000737752_100016273825 [1,0,0,0,0,1|2,0,0]=4 3941 B15R1.1257 CCC(NC(=O)C=CCl)c1ccccc1 11a_100000737752_200016279998 [1,0,0,0,0,1|2,0,0]=4 3942 B15R1.1257 CCC(NC(=O)C=CCl)c1ccccc1 1626a_100000737752_200016279998 [1,0,0,0,0,1|2,0,0]=4 3943 B15R1.1257 CCC(NC(=O)C=CCl)c1ccccc1 240690a_100000737752_200016279998 [1,0,0,0,0,1|2,0,0]=4 3944 B15R1.1257 CCC(NC(=O)C=CI)c1ccccc1 1626a_100000737752_100016256311 [1,0,0,0,0,1|2,0,0]=4 3945 B15R1.1257 CCCC(=O)CN(CC)c1ccccc1 2230a_100000210013_100000747444 [1,0,0,0,0,1|0,0,2]=4 3946 B15R1.1257 CCCC(=O)CN(CC)c1ccccc1 269982a_100000210013_100000747444 [1,0,0,0,0,1|0,0,2]=4 3947 B15R1.1257 CCNC(=O)CN(CC)c1ccccc1 2230a_100000210013_100000183381 [1,0,0,0,0,1|1,0,1]=4 3948 B15R1.1257 CCNC(=O)CN(CC)c1ccccc1 269982a_100000210013_100000183381 [1,0,0,0,0,1|1,0,1]=4 3949 B15R1.1257 CCNC(=O)CN(CC)c1ccccc1 34a_100000210013_100000183381 [1,0,0,0,0,1|1,0,1]=4 3950 B15R1.1257 CCOC(=O)CN(CC)c1ccccc1 2230a_100000210013_100000188475 [1,0,0,0,0,1|1,0,1]=4 3951 B15R1.1257 CCOC(=O)CN(CC)c1ccccc1 2230a_100000219562_100000210202 [1,0,0,0,0,1|1,0,1]=4 3952 B15R1.1257 CCOC(=O)CN(CC)c1ccccc1 269982a_100000210013_100000188475 [1,0,0,0,0,1|1,0,1]=4 3953 B15R1.1257 CCOC(=O)CN(CC)c1ccccc1 269982a_100000219562_100000204670 [1,0,0,0,0,1|1,0,1]=4 3954 B15R1.1257 CCOC(=O)CN(CC)c1ccccc1 34a_100000210013_100000188475 [1,0,0,0,0,1|1,0,1]=4 3955 B15R1.3509 C/C=C/CN(CC)Cc1ccccc1C 269982a_100000201206_100102629194 [1,0,0,0,0,1|0,0,1]=3 3956 B15R1.3509 C/C=C/CN(CC)Cc1ccccc1Cl 269982a_100000201176_100102629194 [1,0,0,0,0,1|1,0,1]=4 3957 B15R1.3509 C/C=C/CN(CC)Cc1ccccc1F 269982a_100015186831_100102629194 [1,0,0,0,0,1|1,0,1]=4 3958 B15R1.3509 C/C=C/CN(CC)Cc1ccccc1F 34a_100015186831_100102629194 [1,0,0,0,0,1|1,0,1]=4 3959 B15R1.3509 C/C=C/CN(CC)Cc1ccccc1O 269982a_100011223546_100102629194 [1,0,0,0,0,1|1,0,1]=4 3960 B15R1.3509 CC=CCN(CC)Cc1ccccc1C 2230a_100000201206_100000070051 [1,0,0,0,0,1|0,0,1]=3 3961 B15R1.3509 CC=CCN(CC)Cc1ccccc1Cl 2230a_100000201176_100000070051 [1,0,0,0,0,1|1,0,1]=4 3962 B15R1.3509 CC=CCN(CC)Cc1ccccc1F 2230a_100015186831_100000070051 [1,0,0,0,0,1|1,0,1]=4 3963 B15R1.3509 