0 B14R1.489 C=C=Cc1ccc(c(c1)CC(=O)C)O 271570a_100015277604_200010006938 [0,0,0,0,0,0|2,0,2]=4 1 B14R1.489 C=C=Cc1ccc(c(c1)NC(=O)C)C 271570a_100015277604_100011344836 [0,0,0,0,0,0|2,0,2]=4 2 B14R1.489 C=C=Cc1ccc(c(c1)NC(=O)C)F 271570a_100015277604_200011951791 [0,0,0,0,0,0|2,0,2]=4 3 B14R1.489 CC(=O)Cc1cc(ccc1O)SCF 62a_100015361967_200010006938 [0,0,0,0,0,0|4,0,0]=4 4 B14R1.489 CC(=O)Cc1cc(ccc1O)SCF 62a_200010006938_100015361967 [0,0,0,0,0,0|4,0,0]=4 5 B14R1.489 CC(=O)Nc1cc(ccc1C)NCF 34a_100000740626_100015361967 [0,0,0,0,0,0|4,0,0]=4 6 B14R1.489 CC(=O)Nc1cc(ccc1C)NCF 7a_100000740626_100015361967 [0,0,0,0,0,0|4,0,0]=4 7 B14R1.489 CC(=O)Nc1cc(ccc1C)SCF 62a_100015361967_100011344836 [0,0,0,0,0,0|4,0,0]=4 8 B14R1.489 CC(=O)Nc1cc(ccc1Cl)NCF 34a_100000745429_100015361967 [0,0,0,0,0,0|4,0,0]=4 9 B14R1.489 CC(=O)Nc1cc(ccc1Cl)NCF 7a_100000745429_100015361967 [0,0,0,0,0,0|4,0,0]=4 10 B14R1.489 CC(=O)Nc1cc(ccc1F)NCF 34a_100000736141_100015361967 [0,0,0,0,0,0|4,0,0]=4 11 B14R1.489 CC(=O)Nc1cc(ccc1F)NCF 7a_100000736141_100015361967 [0,0,0,0,0,0|4,0,0]=4 12 B14R1.489 CC(=O)Nc1cc(ccc1F)SCF 62a_100015361967_200011951791 [0,0,0,0,0,0|4,0,0]=4 13 B14R1.489 CC(=O)Nc1cc(ccc1O)NCF 34a_100000070259_100015361967 [0,0,0,0,0,0|3,0,0]=3 14 B14R1.489 CC(=O)Nc1cc(ccc1O)NCF 7a_100000070259_100015361967 [0,0,0,0,0,0|3,0,0]=3 15 B14R1.489 CC=Cc1ccc(c(c1)CC(=O)C)O 271570a_100016259895_200010006938 [0,0,0,0,0,0|2,0,1]=3 16 B14R1.489 CC=Cc1ccc(c(c1)NC(=O)C)C 271570a_100016259895_100011344836 [0,0,0,0,0,0|2,0,1]=3 17 B14R1.489 CC=Cc1ccc(c(c1)NC(=O)C)F 271570a_100016259895_200011951791 [0,0,0,0,0,0|2,0,1]=3 18 B14R1.489 CC=Cc1ccc(c(c1)OC(=O)C)C 271570a_100016259895_100103282185 [0,0,0,0,0,0|3,0,1]=4 19 B14R1.489 CC=Cc1cnc(c(c1)NC(=O)C)C 271570a_100016259895_100010117071 [0,0,0,0,0,0|3,0,1]=4 20 B14R1.489 CCNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_100000210202 [0,0,0,0,0,0|3,0,0]=3 21 B14R1.489 CCNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_100000210202 [0,0,0,0,0,0|3,0,0]=3 22 B14R1.489 CCNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_100000210202 [0,0,0,0,0,0|3,0,0]=3 23 B14R1.489 CCNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_100000210202 [0,0,0,0,0,0|3,0,0]=3 24 B14R1.489 CCNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_100000210202 [0,0,0,0,0,0|3,0,0]=3 25 B14R1.489 CCNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_100000210202 [0,0,0,0,0,0|3,0,0]=3 26 B14R1.489 CCNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100000210202 [0,0,0,0,0,0|2,0,0]=2 27 B14R1.489 CCNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000210202 [0,0,0,0,0,0|2,0,0]=2 28 B14R1.489 CCSc1ccc(c(c1)CC(=O)C)O 62a_100000210202_200010006938 [0,0,0,0,0,0|3,0,0]=3 29 B14R1.489 CCSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100000210202 [0,0,0,0,0,0|3,0,0]=3 30 B14R1.489 CCSc1ccc(c(c1)NC(=O)C)C 62a_100000210202_100011344836 [0,0,0,0,0,0|3,0,0]=3 31 B14R1.489 CCSc1ccc(c(c1)NC(=O)C)F 62a_100000210202_200011951791 [0,0,0,0,0,0|3,0,0]=3 32 B14R1.489 CCSc1ccc(c(c1)OC(=O)C)C 62a_100000210202_100103282185 [0,0,0,0,0,0|4,0,0]=4 33 B14R1.489 CCSc1ccc(c(c1)OC(=O)C)C 62a_100103282185_100000210202 [0,0,0,0,0,0|4,0,0]=4 34 B14R1.489 CCSc1cnc(c(c1)NC(=O)C)C 62a_100000210202_100010117071 [0,0,0,0,0,0|4,0,0]=4 35 B14R1.489 CCSc1cnc(c(c1)NC(=O)C)C 62a_100010117071_100000210202 [0,0,0,0,0,0|4,0,0]=4 36 B14R1.489 COCc1ccc(c(c1)C=C(C)C)C 271570a_100102525489_200015395492 [0,0,0,0,0,0|3,0,0]=3 37 B14R1.489 COCc1ccc(c(c1)C=C(C)C)F 271570a_100102525489_200011493689 [0,0,0,0,0,0|3,0,0]=3 38 B14R1.489 COCc1ccc(c(c1)NC(=O)C)Br 11a_200013033220_100015343762 [0,0,0,0,0,0|1,0,0]=1 39 B14R1.489 COCc1ccc(c(c1)NC(=O)C)Br 1626a_200013033220_100015343762 [0,0,0,0,0,0|1,0,0]=1 40 B14R1.489 COCc1ccc(c(c1)NC(C)C)Br 34a_200013033220_100000210206 [0,0,0,0,0,0|2,0,1]=3 41 B14R1.489 COCc1ccc(c(c1)SC(C)C)C 62a_100000210206_200015395492 [0,0,0,0,0,0|3,0,1]=4 42 B14R1.489 COCc1ccc(c(c1)SC(C)C)C 62a_200015395492_100000210206 [0,0,0,0,0,0|3,0,1]=4 43 B14R1.489 COCc1ccc(c(c1)SC(C)C)F 62a_100000210206_200011493689 [0,0,0,0,0,0|3,0,1]=4 44 B14R1.489 COCc1ccc(c(c1)SC(C)C)F 62a_200011493689_100000210206 [0,0,0,0,0,0|3,0,1]=4 45 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)C 11a_100012022948_100015343762 [1,0,0,0,0,0|1,0,2]=4 46 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)C 1626a_100012022948_100015343762 [1,0,0,0,0,0|1,0,2]=4 47 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)C 22a_100012022948_100000070787 [1,0,0,0,0,0|1,0,2]=4 48 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)C 527a_100012022948_100103153847 [1,0,0,0,0,0|1,0,2]=4 49 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)F 11a_100000100531_100015343762 [1,0,0,0,0,0|1,0,2]=4 50 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)F 1626a_100000100531_100015343762 [1,0,0,0,0,0|1,0,2]=4 51 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)F 22a_100000100531_100000070787 [1,0,0,0,0,0|1,0,2]=4 52 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)F 527a_100000100531_100103153847 [1,0,0,0,0,0|1,0,2]=4 53 B13R1.97 C=Cc1ccc(c(c1)CC(=O)C)O 271570a_100011290941_200010006938 [1,0,0,0,0,0|1,0,2]=4 54 B13R1.97 C=Cc1ccc(c(c1)NC(=O)C)C 271570a_100011290941_100011344836 [1,0,0,0,0,0|1,0,2]=4 55 B13R1.97 C=Cc1ccc(c(c1)NC(=O)C)F 271570a_100011290941_200011951791 [1,0,0,0,0,0|1,0,2]=4 56 B13R1.97 CC(=Cc1cc(ccc1C)CO)C 271570a_100102525489_100000050133 [1,0,0,0,0,0|3,0,0]=4 57 B13R1.97 CC(=Cc1cc(ccc1F)CO)C 271570a_100102525489_100000246287 [1,0,0,0,0,0|3,0,0]=4 58 B13R1.97 CC(=Cc1cc(ccc1O)CO)C 271570a_100102525489_100011191544 [1,0,0,0,0,0|2,0,0]=3 59 B13R1.97 CC(=Cc1nc(ccc1O)CO)C 271570a_100102525489_200000118097 [1,0,0,0,0,0|3,0,0]=4 60 B13R1.97 CC(=O)Cc1cc(ccc1O)S[13CH3] 62a_200010006938_200025704644 [1,0,0,0,0,0|1,1,0]=3 61 B13R1.97 CC(=O)Cc1cc(ccc1O)S[13CH3] 62a_200025704644_200010006938 [1,0,0,0,0,0|1,1,0]=3 62 B13R1.97 CC(=O)Nc1cc(ccc1Br)C#N 11a_100012001879_100015343762 [1,0,0,0,0,0|2,0,1]=4 63 B13R1.97 CC(=O)Nc1cc(ccc1Br)C#N 1626a_100012001879_100015343762 [1,0,0,0,0,0|2,0,1]=4 64 B13R1.97 CC(=O)Nc1cc(ccc1C)C#N 11a_100000748024_100015343762 [1,0,0,0,0,0|2,0,1]=4 65 B13R1.97 CC(=O)Nc1cc(ccc1C)C#N 1626a_100000748024_100015343762 [1,0,0,0,0,0|2,0,1]=4 66 B13R1.97 CC(=O)Nc1cc(ccc1C)C#N 22a_100000748024_100000070787 [1,0,0,0,0,0|2,0,1]=4 67 B13R1.97 CC(=O)Nc1cc(ccc1C)C#N 527a_100000748024_100103153847 [1,0,0,0,0,0|2,0,1]=4 68 B13R1.97 