CC=CCN(CC)Cc1ccccc1F 34a_100015186831_100000070051 [1,0,0,0,0,1|1,0,1]=4 3964 B15R1.3509 CC=CCN(CC)Cc1ccccc1O 2230a_100011223546_100000070051 [1,0,0,0,0,1|1,0,1]=4 3965 B15R1.3722 C=COC(=O)CN(C)c1ccccc1C 2230a_100000219699_100000036128 [1,0,0,0,0,1|1,0,1]=4 3966 B15R1.3722 C=COC(=O)CN(C)c1ccccc1C 269982a_100000219699_100000036128 [1,0,0,0,0,1|1,0,1]=4 3967 B15R1.3722 C=COC(=O)CN(C)c1ccccc1C 34a_100000219699_100000036128 [1,0,0,0,0,1|1,0,1]=4 3968 B15R1.3722 CC=CC(=O)CC(=O)c1ccccc1C 1458a_100000210699_100000741374 [1,0,0,0,0,1|2,0,0]=4 3969 B15R1.3722 CC=CC(=O)NC(C)c1ccccc1Br 11a_100000181357_100000210699 [1,0,0,0,0,1|2,0,0]=4 3970 B15R1.3722 CC=CC(=O)NC(C)c1ccccc1Br 1626a_100000181357_100000210699 [1,0,0,0,0,1|2,0,0]=4 3971 B15R1.3722 CC=CC(=O)NC(C)c1ccccc1Br 240690a_100000181357_100000210699 [1,0,0,0,0,1|2,0,0]=4 3972 B15R1.3722 CC=CC(=O)NC(C)c1ccccc1C 11a_100000181355_100000210699 [1,0,0,0,0,1|1,0,0]=3 3973 B15R1.3722 CC=CC(=O)NC(C)c1ccccc1C 1626a_100000181355_100000210699 [1,0,0,0,0,1|1,0,0]=3 3974 B15R1.3722 CC=CC(=O)NC(C)c1ccccc1C 240690a_100000181355_100000210699 [1,0,0,0,0,1|1,0,0]=3 3975 B15R1.3722 CC=CC(=O)NC(C)c1ccccc1Cl 11a_100000174978_100000210699 [1,0,0,0,0,1|2,0,0]=4 3976 B15R1.3722 CC=CC(=O)NC(C)c1ccccc1Cl 1626a_100000174978_100000210699 [1,0,0,0,0,1|2,0,0]=4 3977 B15R1.3722 CC=CC(=O)NC(C)c1ccccc1Cl 240690a_100000174978_100000210699 [1,0,0,0,0,1|2,0,0]=4 3978 B15R1.3722 CC=CC(=O)NC(C)c1ccccc1F 11a_100000181408_100000210699 [1,0,0,0,0,1|2,0,0]=4 3979 B15R1.3722 CC=CC(=O)NC(C)c1ccccc1F 1626a_100000181408_100000210699 [1,0,0,0,0,1|2,0,0]=4 3980 B15R1.3722 CC=CC(=O)NC(C)c1ccccc1F 240690a_100000181408_100000210699 [1,0,0,0,0,1|2,0,0]=4 3981 B15R1.3722 CC=CC(=O)NC(C)c1ncccc1C 11a_100011536111_100000210699 [1,0,0,0,0,1|2,0,0]=4 3982 B15R1.3722 CC=CC(=O)NC(C)c1ncccc1C 1626a_100011536111_100000210699 [1,0,0,0,0,1|2,0,0]=4 3983 B15R1.3722 CC=CC(=O)NC(C)c1ncccc1C 240690a_100011536111_100000210699 [1,0,0,0,0,1|2,0,0]=4 3984 B15R1.3722 CC=CC(=O)N[C@H](C)c1ccccc1O 240690a_100025703389_100000210699 [1,0,0,0,0,1|2,0,0]=4 3985 B15R1.3722 CCCC(=O)CN(C)c1ccccc1C 2230a_100000219699_100000747444 [1,0,0,0,0,1|0,0,2]=4 3986 B15R1.3722 CCCC(=O)CN(C)c1ccccc1C 269982a_100000219699_100000747444 [1,0,0,0,0,1|0,0,2]=4 3987 B15R1.3722 CCNC(=O)CN(C)c1ccccc1C 2230a_100000219699_100000183381 [1,0,0,0,0,1|1,0,1]=4 3988 B15R1.3722 CCNC(=O)CN(C)c1ccccc1C 269982a_100000219699_100000183381 [1,0,0,0,0,1|1,0,1]=4 3989 B15R1.3722 CCNC(=O)CN(C)c1ccccc1C 34a_100000219699_100000183381 [1,0,0,0,0,1|1,0,1]=4 3990 B15R1.3722 CCOC(=O)CN(C)c1ccccc1C 2230a_100000219699_100000188475 [1,0,0,0,0,1|1,0,1]=4 3991 B15R1.3722 CCOC(=O)CN(C)c1ccccc1C 2230a_200000219698_200000210301 [1,0,0,0,0,1|1,0,1]=4 3992 B15R1.3722 CCOC(=O)CN(C)c1ccccc1C 269982a_100000219699_100000188475 [1,0,0,0,0,1|1,0,1]=4 3993 B15R1.3722 CCOC(=O)CN(C)c1ccccc1C 269982a_200000219698_200000210301 [1,0,0,0,0,1|1,0,1]=4 3994 B15R1.3722 CCOC(=O)CN(C)c1ccccc1C 34a_100000219699_100000188475 [1,0,0,0,0,1|1,0,1]=4 3995 B15R1.3722 CCOC(=O)CN([13CH3])c1ccccc1C 2230a_200000219698_200025704644 [1,0,0,0,0,1|1,0,1]=4 3996 B15R1.3722 CCOC(=O)CN([13CH3])c1ccccc1C 269982a_200000219698_200025704644 [1,0,0,0,0,1|1,0,1]=4 3997 B15R1.3722 Cc1ccccc1C(C)NC(=O)C=CBr 1626a_100000181355_100016273825 [1,0,0,0,0,1|2,0,0]=4 3998 B15R1.3722 Cc1ccccc1C(C)NC(=O)C=CBr 240690a_100000181355_100016273825 [1,0,0,0,0,1|2,0,0]=4 3999 B15R1.3722 Cc1ccccc1C(C)NC(=O)C=CCl 11a_100000181355_200016279998 [1,0,0,0,0,1|2,0,0]=4 4000 B15R1.3722 Cc1ccccc1C(C)NC(=O)C=CCl 1626a_100000181355_200016279998 [1,0,0,0,0,1|2,0,0]=4 4001 B15R1.3722 Cc1ccccc1C(C)NC(=O)C=CCl 240690a_100000181355_200016279998 [1,0,0,0,0,1|2,0,0]=4 4002 B15R1.3722 Cc1ccccc1C(C)NC(=O)C=CI 1626a_100000181355_100016256311 [1,0,0,0,0,1|2,0,0]=4 4003 B15R1.3960 C=CCC(=O)N(C)Cc1ccccc1C 1626a_100000184421_100000210193 [1,0,0,0,0,1|0,0,2]=4 4004 B15R1.3960 C=CCC(=O)N(C)Cc1ccccc1C 240690a_100000184421_100000210193 [1,0,0,0,0,1|0,0,2]=4 4005 B15R1.3960 C=CCC(=O)N(C)Cc1ccccc1C 527a_100000184421_100000210193 [1,0,0,0,0,1|0,0,2]=4 4006 B15R1.3960 CC=CC(=O)N(C)Cc1ccccc1Br 11a_100000184654_100000210699 [1,0,0,0,0,1|1,0,0]=3 4007 B15R1.3960 CC=CC(=O)N(C)Cc1ccccc1Br 1626a_100000184654_100000210699 [1,0,0,0,0,1|1,0,0]=3 4008 B15R1.3960 CC=CC(=O)N(C)Cc1ccccc1Br 