CC(=O)Nc1cc(ccc1C)CO 22a_100000758420_100000070787 [1,0,0,0,0,0|1,0,0]=2 69 B13R1.97 CC(=O)Nc1cc(ccc1C)N[13CH3] 34a_100000740626_200025704644 [1,0,0,0,0,0|2,0,0]=3 70 B13R1.97 CC(=O)Nc1cc(ccc1C)N[13CH3] 7a_100000740626_200025704644 [1,0,0,0,0,0|2,0,0]=3 71 B13R1.97 CC(=O)Nc1cc(ccc1C)S[13CH3] 62a_200025704644_100011344836 [1,0,0,0,0,0|1,1,0]=3 72 B13R1.97 CC(=O)Nc1cc(ccc1Cl)C#N 11a_100000766345_100015343762 [1,0,0,0,0,0|2,0,1]=4 73 B13R1.97 CC(=O)Nc1cc(ccc1Cl)C#N 1626a_100000766345_100015343762 [1,0,0,0,0,0|2,0,1]=4 74 B13R1.97 CC(=O)Nc1cc(ccc1Cl)N[13CH3] 34a_100000745429_200025704644 [1,0,0,0,0,0|2,0,0]=3 75 B13R1.97 CC(=O)Nc1cc(ccc1Cl)N[13CH3] 7a_100000745429_200025704644 [1,0,0,0,0,0|2,0,0]=3 76 B13R1.97 CC(=O)Nc1cc(ccc1F)C#N 11a_100011934650_100015343762 [1,0,0,0,0,0|2,0,1]=4 77 B13R1.97 CC(=O)Nc1cc(ccc1F)C#N 1626a_100011934650_100015343762 [1,0,0,0,0,0|2,0,1]=4 78 B13R1.97 CC(=O)Nc1cc(ccc1F)C#N 22a_100011934650_100000070787 [1,0,0,0,0,0|2,0,1]=4 79 B13R1.97 CC(=O)Nc1cc(ccc1F)C#N 527a_100011934650_100103153847 [1,0,0,0,0,0|2,0,1]=4 80 B13R1.97 CC(=O)Nc1cc(ccc1F)CO 22a_102125399562_100000070787 [1,0,0,0,0,0|1,0,0]=2 81 B13R1.97 CC(=O)Nc1cc(ccc1F)N[13CH3] 34a_100000736141_200025704644 [1,0,0,0,0,0|2,0,0]=3 82 B13R1.97 CC(=O)Nc1cc(ccc1F)N[13CH3] 7a_100000736141_200025704644 [1,0,0,0,0,0|2,0,0]=3 83 B13R1.97 CC(=O)Nc1cc(ccc1F)S[13CH3] 62a_200025704644_200011951791 [1,0,0,0,0,0|1,1,0]=3 84 B13R1.97 CC(=O)Nc1cc(ccc1I)C#N 11a_200012349464_100015343762 [1,0,0,0,0,0|2,0,1]=4 85 B13R1.97 CC(=O)Nc1cc(ccc1I)C#N 1626a_200012349464_100015343762 [1,0,0,0,0,0|2,0,1]=4 86 B13R1.97 CC(=O)Nc1cc(ccc1O)C#N 22a_100000766272_100000070787 [1,0,0,0,0,0|1,0,1]=3 87 B13R1.97 CC(=O)Nc1cc(ccc1O)C#N 527a_100000766272_100103153847 [1,0,0,0,0,0|1,0,1]=3 88 B13R1.97 CC(=O)Nc1cc(ccc1O)CO 22a_100000123545_100000070787 [1,0,0,0,0,0|0,0,0]=1 89 B13R1.97 CC(=O)Nc1cc(ccc1O)CO 527a_100000123545_100103153847 [1,0,0,0,0,0|0,0,0]=1 90 B13R1.97 CC(=O)Nc1cc(ccc1O)N[13CH3] 34a_100000070259_200025704644 [1,0,0,0,0,0|1,0,0]=2 91 B13R1.97 CC(=O)Nc1cc(ccc1O)N[13CH3] 7a_100000070259_200025704644 [1,0,0,0,0,0|1,0,0]=2 92 B13R1.97 CC(=O)Nc1cc(cnc1C)S[13CH3] 62a_100010117071_200025704644 [1,0,0,0,0,0|2,1,0]=4 93 B13R1.97 CC(=O)Nc1cc(cnc1C)S[13CH3] 62a_200025704644_100010117071 [1,0,0,0,0,0|2,1,0]=4 94 B13R1.97 CC(=O)Oc1cc(ccc1C)S[13CH3] 62a_100103282185_200025704644 [1,0,0,0,0,0|2,1,0]=4 95 B13R1.97 CC(=O)Oc1cc(ccc1C)S[13CH3] 62a_200025704644_100103282185 [1,0,0,0,0,0|2,1,0]=4 96 B13R1.97 CC(C)Nc1cc(ccc1Br)CO 34a_100012347568_100000210206 [1,0,0,0,0,0|2,0,1]=4 97 B13R1.97 CC(C)Nc1cc(ccc1Cl)CO 34a_106256033963_100000210206 [1,0,0,0,0,0|2,0,1]=4 98 B13R1.97 CC(C)Nc1cc(ccc1F)CO 2230a_102125399562_100000210206 [1,0,0,0,0,0|2,0,1]=4 99 B13R1.97 CC(C)Nc1cc(ccc1F)CO 34a_102125399562_100000210206 [1,0,0,0,0,0|2,0,1]=4 100 B13R1.97 CC(C)Nc1cc(ccc1O)CO 34a_100000123545_100000210206 [1,0,0,0,0,0|1,0,1]=3 101 B13R1.97 CC(C)Sc1cc(ccc1O)CO 62a_100000210206_100011191544 [1,0,0,0,0,0|2,0,1]=4 102 B13R1.97 CC(C)Sc1cc(ccc1O)CO 62a_100011191544_100000210206 [1,0,0,0,0,0|2,0,1]=4 103 B13R1.97 CCc1ccc(c(c1)C=C(C)C)F 271570a_100102525489_200010244628 [1,0,0,0,0,0|3,0,0]=4 104 B13R1.97 CCc1ccc(c(c1)C=C(C)C)N 271570a_100102525489_100012339725 [1,0,0,0,0,0|3,0,0]=4 105 B13R1.97 CCc1ccc(c(c1)C=C(C)C)O 271570a_100102525489_100012339963 [1,0,0,0,0,0|2,0,0]=3 106 B13R1.97 CCc1ccc(c(c1)NC(=O)C)C 11a_200012022522_100015343762 [1,0,0,0,0,0|1,0,0]=2 107 B13R1.97 CCc1ccc(c(c1)NC(=O)C)C 1626a_200012022522_100015343762 [1,0,0,0,0,0|1,0,0]=2 108 B13R1.97 CCc1ccc(c(c1)NC(=O)C)C 22a_200012022522_100000070787 [1,0,0,0,0,0|1,0,0]=2 109 B13R1.97 CCc1ccc(c(c1)NC(=O)C)C 527a_200012022522_100103153847 [1,0,0,0,0,0|1,0,0]=2 110 B13R1.97 CCc1ccc(c(c1)NC(=O)C)O 22a_100000765835_100000070787 [1,0,0,0,0,0|0,0,0]=1 111 B13R1.97 CCc1ccc(c(c1)NC(=O)C)O 527a_100000765835_100103153847 [1,0,0,0,0,0|0,0,0]=1 112 B13R1.97 CCc1ccc(c(c1)NC(C)C)C 2230a_200012022522_100000210206 [1,0,0,0,0,0|2,0,1]=4 113 B13R1.97 CCc1ccc(c(c1)NC(C)C)C 34a_200012022522_100000210206 [1,0,0,0,0,0|2,0,1]=4 114 B13R1.97 CCc1ccc(c(c1)NC(C)C)C 7a_200012022522_100000210206 [1,0,0,0,0,0|2,0,1]=4 115 B13R1.97 CCc1ccc(c(c1)NC(C)C)O 34a_100000765835_100000210206 [1,0,0,0,0,0|1,0,1]=3 116 B13R1.97 CCc1ccc(c(c1)SC(C)C)O 62a_100000210206_100012339963 [1,0,0,0,0,0|2,0,1]=4 117 B13R1.97 CCc1ccc(c(c1)SC(C)C)O 62a_100012339963_100000210206 [1,0,0,0,0,0|2,0,1]=4 118 B13R1.97 CNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_200000210301 [1,0,0,0,0,0|2,0,0]=3 119 B13R1.97 CNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_200000210301 [1,0,0,0,0,0|2,0,0]=3 120 B13R1.97 CNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_200000210301 [1,0,0,0,0,0|2,0,0]=3 121 B13R1.97 CNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_200000210301 [1,0,0,0,0,0|2,0,0]=3 122 B13R1.97 CNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_200000210301 [1,0,0,0,0,0|2,0,0]=3 123 B13R1.97 CNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_200000210301 [1,0,0,0,0,0|2,0,0]=3 124 B13R1.97 CNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_200000210301 [1,0,0,0,0,0|1,0,0]=2 125 B13R1.97 CNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_200000210301 [1,0,0,0,0,0|1,0,0]=2 126 B13R1.97 COc1ccc(c(c1)C=C(C)C)Br 271570a_100102525489_100009992028 [1,0,0,0,0,0|3,0,0]=4 127 B13R1.97 COc1ccc(c(c1)C=C(C)C)C 271570a_100102525489_100012349166 [1,0,0,0,0,0|3,0,0]=4 128 B13R1.97 COc1ccc(c(c1)C=C(C)C)Cl 271570a_100102525489_100011356938 [1,0,0,0,0,0|3,0,0]=4 129 B13R1.97 COc1ccc(c(c1)C=C(C)C)F 271570a_100102525489_100000699733 [1,0,0,0,0,0|3,0,0]=4 130 B13R1.97 COc1ccc(c(c1)C=C(C)C)N 271570a_100102525489_100015195136 [1,0,0,0,0,0|3,0,0]=4 131 B13R1.97 COc1ccc(c(c1)C=C(C)C)O 271570a_100102525489_100000685887 [1,0,0,0,0,0|2,0,0]=3 132 B13R1.97 COc1ccc(c(c1)CC(=O)C)Br 1458a_100000070787_100000761528 [1,0,0,0,0,0|2,0,0]=3 133 B13R1.97 COc1ccc(c(c1)CC(=O)C)Br 1458a_100000690513_200000210301 [1,0,0,0,0,0|2,0,0]=3 134 B13R1.97 COc1ccc(c(c1)CC(=O)C)Cl 1458a_100000070787_100000718613 [1,0,0,0,0,0|2,0,0]=3 135 B13R1.97 COc1ccc(c(c1)CC(=O)C)Cl 1458a_100010217559_200000210301 [1,0,0,0,0,0|2,0,0]=3 136 B13R1.97 COc1ccc(c(c1)CC(=O)C)F 1458a_100000070787_100010243555 [1,0,0,0,0,0|2,0,0]=3 137 B13R1.97 COc1ccc(c(c1)CC(=O)C)F 1458a_100009868546_200000210301 [1,0,0,0,0,0|2,0,0]=3 138 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])Br 