240690a_100000184654_100000210699 [1,0,0,0,0,1|1,0,0]=3 4009 B15R1.3960 CC=CC(=O)N(C)Cc1ccccc1C 1626a_100000184421_100000210699 [1,0,0,0,0,1|0,0,0]=2 4010 B15R1.3960 CC=CC(=O)N(C)Cc1ccccc1C 240690a_100000184421_100000210699 [1,0,0,0,0,1|0,0,0]=2 4011 B15R1.3960 CC=CC(=O)N(C)Cc1ccccc1Cl 11a_100000184507_100000210699 [1,0,0,0,0,1|1,0,0]=3 4012 B15R1.3960 CC=CC(=O)N(C)Cc1ccccc1Cl 1626a_100000184507_100000210699 [1,0,0,0,0,1|1,0,0]=3 4013 B15R1.3960 CC=CC(=O)N(C)Cc1ccccc1Cl 240690a_100000184507_100000210699 [1,0,0,0,0,1|1,0,0]=3 4014 B15R1.3960 CC=CC(=O)N(C)Cc1ccccc1F 11a_100000742528_100000210699 [1,0,0,0,0,1|1,0,0]=3 4015 B15R1.3960 CC=CC(=O)N(C)Cc1ccccc1F 1626a_100000742528_100000210699 [1,0,0,0,0,1|1,0,0]=3 4016 B15R1.3960 CC=CC(=O)N(C)Cc1ccccc1F 240690a_100000742528_100000210699 [1,0,0,0,0,1|1,0,0]=3 4017 B15R1.3960 CC=CC(=O)N(C)Cc1ccccc1O 240690a_100015189988_100000210699 [1,0,0,0,0,1|1,0,0]=3 4018 B15R1.3960 CC=CC(=O)N(C)Cc1cccnc1C 11a_200011875998_100000210699 [1,0,0,0,0,1|1,0,0]=3 4019 B15R1.3960 CC=CC(=O)N(C)Cc1cccnc1C 240690a_200011875998_100000210699 [1,0,0,0,0,1|1,0,0]=3 4020 B15R1.3960 CC=CC(=O)N(C)Cc1cccnc1Cl 11a_103496529121_100000210699 [1,0,0,0,0,1|2,0,0]=4 4021 B15R1.3960 CC=CC(=O)N(C)Cc1cccnc1Cl 240690a_103496529121_100000210699 [1,0,0,0,0,1|2,0,0]=4 4022 B15R1.3960 CC=CC(=O)N(C)Cc1ccncc1C 240690a_100015187836_100000210699 [1,0,0,0,0,1|1,0,0]=3 4023 B15R1.3960 CCCC(=O)N(C)Cc1ccccc1C 1626a_100000184421_100000211992 [1,0,0,0,0,1|0,0,2]=4 4024 B15R1.3960 CCCC(=O)N(C)Cc1ccccc1C 240690a_100000184421_100000211992 [1,0,0,0,0,1|0,0,2]=4 4025 B15R1.3960 CCCC(=O)N(C)Cc1ccccc1C 527a_100000184421_100000211992 [1,0,0,0,0,1|0,0,2]=4 4026 B15R1.3960 CCNC(=O)N(C)Cc1ccccc1C 2708a_100015525214_100000184421 [1,0,0,0,0,1|1,0,1]=4 4027 B15R1.3960 CCNC(=O)N(C)Cc1ccccc1C 273464a_100015525214_100000184421 [1,0,0,0,0,1|1,0,1]=4 4028 B15R1.3960 CN(Cc1ccccc1Br)C(=O)C=CBr 1626a_100000184654_100016273825 [1,0,0,0,0,1|2,0,0]=4 4029 B15R1.3960 CN(Cc1ccccc1Br)C(=O)C=CBr 240690a_100000184654_100016273825 [1,0,0,0,0,1|2,0,0]=4 4030 B15R1.3960 CN(Cc1ccccc1Br)C(=O)C=CCl 11a_100000184654_200016279998 [1,0,0,0,0,1|2,0,0]=4 4031 B15R1.3960 CN(Cc1ccccc1Br)C(=O)C=CCl 1626a_100000184654_200016279998 [1,0,0,0,0,1|2,0,0]=4 4032 B15R1.3960 CN(Cc1ccccc1Br)C(=O)C=CCl 240690a_100000184654_200016279998 [1,0,0,0,0,1|2,0,0]=4 4033 B15R1.3960 CN(Cc1ccccc1Br)C(=O)C=CI 1626a_100000184654_100016256311 [1,0,0,0,0,1|2,0,0]=4 4034 B15R1.3960 CN(Cc1ccccc1Cl)C(=O)C=CBr 1626a_100000184507_100016273825 [1,0,0,0,0,1|2,0,0]=4 4035 B15R1.3960 CN(Cc1ccccc1Cl)C(=O)C=CBr 240690a_100000184507_100016273825 [1,0,0,0,0,1|2,0,0]=4 4036 B15R1.3960 CN(Cc1ccccc1Cl)C(=O)C=CCl 11a_100000184507_200016279998 [1,0,0,0,0,1|2,0,0]=4 4037 B15R1.3960 CN(Cc1ccccc1Cl)C(=O)C=CCl 1626a_100000184507_200016279998 [1,0,0,0,0,1|2,0,0]=4 4038 B15R1.3960 CN(Cc1ccccc1Cl)C(=O)C=CCl 240690a_100000184507_200016279998 [1,0,0,0,0,1|2,0,0]=4 4039 B15R1.3960 CN(Cc1ccccc1Cl)C(=O)C=CI 1626a_100000184507_100016256311 [1,0,0,0,0,1|2,0,0]=4 4040 B15R1.3960 CN(Cc1ccccc1F)C(=O)C=CBr 1626a_100000742528_100016273825 [1,0,0,0,0,1|2,0,0]=4 4041 B15R1.3960 CN(Cc1ccccc1F)C(=O)C=CBr 240690a_100000742528_100016273825 [1,0,0,0,0,1|2,0,0]=4 4042 B15R1.3960 CN(Cc1ccccc1F)C(=O)C=CCl 11a_100000742528_200016279998 [1,0,0,0,0,1|2,0,0]=4 4043 B15R1.3960 CN(Cc1ccccc1F)C(=O)C=CCl 1626a_100000742528_200016279998 [1,0,0,0,0,1|2,0,0]=4 4044 B15R1.3960 CN(Cc1ccccc1F)C(=O)C=CCl 240690a_100000742528_200016279998 [1,0,0,0,0,1|2,0,0]=4 4045 B15R1.3960 CN(Cc1ccccc1F)C(=O)C=CI 1626a_100000742528_100016256311 [1,0,0,0,0,1|2,0,0]=4 4046 B15R1.3960 CN(Cc1ccccc1O)C(=O)C=CBr 240690a_100015189988_100016273825 [1,0,0,0,0,1|2,0,0]=4 4047 B15R1.3960 CN(Cc1ccccc1O)C(=O)C=CCl 240690a_100015189988_200016279998 [1,0,0,0,0,1|2,0,0]=4 4048 B15R1.3960 COCC(=O)N(C)Cc1ccccc1C 1626a_100000184421_100000210968 [1,0,0,0,0,1|1,0,1]=4 4049 B15R1.3960 COCC(=O)N(C)Cc1ccccc1C 240690a_100000184421_100000210968 [1,0,0,0,0,1|1,0,1]=4 4050 B15R1.3960 COCC(=O)N(C)Cc1ccccc1C 527a_100000184421_100000210968 [1,0,0,0,0,1|1,0,1]=4 4051 B15R1.3960 CSCC(=O)N(C)Cc1ccccc1C 1626a_100000184421_100000184570 [1,0,0,0,0,1|1,0,1]=4 4052 B15R1.3960 CSCC(=O)N(C)Cc1ccccc1C 240690a_100000184421_100000184570 [1,0,0,0,0,1|1,0,1]=4 4053 B15R1.3960 CSCC(=O)N(C)Cc1ccccc1C 527a_100000184421_100000184570 [1,0,0,0,0,1|1,0,1]=4 4054 B15R1.3960 Cc1ccccc1CN(C)C(=O)C=CBr 1626a_100000184421_100016273825 [1,0,0,0,0,1|1,0,0]=3 4055 B15R1.3960 Cc1ccccc1CN(C)C(=O)C=CBr 240690a_100000184421_100016273825 [1,0,0,0,0,1|1,0,0]=3 4056 B15R1.3960 Cc1ccccc1CN(C)C(=O)C=CCl 1626a_100000184421_200016279998 [1,0,0,0,0,1|1,0,0]=3 4057 B15R1.3960 Cc1ccccc1CN(C)C(=O)C=CCl 240690a_100000184421_200016279998 [1,0,0,0,0,1|1,0,0]=3 4058 B15R1.3960 Cc1ccccc1CN(C)C(=O)C=CI 1626a_100000184421_100016256311 [1,0,0,0,0,1|1,0,0]=3 4059 B15R1.3960 Cc1cnccc1CN(C)C(=O)C=CBr 240690a_100015187836_100016273825 [1,0,0,0,0,1|2,0,0]=4 4060 B15R1.3960 Cc1cnccc1CN(C)C(=O)C=CCl 240690a_100015187836_200016279998 [1,0,0,0,0,1|2,0,0]=4 4061 B15R1.3960 Cc1ncccc1CN(C)C(=O)C=CBr 240690a_200011875998_100016273825 [1,0,0,0,0,1|2,0,0]=4 4062 B15R1.3960 Cc1ncccc1CN(C)C(=O)C=CCl 11a_200011875998_200016279998 [1,0,0,0,0,1|2,0,0]=4 4063 B15R1.3960 Cc1ncccc1CN(C)C(=O)C=CCl 240690a_200011875998_200016279998 [1,0,0,0,0,1|2,0,0]=4 4064 B15R1.11498 C=CC(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100000185746 [1,0,0,0,0,1|0,0,0]=2 4065 B15R1.11498 C=CC(=O)N(CC)Cc1ccccc1C 240690a_100000201206_200121576911 [1,0,0,0,0,1|0,0,0]=2 4066 B15R1.11498 C=CC(=O)N(CC)Cc1ccccc1Cl 1626a_100000201176_100000185746 [1,0,0,0,0,1|1,0,0]=3 4067 B15R1.11498 C=CC(=O)N(CC)Cc1ccccc1Cl 240690a_100000201176_200121576911 [1,0,0,0,0,1|1,0,0]=3 4068 B15R1.11498 C=CC(=O)N(CC)Cc1ccccc1F 1626a_100015186831_100000185746 [1,0,0,0,0,1|1,0,0]=3 4069 B15R1.11498 C=CC(=O)N(CC)Cc1ccccc1F 240690a_100015186831_200121576911 [1,0,0,0,0,1|1,0,0]=3 4070 B15R1.11498 C=CC(=O)N(CC)Cc1ccccc1O 240690a_100011223546_200121576911 [1,0,0,0,0,1|1,0,0]=3 4071 B15R1.11498 C=CC(C)N(CC)Cc1ccccc1C 269982a_100000201206_100011215867 [1,0,0,0,0,1|1,0,1]=4 4072 B15R1.11498 CCC(=O)N(CC)Cc1ccccc1C 11a_100000201206_100000210414 [1,0,0,0,0,1|0,0,1]=3 4073 B15R1.11498 CCC(=O)N(CC)Cc1ccccc1C 1626a_100000201206_100000210414 [1,0,0,0,0,1|0,0,1]=3 4074 B15R1.11498 CCC(=O)N(CC)Cc1ccccc1C 240690a_100000201206_100000210414 [1,0,0,0,0,1|0,0,1]=3 4075 B15R1.11498 CCC(=O)N(CC)Cc1ccccc1C 