1458a_100000690513_200025704644 [1,0,0,0,0,0|2,0,0]=3 139 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])Cl 1458a_100010217559_200025704644 [1,0,0,0,0,0|2,0,0]=3 140 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])F 1458a_100009868546_200025704644 [1,0,0,0,0,0|2,0,0]=3 141 B13R1.97 COc1ccc(c(c1)CN(C)C)O 271570a_203496583355_100000727244 [1,0,0,0,0,0|3,0,0]=4 142 B13R1.97 COc1ccc(c(c1)NC(=O)C)Br 11a_100000748603_100015343762 [1,0,0,0,0,0|1,0,0]=2 143 B13R1.97 COc1ccc(c(c1)NC(=O)C)Br 1626a_100000748603_100015343762 [1,0,0,0,0,0|1,0,0]=2 144 B13R1.97 COc1ccc(c(c1)NC(=O)C)Br 22a_100000748603_100000070787 [1,0,0,0,0,0|1,0,0]=2 145 B13R1.97 COc1ccc(c(c1)NC(=O)C)C 11a_100000760359_100015343762 [1,0,0,0,0,0|1,0,0]=2 146 B13R1.97 COc1ccc(c(c1)NC(=O)C)C 1626a_100000760359_100015343762 [1,0,0,0,0,0|1,0,0]=2 147 B13R1.97 COc1ccc(c(c1)NC(=O)C)C 22a_100000760359_100000070787 [1,0,0,0,0,0|1,0,0]=2 148 B13R1.97 COc1ccc(c(c1)NC(=O)C)C 527a_100000760359_100103153847 [1,0,0,0,0,0|1,0,0]=2 149 B13R1.97 COc1ccc(c(c1)NC(=O)C)Cl 11a_100000745576_100015343762 [1,0,0,0,0,0|1,0,0]=2 150 B13R1.97 COc1ccc(c(c1)NC(=O)C)Cl 1626a_100000745576_100015343762 [1,0,0,0,0,0|1,0,0]=2 151 B13R1.97 COc1ccc(c(c1)NC(=O)C)Cl 22a_100000745576_100000070787 [1,0,0,0,0,0|1,0,0]=2 152 B13R1.97 COc1ccc(c(c1)NC(=O)C)F 11a_100000764331_100015343762 [1,0,0,0,0,0|1,0,0]=2 153 B13R1.97 COc1ccc(c(c1)NC(=O)C)F 1626a_100000764331_100015343762 [1,0,0,0,0,0|1,0,0]=2 154 B13R1.97 COc1ccc(c(c1)NC(=O)C)F 22a_100000764331_100000070787 [1,0,0,0,0,0|1,0,0]=2 155 B13R1.97 COc1ccc(c(c1)NC(=O)C)F 527a_100000764331_100103153847 [1,0,0,0,0,0|1,0,0]=2 156 B13R1.97 COc1ccc(c(c1)NC(=O)C)I 11a_100000748021_100015343762 [1,0,0,0,0,0|1,0,0]=2 157 B13R1.97 COc1ccc(c(c1)NC(=O)C)I 1626a_100000748021_100015343762 [1,0,0,0,0,0|1,0,0]=2 158 B13R1.97 COc1ccc(c(c1)NC(=O)C)I 22a_100000748021_100000070787 [1,0,0,0,0,0|1,0,0]=2 159 B13R1.97 COc1ccc(c(c1)NC(=O)C)O 22a_100000188146_100000070787 [1,0,0,0,0,0|0,0,0]=1 160 B13R1.97 COc1ccc(c(c1)NC(=O)C)O 271570a_203496583355_100011665069 [1,0,0,0,0,0|0,0,0]=1 161 B13R1.97 COc1ccc(c(c1)NC(=O)C)O 527a_100000188146_100103153847 [1,0,0,0,0,0|0,0,0]=1 162 B13R1.97 COc1ccc(c(c1)NC(C)C)Br 34a_100000748603_100000210206 [1,0,0,0,0,0|2,0,1]=4 163 B13R1.97 COc1ccc(c(c1)NC(C)C)C 2230a_100000760359_100000210206 [1,0,0,0,0,0|2,0,1]=4 164 B13R1.97 COc1ccc(c(c1)NC(C)C)C 34a_100000760359_100000210206 [1,0,0,0,0,0|2,0,1]=4 165 B13R1.97 COc1ccc(c(c1)NC(C)C)Cl 34a_100000745576_100000210206 [1,0,0,0,0,0|2,0,1]=4 166 B13R1.97 COc1ccc(c(c1)NC(C)C)F 34a_100000764331_100000210206 [1,0,0,0,0,0|2,0,1]=4 167 B13R1.97 COc1ccc(c(c1)NC(C)C)I 34a_100000748021_100000210206 [1,0,0,0,0,0|2,0,1]=4 168 B13R1.97 COc1ccc(c(c1)NC(C)C)O 34a_100000188146_100000210206 [1,0,0,0,0,0|1,0,1]=3 169 B13R1.97 COc1ccc(c(c1)SC(C)C)O 62a_100000210206_100000685887 [1,0,0,0,0,0|2,0,1]=4 170 B13R1.97 CSc1ccc(c(c1)CC(=O)C)O 62a_200000210301_200010006938 [1,0,0,0,0,0|1,1,0]=3 171 B13R1.97 CSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_200000210301 [1,0,0,0,0,0|1,1,0]=3 172 B13R1.97 CSc1ccc(c(c1)NC(=O)C)C 62a_200000210301_100011344836 [1,0,0,0,0,0|1,1,0]=3 173 B13R1.97 CSc1ccc(c(c1)NC(=O)C)F 62a_200000210301_200011951791 [1,0,0,0,0,0|1,1,0]=3 174 B13R1.97 CSc1ccc(c(c1)OC(=O)C)C 62a_100103282185_200000210301 [1,0,0,0,0,0|2,1,0]=4 175 B13R1.97 CSc1ccc(c(c1)OC(=O)C)C 62a_200000210301_100103282185 [1,0,0,0,0,0|2,1,0]=4 176 B13R1.97 CSc1cnc(c(c1)NC(=O)C)C 62a_100010117071_200000210301 [1,0,0,0,0,0|2,1,0]=4 177 B13R1.97 CSc1cnc(c(c1)NC(=O)C)C 62a_200000210301_100010117071 [1,0,0,0,0,0|2,1,0]=4 178 B13R1.97 Cc1ccc(cc1NC(C)C)CO 2230a_100000758420_100000210206 [1,0,0,0,0,0|2,0,1]=4 179 B13R1.97 Cc1ccc(cc1NC(C)C)CO 34a_100000758420_100000210206 [1,0,0,0,0,0|2,0,1]=4 180 B13R1.373 C=C=Cc1cccc(c1)NC(=O)C 271570a_100015277604_100000153616 [1,0,0,0,0,0|1,0,2]=4 181 B13R1.373 CC(=O)Nc1cccc(c1)CC#N 11a_100000017804_100015343762 [1,0,0,0,0,0|2,0,0]=3 182 B13R1.373 CC(=O)Nc1cccc(c1)CC#N 1626a_100000017804_100015343762 [1,0,0,0,0,0|2,0,0]=3 183 B13R1.373 CC(=O)Nc1cccc(c1)CC#N 22a_100000017804_100000070787 [1,0,0,0,0,0|2,0,0]=3 184 B13R1.373 CC(=O)Nc1cccc(c1)CC#N 527a_100000017804_100103153847 [1,0,0,0,0,0|2,0,0]=3 185 B13R1.373 CC(=O)Nc1cccc(c1)CCO 22a_100011996697_100000070787 [1,0,0,0,0,0|2,0,0]=3 186 B13R1.373 CC(=O)Nc1cccc(c1)CCO 527a_100011996697_100103153847 [1,0,0,0,0,0|2,0,0]=3 187 B13R1.373 CC(=O)Nc1cccc(c1)CN[13CH3] 2230a_100000740035_200025704644 [1,0,0,0,0,0|1,0,0]=2 188 B13R1.373 CC(=O)Nc1cccc(c1)CN[13CH3] 34a_100000740035_200025704644 [1,0,0,0,0,0|1,0,0]=2 189 B13R1.373 CC(=O)Nc1cccc(c1)NCF 34a_100000749408_100015361967 [1,0,0,0,0,0|3,0,0]=4 190 B13R1.373 CC(=O)Nc1cccc(c1)OCF 34a_100000158604_100015361967 [1,0,0,0,0,0|3,0,0]=4 191 B13R1.373 CC(=O)Nc1cccc(c1)OCF 7a_100000158604_100015361967 [1,0,0,0,0,0|3,0,0]=4 192 B13R1.373 CC(=O)Nc1cccc(c1)SCF 62a_100015361967_100000153616 [1,0,0,0,0,0|3,0,0]=4 193 B13R1.373 CC(=O)Oc1cccc(c1)CS[13CH3] 62a_200009816940_200025704644 [1,0,0,0,0,0|1,1,0]=3 194 B13R1.373 CC(=O)Oc1cccc(c1)CS[13CH3] 62a_200025704644_200009816940 [1,0,0,0,0,0|1,1,0]=3 195 B13R1.373 CC=Cc1cc(ccn1)NC(=O)C 271570a_100016259895_100000238608 [1,0,0,0,0,0|2,0,1]=4 196 B13R1.373 CC=Cc1cccc(c1)CC(=O)C 271570a_100016259895_100000689217 [1,0,0,0,0,0|2,0,1]=4 197 B13R1.373 CC=Cc1cccc(c1)NC(=O)C 271570a_100016259895_100000153616 [1,0,0,0,0,0|1,0,1]=3 198 B13R1.373 CC=Cc1cccc(c1)NC(=O)N 271570a_100016259895_100000238923 [1,0,0,0,0,0|2,0,1]=4 199 B13R1.373 CC=Cc1cccc(c1)OC(=O)C 271570a_100016259895_100009811612 [1,0,0,0,0,0|2,0,1]=4 200 B13R1.373 CC=Cc1cccc(n1)NC(=O)C 271570a_100016259895_200011307899 [1,0,0,0,0,0|2,0,1]=4 201 B13R1.373 CC=Cc1ccnc(c1)NC(=O)C 271570a_100016259895_100012362434 [1,0,0,0,0,0|2,0,1]=4 202 B13R1.373 CC=Cc1cncc(c1)NC(=O)C 271570a_100016259895_100012351681 [1,0,0,0,0,0|2,0,1]=4 203 B13R1.373 CCCc1cccc(c1)C=C(C)C 271570a_100102525489_100000694964 [1,0,0,0,0,0|3,0,0]=4 204 B13R1.373 CCNc1cccc(c1)NC(=O)C 34a_100000749408_100000210202 [1,0,0,0,0,0|2,0,0]=3 205 B13R1.373 CCNc1cccc(c1)NC(=O)N 34a_100000736001_100000210202 [1,0,0,0,0,0|3,0,0]=4 206 B13R1.373 CCOc1cccc(c1)CC(=O)C 1458a_100000690747_200000210301 [1,0,0,0,0,0|3,0,0]=4 207 B13R1.373 CCOc1cccc(c1)CC(=O)[13CH3] 1458a_100000690747_200025704644 [1,0,0,0,0,0|3,0,0]=4 208 B13R1.373 CCOc1cccc(c1)NC(=O)C 11a_100000742568_100015343762 [1,0,0,0,0,0|2,0,0]=3 209 B13R1.373 CCOc1cccc(c1)NC(=O)C 1626a_100000742568_100015343762 [1,0,0,0,0,0|2,0,0]=3 210 B13R1.373 CCOc1cccc(c1)NC(=O)C 22a_100000742568_100000070787 [1,0,0,0,0,0|2,0,0]=3 211 B13R1.373 CCOc1cccc(c1)NC(=O)C 34a_100000158604_100000210202 [1,0,0,0,0,0|2,0,0]=3 212 B13R1.373 CCOc1cccc(c1)NC(=O)C 527a_100000742568_100103153847 [1,0,0,0,0,0|2,0,0]=3 213 B13R1.373 CCOc1cccc(c1)NC(=O)C 7a_100000158604_100000210202 [1,0,0,0,0,0|2,0,0]=3 214 B13R1.373 CCOc1cccc(c1)NC(=O)N 34a_100011219624_100000210202 [1,0,0,0,0,0|3,0,0]=4 215 B13R1.373 CCOc1cccc(c1)NC(=O)N 7a_100011219624_100000210202 [1,0,0,0,0,0|3,0,0]=4 216 B13R1.373 CCOc1cccc(c1)OC(=O)C 7a_100011218754_100000210202 [1,0,0,0,0,0|3,0,0]=4 217 B13R1.373 CCSc1cc(ccn1)NC(=O)C 62a_100000210202_100000238608 [1,0,0,0,0,0|3,0,0]=4 218 B13R1.373 CCSc1cccc(c1)CC(=O)C 62a_100000210202_100000689217 [1,0,0,0,0,0|3,0,0]=4 219 B13R1.373 CCSc1cccc(c1)CC(=O)C 62a_100000689217_100000210202 [1,0,0,0,0,0|3,0,0]=4 220 B13R1.373 CCSc1cccc(c1)NC(=O)C 62a_100000210202_100000153616 [1,0,0,0,0,0|2,0,0]=3 221 B13R1.373 CCSc1cccc(c1)NC(=O)N 62a_100000210202_100000238923 [1,0,0,0,0,0|3,0,0]=4 222 B13R1.373 CCSc1cccc(c1)OC(=O)C 62a_100000210202_100009811612 [1,0,0,0,0,0|3,0,0]=4 223 B13R1.373 CCSc1cccc(n1)NC(=O)C 62a_100000210202_200011307899 [1,0,0,0,0,0|3,0,0]=4 224 B13R1.373 CCSc1ccnc(c1)NC(=O)C 62a_100000210202_100012362434 [1,0,0,0,0,0|3,0,0]=4 225 B13R1.373 CCSc1cncc(c1)NC(=O)C 62a_100000210202_100012351681 [1,0,0,0,0,0|3,0,0]=4 226 B13R1.373 CNCc1cccc(c1)C=C(C)C 271570a_100102525489_100000187585 [1,0,0,0,0,0|3,0,0]=4 227 B13R1.373 CNCc1cccc(c1)NC(=O)C 207a_100102657272_100011257792 [1,0,0,0,0,0|1,0,0]=2 228 B13R1.373 CNCc1cccc(c1)NC(=O)C 2230a_100000740035_200000210301 [1,0,0,0,0,0|1,0,0]=2 229 B13R1.373 CNCc1cccc(c1)NC(=O)C 270004a_106832991635_100011257792 [1,0,0,0,0,0|1,0,0]=2 230 B13R1.373 CNCc1cccc(c1)NC(=O)C 34a_100000740035_200000210301 [1,0,0,0,0,0|1,0,0]=2 231 B13R1.373 CNCc1cccc(c1)OC(=O)C 207a_100102657272_100000014719 [1,0,0,0,0,0|2,0,0]=3 232 B13R1.373 CNCc1cccc(c1)OC(=O)C 2230a_106832991635_200009816940 [1,0,0,0,0,0|2,0,0]=3 233 B13R1.373 CNCc1cccc(c1)OC(=O)C 270004a_106832991635_100000014719 [1,0,0,0,0,0|2,0,0]=3 234 B13R1.373 CNCc1cccc(c1)OC(=O)C 34a_100102657272_200009816940 [1,0,0,0,0,0|2,0,0]=3 235 B13R1.373 CNCc1cccc(c1)OC(=O)C 7a_106832991635_200009816940 [1,0,0,0,0,0|2,0,0]=3 236 B13R1.373 COCc1cccc(c1)C=C(C)C 271570a_100102525489_100011493687 [1,0,0,0,0,0|2,0,0]=3 237 B13R1.373 COCc1cccc(c1)NC(=O)C 11a_100000737370_100015343762 [1,0,0,0,0,0|0,0,0]=1 238 B13R1.373 COCc1cccc(c1)NC(=O)C 1626a_100000737370_100015343762 [1,0,0,0,0,0|0,0,0]=1 239 B13R1.373 COCc1cccc(c1)NC(=O)C 22a_100000737370_100000070787 [1,0,0,0,0,0|0,0,0]=1 240 B13R1.373 COCc1cccc(c1)NC(=O)C 527a_100000737370_100103153847 [1,0,0,0,0,0|0,0,0]=1 241 B13R1.373 COCc1cccc(c1)NC(C)C 2230a_100000737370_100000210206 [1,0,0,0,0,0|1,0,1]=3 242 B13R1.373 COCc1cccc(c1)NC(C)C 34a_100000737370_100000210206 [1,0,0,0,0,0|1,0,1]=3 243 B13R1.373 COCc1cccc(c1)OC(=O)C 34a_100138415774_200009816940 [1,0,0,0,0,0|1,0,0]=2 244 B13R1.373 COCc1cccc(c1)SC(C)C 62a_100000210206_100011493687 [1,0,0,0,0,0|2,0,1]=4 245 B13R1.373 COCc1cccc(c1)SC(C)C 62a_100011493687_100000210206 [1,0,0,0,0,0|2,0,1]=4 246 B13R1.373 CSCc1cccc(c1)OC(=O)C 62a_200000210301_200009816940 [1,0,0,0,0,0|1,1,0]=3 247 B13R1.373 CSCc1cccc(c1)OC(=O)C 62a_200009816940_200000210301 [1,0,0,0,0,0|1,1,0]=3 248 B13R1.384 CC=Cc1cc(ccc1C)COC 271570a_100016259895_200015395492 [1,0,0,0,0,0|2,0,0]=3 249 B13R1.384 CC=Cc1cc(ccc1F)COC 271570a_100016259895_200011493689 [1,0,0,0,0,0|2,0,0]=3 250 B13R1.384 CCNc1cc(ccc1Br)COC 34a_200013033220_100000210202 [1,0,0,0,0,0|1,0,1]=3 251 B13R1.384 CCOc1cc(ccc1O)CNC 34a_200000751567_200000210301 [1,0,0,0,0,0|2,0,1]=4 252 B13R1.384 CCOc1cc(ccc1O)CN[13CH3] 34a_200000751567_200025704644 [1,0,0,0,0,0|2,0,1]=4 253 B13R1.384 CCSc1cc(ccc1C)COC 62a_100000210202_200015395492 [1,0,0,0,0,0|2,0,1]=4 254 B13R1.384 CCSc1cc(ccc1C)COC 62a_200015395492_100000210202 [1,0,0,0,0,0|2,0,1]=4 255 B13R1.384 CCSc1cc(ccc1F)COC 62a_100000210202_200011493689 [1,0,0,0,0,0|2,0,1]=4 256 B13R1.384 CCSc1cc(ccc1F)COC 62a_200011493689_100000210202 [1,0,0,0,0,0|2,0,1]=4 257 B13R1.384 COCc1ccc(c(c1)NCF)Br 34a_200013033220_100015361967 [1,0,0,0,0,0|2,0,1]=4 258 B15R1.901 CC(=O)Cc1cc(ccc1O)C=C(C)C 271570a_100102525489_200010006938 [0,1,0,0,0,0|2,0,1]=4 259 B15R1.901 CC(=O)Cc1cc(ccc1O)SC(C)C 62a_100000210206_200010006938 [0,1,0,0,0,0|3,0,0]=4 260 B15R1.901 CC(=O)Cc1cc(ccc1O)SC(C)C 62a_200010006938_100000210206 [0,1,0,0,0,0|3,0,0]=4 261 B15R1.901 CC(=O)Cc1ccc(c(c1)C=C(C)C)O 271570a_100102525489_100010141077 [0,1,0,0,0,0|3,0,0]=4 262 B15R1.901 CC(=O)Nc1cc(ccc1C)C=C(C)C 271570a_100102525489_100011344836 [0,1,0,0,0,0|2,0,1]=4 263 B15R1.901 CC(=O)Nc1cc(ccc1C)NC(C)C 34a_100000740626_100000210206 [0,1,0,0,0,0|3,0,0]=4 264 B15R1.901 CC(=O)Nc1cc(ccc1C)NC(C)C 7a_100000740626_100000210206 [0,1,0,0,0,0|3,0,0]=4 265 B15R1.901 CC(=O)Nc1cc(ccc1C)SC(C)C 62a_100000210206_100011344836 [0,1,0,0,0,0|3,0,0]=4 266 B15R1.901 CC(=O)Nc1cc(ccc1Cl)NC(C)C 34a_100000745429_100000210206 [0,1,0,0,0,0|3,0,0]=4 267 B15R1.901 CC(=O)Nc1cc(ccc1Cl)NC(C)C 7a_100000745429_100000210206 [0,1,0,0,0,0|3,0,0]=4 268 B15R1.901 CC(=O)Nc1cc(ccc1F)C=C(C)C 271570a_100102525489_200011951791 [0,1,0,0,0,0|2,0,1]=4 269 B15R1.901 CC(=O)Nc1cc(ccc1F)NC(C)C 34a_100000736141_100000210206 [0,1,0,0,0,0|3,0,0]=4 270 B15R1.901 CC(=O)Nc1cc(ccc1F)NC(C)C 7a_100000736141_100000210206 [0,1,0,0,0,0|3,0,0]=4 271 B15R1.901 CC(=O)Nc1cc(ccc1F)SC(C)C 62a_100000210206_200011951791 [0,1,0,0,0,0|3,0,0]=4 272 B15R1.901 CC(=O)Nc1cc(ccc1O)NC(C)C 34a_100000070259_100000210206 [0,1,0,0,0,0|2,0,0]=3 273 B15R1.901 CC(=O)Nc1cc(ccc1O)NC(C)C 7a_100000070259_100000210206 [0,1,0,0,0,0|2,0,0]=3 274 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)C 11a_100000739390_100015343762 [0,1,0,0,0,0|3,0,0]=4 275 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)C 11a_100000740626_100015343762 [0,1,0,0,0,0|3,0,0]=4 276 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)C 1626a_100000739390_100015343762 [0,1,0,0,0,0|3,0,0]=4 277 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)C 1626a_100000740626_100015343762 [0,1,0,0,0,0|3,0,0]=4 278 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)C 22a_100000739390_100000070787 [0,1,0,0,0,0|3,0,0]=4 279 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)C 22a_100000740626_100000070787 [0,1,0,0,0,0|3,0,0]=4 280 