527a_100000201206_100000210414 [1,0,0,0,0,1|0,0,1]=3 4076 B15R1.11498 CCC(=O)N(CC)Cc1ccccc1Cl 11a_100000201176_100000210414 [1,0,0,0,0,1|1,0,1]=4 4077 B15R1.11498 CCC(=O)N(CC)Cc1ccccc1Cl 1626a_100000201176_100000210414 [1,0,0,0,0,1|1,0,1]=4 4078 B15R1.11498 CCC(=O)N(CC)Cc1ccccc1Cl 240690a_100000201176_100000210414 [1,0,0,0,0,1|1,0,1]=4 4079 B15R1.11498 CCC(=O)N(CC)Cc1ccccc1Cl 527a_100000201176_100000210414 [1,0,0,0,0,1|1,0,1]=4 4080 B15R1.11498 CCC(=O)N(CC)Cc1ccccc1F 11a_100015186831_100000210414 [1,0,0,0,0,1|1,0,1]=4 4081 B15R1.11498 CCC(=O)N(CC)Cc1ccccc1F 1626a_100015186831_100000210414 [1,0,0,0,0,1|1,0,1]=4 4082 B15R1.11498 CCC(=O)N(CC)Cc1ccccc1F 240690a_100015186831_100000210414 [1,0,0,0,0,1|1,0,1]=4 4083 B15R1.11498 CCC(=O)N(CC)Cc1ccccc1F 527a_100015186831_100000210414 [1,0,0,0,0,1|1,0,1]=4 4084 B15R1.11498 CCC(=O)N(CC)Cc1ccccc1O 240690a_100011223546_100000210414 [1,0,0,0,0,1|1,0,1]=4 4085 B15R1.11498 CCC(=O)N(CC)Cc1ccccc1O 527a_100011223546_100000210414 [1,0,0,0,0,1|1,0,1]=4 4086 B15R1.11498 CCC(Nc1ccccc1C)C(=O)OC 34a_100015192222_100000235869 [1,0,0,0,0,1|2,0,0]=4 4087 B15R1.11498 CCC(Oc1ccccc1C)C(=O)OC 34a_100000210338_100000235869 [1,0,0,0,0,1|2,0,0]=4 4088 B15R1.11498 CCC(Oc1ccccc1C)C(=O)OC 7a_100000210338_100000742303 [1,0,0,0,0,1|2,0,0]=4 4089 B15R1.11498 CCC(Sc1ccccc1C)C(=O)OC 62a_100000210755_100000235869 [1,0,0,0,0,1|2,0,0]=4 4090 B15R1.11498 CCC(Sc1ccccc1C)C(=O)OC 62a_100000235869_100000210755 [1,0,0,0,0,1|2,0,0]=4 4091 B15R1.11498 CCN(Cc1ccccc1C)C(=O)CO 240690a_100000201206_100000210174 [1,0,0,0,0,1|1,0,1]=4 4092 B15R1.11498 CCN(Cc1ccccc1C)C(=O)CO 527a_100000201206_100000210174 [1,0,0,0,0,1|1,0,1]=4 4093 B15R1.11498 CCN(Cc1ccccc1C)C(=O)NC 2708a_100102657272_100000201206 [1,0,0,0,0,1|1,0,0]=3 4094 B15R1.11498 CCN(Cc1ccccc1C)C(=O)NC 273464a_100102657272_100000201206 [1,0,0,0,0,1|1,0,0]=3 4095 B15R1.11498 CCN(Cc1ccccc1Cl)C(=O)NC 2708a_100102657272_100000201176 [1,0,0,0,0,1|2,0,0]=4 4096 B15R1.11498 CCN(Cc1ccccc1Cl)C(=O)NC 273464a_100102657272_100000201176 [1,0,0,0,0,1|2,0,0]=4 4097 B15R1.11498 CCN(Cc1ccccc1F)C(=O)NC 2708a_100102657272_100015186831 [1,0,0,0,0,1|2,0,0]=4 