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)C 527a_100000739390_100103153847 [0,1,0,0,0,0|3,0,0]=4 281 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)C 527a_100000740626_100103153847 [0,1,0,0,0,0|3,0,0]=4 282 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)Cl 11a_100000742996_100015343762 [0,1,0,0,0,0|3,0,0]=4 283 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)Cl 11a_100000745429_100015343762 [0,1,0,0,0,0|3,0,0]=4 284 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)Cl 1626a_100000742996_100015343762 [0,1,0,0,0,0|3,0,0]=4 285 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)Cl 1626a_100000745429_100015343762 [0,1,0,0,0,0|3,0,0]=4 286 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)Cl 22a_100000742996_100000070787 [0,1,0,0,0,0|3,0,0]=4 287 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)Cl 22a_100000745429_100000070787 [0,1,0,0,0,0|3,0,0]=4 288 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)Cl 527a_100000745429_100103153847 [0,1,0,0,0,0|3,0,0]=4 289 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)F 11a_100000736141_100015343762 [0,1,0,0,0,0|3,0,0]=4 290 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)F 11a_106454645589_100015343762 [0,1,0,0,0,0|3,0,0]=4 291 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)F 1626a_100000736141_100015343762 [0,1,0,0,0,0|3,0,0]=4 292 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)F 1626a_106454645589_100015343762 [0,1,0,0,0,0|3,0,0]=4 293 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)F 22a_100000736141_100000070787 [0,1,0,0,0,0|3,0,0]=4 294 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)F 22a_106454645589_100000070787 [0,1,0,0,0,0|3,0,0]=4 295 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)F 527a_100000736141_100103153847 [0,1,0,0,0,0|3,0,0]=4 296 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)F 527a_106454645589_100103153847 [0,1,0,0,0,0|3,0,0]=4 297 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)O 22a_100000070259_100000070787 [0,1,0,0,0,0|2,0,0]=3 298 B15R1.901 CC(=O)Nc1ccc(c(c1)NC(=O)C)O 527a_100000070259_100103153847 [0,1,0,0,0,0|2,0,0]=3 299 B15R1.991 CCC(=O)c1ccc(c(c1)NC(=O)C)C 1458a_100000194935_100000210202 [0,1,0,0,0,0|2,0,1]=4 300 B15R1.991 CCC(=O)c1ccc(c(c1)NC(=O)C)F 1458a_100000744603_100000210202 [0,1,0,0,0,0|2,0,1]=4 301 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 11a_100000737617_100015343762 [0,1,0,0,0,0|2,0,1]=4 302 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 11a_106832991635_100000194935 [0,1,0,0,0,0|2,0,1]=4 303 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 1626a_100000737617_100015343762 [0,1,0,0,0,0|2,0,1]=4 304 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 1626a_100102657272_100000194935 [0,1,0,0,0,0|2,0,1]=4 305 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 22a_100000737617_100000070787 [0,1,0,0,0,0|2,0,1]=4 306 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 240690a_100102657272_100000194935 [0,1,0,0,0,0|2,0,1]=4 307 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 527a_100000737617_100103153847 [0,1,0,0,0,0|2,0,1]=4 308 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 527a_100102657272_100000194935 [0,1,0,0,0,0|2,0,1]=4 309 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)Cl 11a_100000740709_100015343762 [0,1,0,0,0,0|2,0,1]=4 310 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)Cl 1626a_100000740709_100015343762 [0,1,0,0,0,0|2,0,1]=4 311 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)F 11a_100011295210_100015343762 [0,1,0,0,0,0|2,0,1]=4 312 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)F 11a_106832991635_100000744603 [0,1,0,0,0,0|2,0,1]=4 313 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)F 1626a_100011295210_100015343762 [0,1,0,0,0,0|2,0,1]=4 314 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)F 1626a_100102657272_100000744603 [0,1,0,0,0,0|2,0,1]=4 315 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)F 22a_100011295210_100000070787 [0,1,0,0,0,0|2,0,1]=4 316 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)F 240690a_100102657272_100000744603 [0,1,0,0,0,0|2,0,1]=4 317 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)F 527a_100011295210_100103153847 [0,1,0,0,0,0|2,0,1]=4 318 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)F 527a_100102657272_100000744603 [0,1,0,0,0,0|2,0,1]=4 319 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)O 240690a_100102657272_100011219828 [0,1,0,0,0,0|1,0,1]=3 320 B15R1.991 COC(=O)c1ccc(c(c1)C=C(C)C)O 271570a_100102525489_100000216328 [0,1,0,0,0,0|2,0,1]=4 321 B15R1.991 COC(=O)c1ccc(c(c1)CC(=O)C)Br 1458a_100000070787_100012232407 [0,1,0,0,0,0|2,0,1]=4 322 B15R1.991 COC(=O)c1ccc(c(c1)CC(=O)C)Cl 1458a_100000070787_100000698984 [0,1,0,0,0,0|2,0,1]=4 323 B15R1.991 COC(=O)c1ccc(c(c1)NC(=O)C)Br 188690a_100011450966_100015343762 [0,1,0,0,0,0|1,0,1]=3 324 B15R1.991 COC(=O)c1ccc(c(c1)NC(=O)C)C 188690a_100000742527_100015343762 [0,1,0,0,0,0|1,0,1]=3 325 B15R1.991 COC(=O)c1ccc(c(c1)NC(=O)C)F 188690a_100000735820_100015343762 [0,1,0,0,0,0|1,0,1]=3 326 B15R1.991 COC(=O)c1ccc(c(c1)NC(=O)C)O 188690a_100000724433_100015343762 [0,1,0,0,0,0|0,0,1]=2 327 B15R1.1058 C#CCNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_100000184674 [0,1,0,0,0,0|2,0,1]=4 328 B15R1.1058 C#CCNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_100000038162 [0,1,0,0,0,0|2,0,1]=4 329 B15R1.1058 C#CCNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_100000184674 [0,1,0,0,0,0|2,0,1]=4 330 B15R1.1058 C#CCNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_100000038162 [0,1,0,0,0,0|2,0,1]=4 331 B15R1.1058 C#CCNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_100000184674 [0,1,0,0,0,0|2,0,1]=4 332 B15R1.1058 C#CCNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_100000038162 [0,1,0,0,0,0|2,0,1]=4 333 B15R1.1058 C#CCNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100000184674 [0,1,0,0,0,0|1,0,1]=3 334 B15R1.1058 C#CCNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000038162 [0,1,0,0,0,0|1,0,1]=3 335 B15R1.1058 C#CCSc1ccc(c(c1)CC(=O)C)O 62a_100000038162_200010006938 [0,1,0,0,0,0|2,0,1]=4 336 B15R1.1058 C#CCSc1ccc(c(c1)NC(=O)C)C 62a_100000038162_100011344836 [0,1,0,0,0,0|2,0,1]=4 337 B15R1.1058 C#CCSc1ccc(c(c1)NC(=O)C)F 62a_100000038162_200011951791 [0,1,0,0,0,0|2,0,1]=4 338 B15R1.1058 C=CCNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_100015514636 [0,1,0,0,0,0|2,0,1]=4 339 B15R1.1058 C=CCNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_100015514636 [0,1,0,0,0,0|2,0,1]=4 340 B15R1.1058 C=CCNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_100015514636 [0,1,0,0,0,0|2,0,1]=4 341 B15R1.1058 C=CCNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_100015514636 [0,1,0,0,0,0|2,0,1]=4 342 B15R1.1058 C=CCNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_100015514636 [0,1,0,0,0,0|2,0,1]=4 343 B15R1.1058 C=CCNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_100015514636 [0,1,0,0,0,0|2,0,1]=4 344 B15R1.1058 C=CCNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100015514636 [0,1,0,0,0,0|1,0,1]=3 345 B15R1.1058 C=CCNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100015514636 [0,1,0,0,0,0|1,0,1]=3 346 B15R1.1058 C=CCSc1ccc(c(c1)CC(=O)C)O 62a_100000210623_200010006938 [0,1,0,0,0,0|2,0,1]=4 347 B15R1.1058 C=CCSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100000210623 [0,1,0,0,0,0|2,0,1]=4 348 B15R1.1058 C=CCSc1ccc(c(c1)NC(=O)C)C 62a_100000210623_100011344836 [0,1,0,0,0,0|2,0,1]=4 349 B15R1.1058 C=CCSc1ccc(c(c1)NC(=O)C)F 62a_100000210623_200011951791 [0,1,0,0,0,0|2,0,1]=4 350 B15R1.1058 CC(=O)Cc1cc(ccc1O)SCC#N 62a_100011215382_200010006938 [0,1,0,0,0,0|3,0,0]=4 351 B15R1.1058 CC(=O)Cc1cc(ccc1O)SCC#N 62a_200010006938_100011215382 [0,1,0,0,0,0|3,0,0]=4 352 B15R1.1058 CC(=O)Cc1cc(ccc1O)SCC=O 62a_200010006938_200015260668 [0,1,0,0,0,0|3,0,0]=4 353 B15R1.1058 CC(=O)Cc1cc(ccc1O)SCC=O 62a_200015260668_200010006938 [0,1,0,0,0,0|3,0,0]=4 354 B15R1.1058 CC(=O)Cc1cc(ccc1O)SCCF 62a_100011217306_200010006938 [0,1,0,0,0,0|3,0,0]=4 355 B15R1.1058 CC(=O)Cc1cc(ccc1O)SCCF 62a_200010006938_100011217306 [0,1,0,0,0,0|3,0,0]=4 356 B15R1.1058 CC(=O)Cc1cc(ccc1O)SCCO 62a_100000211926_200010006938 [0,1,0,0,0,0|3,0,0]=4 357 B15R1.1058 CC(=O)Cc1cc(ccc1O)SCCO 62a_200010006938_100000211926 [0,1,0,0,0,0|3,0,0]=4 358 B15R1.1058 CC(=O)Nc1cc(ccc1C)NCC#N 7a_100000740626_100011215382 [0,1,0,0,0,0|3,0,0]=4 359 B15R1.1058 CC(=O)Nc1cc(ccc1C)NCC=O 34a_100000740626_200009817547 [0,1,0,0,0,0|3,0,0]=4 360 B15R1.1058 CC(=O)Nc1cc(ccc1C)NCC=O 7a_100000740626_200015260668 [0,1,0,0,0,0|3,0,0]=4 361 B15R1.1058 CC(=O)Nc1cc(ccc1C)NCCF 34a_100000740626_100011217306 [0,1,0,0,0,0|3,0,0]=4 362 B15R1.1058 CC(=O)Nc1cc(ccc1C)NCCF 7a_100000740626_100011217306 [0,1,0,0,0,0|3,0,0]=4 363 B15R1.1058 CC(=O)Nc1cc(ccc1C)NCCO 34a_100000740626_100000211926 [0,1,0,0,0,0|3,0,0]=4 364 B15R1.1058 CC(=O)Nc1cc(ccc1C)NCCO 7a_100000740626_100000211926 [0,1,0,0,0,0|3,0,0]=4 365 B15R1.1058 CC(=O)Nc1cc(ccc1C)OCCO 22a_100012283766_100000070787 [0,1,0,0,0,0|3,0,0]=4 366 B15R1.1058 CC(=O)Nc1cc(ccc1C)OCCO 527a_100012283766_100103153847 [0,1,0,0,0,0|3,0,0]=4 367 B15R1.1058 CC(=O)Nc1cc(ccc1C)SCC#N 62a_100011215382_100011344836 [0,1,0,0,0,0|3,0,0]=4 368 B15R1.1058 CC(=O)Nc1cc(ccc1C)SCC=O 62a_200015260668_100011344836 [0,1,0,0,0,0|3,0,0]=4 369 B15R1.1058 CC(=O)Nc1cc(ccc1C)SCCF 62a_100011217306_100011344836 [0,1,0,0,0,0|3,0,0]=4 370 B15R1.1058 CC(=O)Nc1cc(ccc1C)SCCO 62a_100000211926_100011344836 [0,1,0,0,0,0|3,0,0]=4 371 B15R1.1058 CC(=O)Nc1cc(ccc1Cl)NCC#N 7a_100000745429_100011215382 [0,1,0,0,0,0|3,0,0]=4 372 B15R1.1058 CC(=O)Nc1cc(ccc1Cl)NCC=O 34a_100000745429_200009817547 [0,1,0,0,0,0|3,0,0]=4 373 B15R1.1058 CC(=O)Nc1cc(ccc1Cl)NCC=O 7a_100000745429_200015260668 [0,1,0,0,0,0|3,0,0]=4 374 B15R1.1058 CC(=O)Nc1cc(ccc1Cl)NCCF 34a_100000745429_100011217306 [0,1,0,0,0,0|3,0,0]=4 375 B15R1.1058 CC(=O)Nc1cc(ccc1Cl)NCCF 7a_100000745429_100011217306 [0,1,0,0,0,0|3,0,0]=4 376 B15R1.1058 CC(=O)Nc1cc(ccc1Cl)NCCO 34a_100000745429_100000211926 [0,1,0,0,0,0|3,0,0]=4 377 B15R1.1058 CC(=O)Nc1cc(ccc1Cl)NCCO 7a_100000745429_100000211926 [0,1,0,0,0,0|3,0,0]=4 378 B15R1.1058 CC(=O)Nc1cc(ccc1F)NCC#N 7a_100000736141_100011215382 [0,1,0,0,0,0|3,0,0]=4 379 B15R1.1058 CC(=O)Nc1cc(ccc1F)NCC=O 34a_100000736141_200009817547 [0,1,0,0,0,0|3,0,0]=4 380 B15R1.1058 CC(=O)Nc1cc(ccc1F)NCC=O 7a_100000736141_200015260668 [0,1,0,0,0,0|3,0,0]=4 381 B15R1.1058 CC(=O)Nc1cc(ccc1F)NCCF 34a_100000736141_100011217306 [0,1,0,0,0,0|3,0,0]=4 382 B15R1.1058 CC(=O)Nc1cc(ccc1F)NCCF 7a_100000736141_100011217306 [0,1,0,0,0,0|3,0,0]=4 383 B15R1.1058 CC(=O)Nc1cc(ccc1F)NCCO 34a_100000736141_100000211926 [0,1,0,0,0,0|3,0,0]=4 384 B15R1.1058 CC(=O)Nc1cc(ccc1F)NCCO 7a_100000736141_100000211926 [0,1,0,0,0,0|3,0,0]=4 385 B15R1.1058 CC(=O)Nc1cc(ccc1F)SCC#N 62a_100011215382_200011951791 [0,1,0,0,0,0|3,0,0]=4 386 B15R1.1058 CC(=O)Nc1cc(ccc1F)SCC=O 62a_200015260668_200011951791 [0,1,0,0,0,0|3,0,0]=4 387 B15R1.1058 CC(=O)Nc1cc(ccc1F)SCCF 62a_100011217306_200011951791 [0,1,0,0,0,0|3,0,0]=4 388 B15R1.1058 CC(=O)Nc1cc(ccc1F)SCCO 62a_100000211926_200011951791 [0,1,0,0,0,0|3,0,0]=4 389 B15R1.1058 CC(=O)Nc1cc(ccc1O)NCC#N 7a_100000070259_100011215382 [0,1,0,0,0,0|2,0,0]=3 390 B15R1.1058 CC(=O)Nc1cc(ccc1O)NCC=O 34a_100000070259_200009817547 [0,1,0,0,0,0|2,0,0]=3 391 B15R1.1058 CC(=O)Nc1cc(ccc1O)NCC=O 7a_100000070259_200015260668 [0,1,0,0,0,0|2,0,0]=3 392 B15R1.1058 CC(=O)Nc1cc(ccc1O)NCCF 34a_100000070259_100011217306 [0,1,0,0,0,0|2,0,0]=3 393 B15R1.1058 CC(=O)Nc1cc(ccc1O)NCCF 7a_100000070259_100011217306 [0,1,0,0,0,0|2,0,0]=3 394 B15R1.1058 CC(=O)Nc1cc(ccc1O)NCCO 34a_100000070259_100000211926 [0,1,0,0,0,0|2,0,0]=3 395 B15R1.1058 CC(=O)Nc1cc(ccc1O)NCCO 7a_100000070259_100000211926 [0,1,0,0,0,0|2,0,0]=3 396 B15R1.1058 CCCCc1ccc(c(c1)CC(=O)C)O 271570a_100020621405_200010006938 [0,1,0,0,0,0|2,0,0]=3 397 B15R1.1058 CCCCc1ccc(c(c1)NC(=O)C)C 271570a_100020621405_100011344836 [0,1,0,0,0,0|2,0,0]=3 398 B15R1.1058 CCCCc1ccc(c(c1)NC(=O)C)F 271570a_100020621405_200011951791 [0,1,0,0,0,0|2,0,0]=3 399 B15R1.1058 CCCCc1ccc(c(c1)OC(=O)C)C 271570a_100020621405_100103282185 [0,1,0,0,0,0|3,0,0]=4 400 B15R1.1058 CCCCc1cnc(c(c1)NC(=O)C)C 271570a_100020621405_100010117071 [0,1,0,0,0,0|3,0,0]=4 401 B15R1.1058 CCCNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_100000210303 [0,1,0,0,0,0|2,0,0]=3 402 B15R1.1058 CCCNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_100000210303 [0,1,0,0,0,0|2,0,0]=3 403 B15R1.1058 CCCNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_100000210303 [0,1,0,0,0,0|2,0,0]=3 404 B15R1.1058 CCCNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_100000210303 [0,1,0,0,0,0|2,0,0]=3 405 B15R1.1058 CCCNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_100000210303 [0,1,0,0,0,0|2,0,0]=3 406 B15R1.1058 CCCNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_100000210303 [0,1,0,0,0,0|2,0,0]=3 