4098 B15R1.11498 CCN(Cc1ccccc1F)C(=O)NC 273464a_100102657272_100015186831 [1,0,0,0,0,1|2,0,0]=4 4099 B15R1.11498 CCN(Cc1ccccc1O)C(=O)NC 2708a_100102657272_100011223546 [1,0,0,0,0,1|2,0,0]=4 4100 B15R1.11498 CCN(Cc1ccccc1O)C(=O)NC 273464a_100102657272_100011223546 [1,0,0,0,0,1|2,0,0]=4 4101 B17R1.30638 C=COC(=O)CN(CC)Cc1ccccc1C 2230a_100000201206_100000036128 [0,0,0,0,0,2|1,0,1]=4 4102 B17R1.30638 C=COC(=O)CN(CC)Cc1ccccc1C 269982a_100000201206_100000036128 [0,0,0,0,0,2|1,0,1]=4 4103 B17R1.30638 CCCC(=O)CN(CC)Cc1ccccc1C 2230a_100000201206_100000747444 [0,0,0,0,0,2|0,0,2]=4 4104 B17R1.30638 CCCC(=O)CN(CC)Cc1ccccc1C 269982a_100000201206_100000747444 [0,0,0,0,0,2|0,0,2]=4 4105 B17R1.30638 CCNC(=O)CN(CC)Cc1ccccc1C 2230a_100000201206_100000183381 [0,0,0,0,0,2|1,0,1]=4 4106 B17R1.30638 CCNC(=O)CN(CC)Cc1ccccc1C 269982a_100000201206_100000183381 [0,0,0,0,0,2|1,0,1]=4 4107 B17R1.30638 CCOC(=O)CN(CC)Cc1ccccc1C 2230a_100000201206_100000188475 [0,0,0,0,0,2|1,0,1]=4 4108 B17R1.30638 CCOC(=O)CN(CC)Cc1ccccc1C 2230a_100000220607_100000211839 [0,0,0,0,0,2|1,0,1]=4 4109 B17R1.30638 CCOC(=O)CN(CC)Cc1ccccc1C 269982a_100000201206_100000188475 [0,0,0,0,0,2|1,0,1]=4 4110 B17R1.30638 CCOC(=O)CN(CC)Cc1ccccc1C 269982a_100000220607_100000211839 [0,0,0,0,0,2|1,0,1]=4 4111 B17R1.30638 CCOC(=O)CN(CC)Cc1ccccc1C 270004a_100000220607_100000211143 [0,0,0,0,0,2|1,0,1]=4 4112 B17R1.126254 CCCC(=O)OCN(CC)c1ccccc1C 2230a_100000211084_100000034017 [0,0,0,0,0,2|0,0,2]=4 4113 B17R1.126254 CCCC(=O)OCN(CC)c1ccccc1C 269982a_100000211084_100000034017 [0,0,0,0,0,2|0,0,2]=4 4114 B17R1.126254 CCCC(=O)OCN(CC)c1ccccc1C 34a_100000211084_100000034017 [0,0,0,0,0,2|0,0,2]=4 4115 B17R1.126254 CCNC(=O)CCN(CC)c1ccccc1C 2230a_100000211084_100000737597 [0,0,0,0,0,2|1,0,1]=4 4116 B17R1.126254 CCNC(=O)CCN(CC)c1ccccc1C 269982a_100000211084_100000737597 [0,0,0,0,0,2|1,0,1]=4 4117 B17R1.126254 CCOC(=O)CCN(CC)c1ccccc1C 2230a_100000211084_100011206558 [0,0,0,0,0,2|1,0,1]=4 4118 B17R1.126254 CCOC(=O)CCN(CC)c1ccccc1C 269982a_100000211084_100011206558 [0,0,0,0,0,2|1,0,1]=4 4119 B17R1.126254 CCOC(=O)CCN(CC)c1ccccc1C 34a_100000211084_100000765890 [0,0,0,0,0,2|1,0,1]=4