407 B15R1.1058 CCCNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100000210303 [0,1,0,0,0,0|1,0,0]=2 408 B15R1.1058 CCCNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000210303 [0,1,0,0,0,0|1,0,0]=2 409 B15R1.1058 CCCSc1ccc(c(c1)CC(=O)C)O 62a_100000210303_200010006938 [0,1,0,0,0,0|2,0,0]=3 410 B15R1.1058 CCCSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100000210303 [0,1,0,0,0,0|2,0,0]=3 411 B15R1.1058 CCCSc1ccc(c(c1)NC(=O)C)C 62a_100000210303_100011344836 [0,1,0,0,0,0|2,0,0]=3 412 B15R1.1058 CCCSc1ccc(c(c1)NC(=O)C)F 62a_100000210303_200011951791 [0,1,0,0,0,0|2,0,0]=3 413 B15R1.1058 CCCSc1ccc(c(c1)OC(=O)C)C 62a_100000210303_100103282185 [0,1,0,0,0,0|3,0,0]=4 414 B15R1.1058 CCCSc1ccc(c(c1)OC(=O)C)C 62a_100103282185_100000210303 [0,1,0,0,0,0|3,0,0]=4 415 B15R1.1058 CCCSc1cnc(c(c1)NC(=O)C)C 62a_100000210303_100010117071 [0,1,0,0,0,0|3,0,0]=4 416 B15R1.1058 CCCSc1cnc(c(c1)NC(=O)C)C 62a_100010117071_100000210303 [0,1,0,0,0,0|3,0,0]=4 417 B15R1.1058 COCOc1ccc(c(c1)C=C(C)C)C 271570a_100102525489_200015918306 [0,1,0,0,0,0|3,0,0]=4 418 B15R1.1058 COCSc1ccc(c(c1)CC(=O)C)O 62a_100000766300_200010006938 [0,1,0,0,0,0|1,0,0]=2 419 B15R1.1058 COCSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100000766300 [0,1,0,0,0,0|1,0,0]=2 420 B15R1.1058 COCSc1ccc(c(c1)NC(=O)C)C 62a_100000766300_100011344836 [0,1,0,0,0,0|1,0,0]=2 421 B15R1.1058 COCSc1ccc(c(c1)NC(=O)C)F 62a_100000766300_200011951791 [0,1,0,0,0,0|1,0,0]=2 422 B15R1.1058 COCSc1ccc(c(c1)NC(C)C)C 62a_100000766300_200000714908 [0,1,0,0,0,0|2,0,1]=4 423 B15R1.1058 COCSc1ccc(c(c1)NC(C)C)C 62a_200000714908_100000766300 [0,1,0,0,0,0|2,0,1]=4 424 B15R1.1058 COCSc1ccc(c(c1)OC(=O)C)C 62a_100000766300_100103282185 [0,1,0,0,0,0|2,0,0]=3 425 B15R1.1058 COCSc1ccc(c(c1)OC(=O)C)C 62a_100103282185_100000766300 [0,1,0,0,0,0|2,0,0]=3 426 B15R1.1058 COCSc1cnc(c(c1)NC(=O)C)C 62a_100000766300_100010117071 [0,1,0,0,0,0|2,0,0]=3 427 B15R1.1058 COCSc1cnc(c(c1)NC(=O)C)C 62a_100010117071_100000766300 [0,1,0,0,0,0|2,0,0]=3 428 B15R1.1058 CSCNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_100011218213 [0,1,0,0,0,0|1,1,0]=3 429 B15R1.1058 CSCNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_100011218213 [0,1,0,0,0,0|1,1,0]=3 430 B15R1.1058 CSCNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_100011218213 [0,1,0,0,0,0|1,1,0]=3 431 B15R1.1058 CSCNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100011218213 [0,1,0,0,0,0|0,1,0]=2 432 B15R1.1058 CSCSc1ccc(c(c1)CC(=O)C)O 62a_100011218213_200010006938 [0,1,0,0,0,0|1,1,0]=3 433 B15R1.1058 CSCSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100011218213 [0,1,0,0,0,0|1,1,0]=3 434 B15R1.1058 CSCSc1ccc(c(c1)NC(=O)C)C 62a_100011218213_100011344836 [0,1,0,0,0,0|1,1,0]=3 435 B15R1.1058 CSCSc1ccc(c(c1)NC(=O)C)F 62a_100011218213_200011951791 [0,1,0,0,0,0|1,1,0]=3 436 B15R1.1058 CSCSc1ccc(c(c1)OC(=O)C)C 62a_100011218213_100103282185 [0,1,0,0,0,0|2,1,0]=4 437 B15R1.1058 CSCSc1ccc(c(c1)OC(=O)C)C 62a_100103282185_100011218213 [0,1,0,0,0,0|2,1,0]=4 438 B15R1.1058 CSCSc1cnc(c(c1)NC(=O)C)C 62a_100010117071_100011218213 [0,1,0,0,0,0|2,1,0]=4 439 B15R1.1058 CSCSc1cnc(c(c1)NC(=O)C)C 62a_100011218213_100010117071 [0,1,0,0,0,0|2,1,0]=4 440 B15R1.3888 CC=Cc1cc(c(cc1F)F)NC(=O)C 271570a_100016259895_200013902858 [0,1,0,0,0,0|2,0,1]=4 441 B15R1.3888 CCOc1cc(c(cc1Cl)Cl)NC(=O)C 34a_200000039401_100000210202 [0,1,0,0,0,0|3,0,0]=4 442 B15R1.3888 CCOc1cc(c(cc1Cl)Cl)NC(=O)C 7a_200000039401_100000210202 [0,1,0,0,0,0|3,0,0]=4 443 B15R1.3888 CCSc1cc(c(cc1F)F)NC(=O)C 62a_100000210202_200013902858 [0,1,0,0,0,0|3,0,0]=4 444 B15R1.3888 CCSc1cc(c(cc1F)F)NC(=O)C 62a_200013902858_100000210202 [0,1,0,0,0,0|3,0,0]=4 445 B15R1.3888 CNCc1cc(c(cc1Cl)Cl)NC(=O)C 26a_100102657272_200000039401 [0,1,0,0,0,0|2,0,0]=3 446 B15R1.9633 COCc1ccc(c(c1)NC(C)(C)C)Br 34a_200013033220_100000210625 [0,1,0,0,0,0|2,0,1]=4 447 B15R1.9655 COCc1ccc(c(c1)C(=C(C)C)C)C 271570a_200000049429_200015395492 [0,1,0,0,0,0|3,0,0]=4 448 B15R1.9655 COCc1ccc(c(c1)C(=C(C)C)C)F 271570a_200000049429_200011493689 [0,1,0,0,0,0|3,0,0]=4 449 B15R1.9656 C=C=Cc1ccc(c(c1)NC(=O)C)OC 271570a_100015277604_200011407902 [0,1,0,0,0,0|1,0,2]=4 450 B15R1.9656 CC=Cc1ccc(c(c1)CC(=O)C)OC 271570a_100016259895_200011493461 [0,1,0,0,0,0|2,0,1]=4 451 B15R1.9656 CC=Cc1ccc(c(c1)NC(=O)C)OC 271570a_100016259895_200011407902 [0,1,0,0,0,0|1,0,1]=3 452 B15R1.9656 CC=Cc1ccc(c(c1)OC(=O)C)OC 271570a_100016259895_200011016479 [0,1,0,0,0,0|2,0,1]=4 453 B15R1.9656 CCNc1ccc(c(c1)NC(=O)C)OC 34a_100000736378_100000210202 [0,1,0,0,0,0|2,0,0]=3 454 B15R1.9656 CCNc1ccc(c(c1)NC(=O)C)OC 7a_100000736378_100000210202 [0,1,0,0,0,0|2,0,0]=3 455 B15R1.9656 CCSc1ccc(c(c1)CC(=O)C)OC 62a_200011493461_100000210202 [0,1,0,0,0,0|3,0,0]=4 456 B15R1.9656 CCSc1ccc(c(c1)NC(=O)C)OC 62a_100000210202_200011407902 [0,1,0,0,0,0|2,0,0]=3 457 B15R1.9656 CNCc1ccc(c(c1)OC(=O)C)OC 207a_100102657272_100000014717 [0,1,0,0,0,0|2,0,0]=3 458 B15R1.9656 CNCc1ccc(c(c1)OC(=O)C)OC 270004a_106832991635_100000014717 [0,1,0,0,0,0|2,0,0]=3 459 B15R1.9656 COc1ccc(cc1NC(=O)C)NCF 34a_100000736378_100015361967 [0,1,0,0,0,0|3,0,0]=4 460 B15R1.9656 COc1ccc(cc1NC(=O)C)NCF 7a_100000736378_100015361967 [0,1,0,0,0,0|3,0,0]=4 461 B15R1.9656 COc1ccc(cc1NC(=O)C)SCF 62a_100015361967_200011407902 [0,1,0,0,0,0|3,0,0]=4 462 B15R1.9657 C#CC(C)Nc1cc(ccc1Br)COC 34a_200013033220_200000035995 [0,1,0,0,0,0|2,0,1]=4 463 B15R1.9657 C=CC(=O)Nc1cc(ccc1Br)COC 1626a_200013033220_100000185746 [0,1,0,0,0,0|1,0,1]=3 464 B15R1.9657 CC=Cc1ccc(c(c1)CC(=O)OC)O 271570a_100016259895_100010185610 [0,1,0,0,0,0|2,0,1]=4 465 B15R1.9657 CCC(=O)Nc1cc(ccc1Br)COC 11a_200013033220_100000210414 [0,1,0,0,0,0|1,0,0]=2 466 B15R1.9657 CCC(=O)Nc1cc(ccc1Br)COC 1626a_200013033220_100000210414 [0,1,0,0,0,0|1,0,0]=2 467 B15R1.9657 CCC(C)Nc1cc(ccc1Br)COC 34a_200013033220_100011215416 [0,1,0,0,0,0|2,0,1]=4 468 B15R1.9657 CCNc1ccc(c(c1)NC(=O)CC)C 34a_200011193571_100000210202 [0,1,0,0,0,0|3,0,0]=4 469 B15R1.9657 CCNc1ccc(c(c1)NC(=O)CC)C 7a_200011193571_100000210202 [0,1,0,0,0,0|3,0,0]=4 470 B15R1.9657 CCSc1ccc(c(c1)CC(=O)OC)O 62a_100000210202_100010185610 [0,1,0,0,0,0|3,0,0]=4 471 B15R1.9657 CCSc1ccc(c(c1)CC(=O)OC)O 62a_100010185610_100000210202 [0,1,0,0,0,0|3,0,0]=4 472 B15R1.9657 CNC(=O)Nc1cc(ccc1Br)COC 2430a_200013033220_100102657272 [0,1,0,0,0,0|1,0,0]=2 473 B15R1.9657 COCc1ccc(c(c1)NC(C)CO)Br 34a_200013033220_100012180447 [0,1,0,0,0,0|1,0,2]=4 474 B15R1.16576 CCNc1ccc(c(c1F)NC(=O)C)F 34a_100009824841_100000210202 [0,1,0,0,0,0|3,0,0]=4 475 B15R1.16576 CCOc1ccc(c(c1F)NC(=O)C)F 11a_100000061554_100015343762 [0,1,0,0,0,0|3,0,0]=4 476 B15R1.16576 CCOc1ccc(c(c1F)NC(=O)C)F 1626a_100000061554_100015343762 [0,1,0,0,0,0|3,0,0]=4 477 B15R2.964 CC(=Cc1cc2c(cc1O)CCC2)C 271570a_100102525489_200010659162 [0,0,0,1,0,0|3,0,0]=4 478 B15R2.964 CC(=O)Nc1cc2c(cc1O)CCC2 271570a_203496583355_100010204489 [0,0,0,1,0,0|1,0,0]=2 479 B15R2.1282 C=C=Cc1ccc2c(c1)NC(=O)CO2 271570a_100015277604_100000244627 [0,0,0,1,0,0|1,0,2]=4 480 B15R2.1282 CC=Cc1ccc2c(c1)NC(=O)CC2 271570a_100016259895_100000763451 [0,0,0,1,0,0|2,0,1]=4 481 B15R2.1282 CC=Cc1ccc2c(c1)NC(=O)CO2 271570a_100016259895_100000244627 [0,0,0,1,0,0|1,0,1]=3 482 B15R2.1282 CC=Cc1ccc2c(c1)NC(=O)CS2 271570a_100016259895_100012361575 [0,0,0,1,0,0|1,1,1]=4 483 B15R2.1282 CC=Cc1ccc2c(n1)NC(=O)CO2 271570a_100016259895_100010235088 [0,0,0,1,0,0|2,0,1]=4 484 B15R2.1282 CC=Cc1cnc2c(c1)NC(=O)CO2 271570a_100016259895_100000699640 [0,0,0,1,0,0|2,0,1]=4 485 B15R2.1282 CCNc1ccc2c(c1)NC(=O)CC2 2230a_100000055022_100000210202 [0,0,0,1,0,0|3,0,0]=4 486 B15R2.1282 CCNc1ccc2c(c1)NC(=O)CC2 34a_100000055022_100000210202 [0,0,0,1,0,0|3,0,0]=4 487 B15R2.1282 CCNc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_100000210202 [0,0,0,1,0,0|2,0,0]=3 488 B15R2.1282 CCOc1ccc2c(c1)NC(=O)CC2 34a_100000708604_100000210202 [0,0,0,1,0,0|3,0,0]=4 489 B15R2.1282 CCOc1ccc2c(c1)NC(=O)CO2 34a_100009876821_100000210202 [0,0,0,1,0,0|2,0,0]=3 490 B15R2.1282 CCSc1ccc2c(c1)NC(=O)CC2 62a_100000210202_100000763451 [0,0,0,1,0,0|3,0,0]=4 491 B15R2.1282 CCSc1ccc2c(c1)NC(=O)CC2 62a_100000763451_100000210202 [0,0,0,1,0,0|3,0,0]=4 492 B15R2.1282 CCSc1cnc2c(c1)NC(=O)CO2 62a_100000210202_100000699640 [0,0,0,1,0,0|3,0,0]=4 493 B15R2.1282 CNCc1ccc2c(c1)NC(=O)CO2 270004a_106832991635_100000766376 [0,0,0,1,0,0|1,0,0]=2 494 B15R2.1282 O=C1COc2ccc(cc2N1)OCF 34a_100009876821_100015361967 [0,0,0,1,0,0|3,0,0]=4 495 B15R2.1311 COCc1ccc(c(c1)NC2CC2)Br 34a_200013033220_100000211595 [0,0,0,1,0,0|2,0,1]=4 496 B15R2.7192 CC(=O)Nc1c(ccc2c1CCC2)Br 11a_202495424074_100015343762 [0,0,0,1,0,0|2,0,0]=3 497 B15R2.7192 CC(=O)Nc1c(ccc2c1CCC2)Br 1626a_202495424074_100015343762 [0,0,0,1,0,0|2,0,0]=3 498 B15R2.7192 CC(=O)Nc1c(ccc2c1CCC2)C 11a_202495413831_100015343762 [0,0,0,1,0,0|2,0,0]=3 499 B15R2.7192 CC(=O)Nc1c(ccc2c1CCC2)C 1626a_202495413831_100015343762 [0,0,0,1,0,0|2,0,0]=3 500 B15R2.7192 CC(=O)Nc1c(ccc2c1CCC2)C 22a_202495413831_100000070787 [0,0,0,1,0,0|2,0,0]=3 501 B15R2.12842 CC=Cc1ccc(c2c1CC(=O)N2)F 271570a_100016259895_100012355367 [0,0,0,1,0,0|2,0,1]=4 502 B15R2.12842 CCSc1ccc(c2c1CC(=O)N2)F 62a_100000210202_100012355367 [0,0,0,1,0,0|3,0,0]=4 503 B15R2.18904 CC(=Cc1cc(ccc1O)C2CC2)C 271570a_100102525489_100135415898 [0,0,0,1,0,0|3,0,0]=4 504 B15R2.18904 CC(=O)Cc1cc(ccc1O)C2CC2 271570a_100011220607_200010006938 [0,0,0,1,0,0|2,0,0]=3 505 B15R2.18904 CC(=O)Nc1cc(ccc1C)C2CC2 271570a_100011220607_100011344836 [0,0,0,1,0,0|2,0,0]=3 506 B15R2.18904 CC(=O)Nc1cc(ccc1F)C2CC2 11a_102516457221_100015343762 [0,0,0,1,0,0|2,0,0]=3 507 B15R2.18904 CC(=O)Nc1cc(ccc1F)C2CC2 1626a_102516457221_100015343762 [0,0,0,1,0,0|2,0,0]=3 508 B15R2.18904 CC(=O)Nc1cc(ccc1F)C2CC2 22a_102516457221_100000070787 [0,0,0,1,0,0|2,0,0]=3 509 B15R2.18904 CC(=O)Nc1cc(ccc1F)C2CC2 271570a_100011220607_200011951791 [0,0,0,1,0,0|2,0,0]=3 510 B15R2.18904 CC(=O)Nc1cc(ccc1F)C2CC2 527a_102516457221_100103153847 [0,0,0,1,0,0|2,0,0]=3 511 B15R2.18904 CC(=O)Nc1cc(cnc1C)C2CC2 271570a_100011220607_100010117071 [0,0,0,1,0,0|3,0,0]=4 512 B15R2.18904 CC(=O)Oc1cc(ccc1C)C2CC2 271570a_100011220607_100103282185 [0,0,0,1,0,0|3,0,0]=4 513 B13R1.387 C=C(C)c1cc(ccc1C)COC 271570a_100000694244_200015395492 [0,0,0,0,1,0|2,0,0]=3 514 B13R1.387 C=C(C)c1cc(ccc1F)COC 271570a_100000694244_200011493689 [0,0,0,0,1,0|2,0,0]=3 515 B13R1.387 C=C=Cc1ccc(c(c1)C(=O)C)O 271570a_100015277604_100000212127 [0,0,0,0,1,0|1,0,2]=4 516 B13R1.387 CC=Cc1ccc(c(c1)C(=O)C)C 271570a_100016259895_100012706819 [0,0,0,0,1,0|2,0,1]=4 517 B13R1.387 CC=Cc1ccc(c(c1)C(=O)C)Cl 271570a_100016259895_100010712560 [0,0,0,0,1,0|2,0,1]=4 518 B13R1.387 CC=Cc1ccc(c(c1)C(=O)C)F 271570a_100016259895_100000689017 [0,0,0,0,1,0|2,0,1]=4 519 B13R1.387 CC=Cc1ccc(c(c1)C(=O)C)N 271570a_100016259895_100000695420 [0,0,0,0,1,0|2,0,1]=4 520 B13R1.387 CC=Cc1ccc(c(c1)C(=O)C)O 271570a_100016259895_100000212127 [0,0,0,0,1,0|1,0,1]=3 521 B13R1.387 CC=Cc1ccc(c(c1)C(=O)N)O 271570a_100016259895_100000192807 [0,0,0,0,1,0|2,0,1]=4 522 B13R1.387 CCOc1ccc(c(c1)C(=O)C)Cl 34a_100009867868_100000210202 [0,0,0,0,1,0|3,0,0]=4 523 B13R1.387 CCOc1ccc(c(c1)C(=O)C)Cl 7a_100009867868_100000210202 [0,0,0,0,1,0|3,0,0]=4 524 B13R1.387 CCOc1ccc(c(c1)C(=O)C)F 34a_100000091700_100000210202 [0,0,0,0,1,0|3,0,0]=4 525 B13R1.387 CCOc1ccc(c(c1)C(=O)C)F 7a_100000091700_100000210202 [0,0,0,0,1,0|3,0,0]=4 526 B13R1.387 CCOc1ccc(c(c1)C(=O)C)O 1458a_200011255221_200000210301 [0,0,0,0,1,0|2,0,0]=3 527 B13R1.387 CCOc1ccc(c(c1)C(=O)[13CH3])O 1458a_200011255221_200025704644 [0,0,0,0,1,0|2,0,0]=3 528 B13R1.387 CCSc1ccc(c(c1)C(=O)C)C 62a_100012706819_100000210202 [0,0,0,0,1,0|3,0,0]=4 529 B13R1.387 CCSc1ccc(c(c1)C(=O)C)Cl 62a_100010712560_100000210202 [0,0,0,0,1,0|3,0,0]=4 530 B13R1.387 CCSc1ccc(c(c1)C(=O)C)F 62a_100000210202_100010254839 [0,0,0,0,1,0|3,0,0]=4 531 B13R1.387 CCSc1ccc(c(c1)C(=O)C)F 62a_100000689017_100000210202 [0,0,0,0,1,0|3,0,0]=4 532 B13R1.387 CCSc1ccc(c(c1)C(=O)C)N 62a_100000695420_100000210202 [0,0,0,0,1,0|3,0,0]=4 533 B13R1.387 CCSc1ccc(c(c1)C(=O)N)O 62a_100000192807_100000210202 [0,0,0,0,1,0|3,0,0]=4 534 B13R1.387 CNCc1ccc(c(c1)C(=O)C)Cl 26a_100102657272_100009867868 [0,0,0,0,1,0|2,0,0]=3 535 B13R1.387 CNCc1ccc(c(c1)[N+](=O)[O-])O 2230a_106832991635_100010149780 [0,0,0,0,1,0|3,0,0]=4 536 B13R1.387 CNCc1ccc(c(c1)[N+](=O)[O-])O 7a_106832991635_100010149780 [0,0,0,0,1,0|3,0,0]=4 537 B13R1.387 COCc1ccc(c(c1)[N+](=O)[O-])Br 34a_100138415774_100000693152 [0,0,0,0,1,0|3,0,0]=4 538 B13R1.387 COCc1ccc(c(c1)[N+](=O)[O-])C 34a_100138415774_100000042939 [0,0,0,0,1,0|3,0,0]=4 539 B13R1.387 COCc1ccc(c(c1)[N+](=O)[O-])C 7a_100011216690_200000210301 [0,0,0,0,1,0|3,0,0]=4 540 B13R1.387 COCc1ccc(c(c1)[N+](=O)[O-])Cl 7a_100000756607_200000210301 [0,0,0,0,1,0|3,0,0]=4 541 B13R1.387 COCc1ccc(c(c1)[N+](=O)[O-])F 34a_100000039452_200000210301 [0,0,0,0,1,0|3,0,0]=4 542 B13R1.387 COCc1ccc(c(c1)[N+](=O)[O-])F 34a_100138415774_100009816672 [0,0,0,0,1,0|3,0,0]=4 543 B13R1.387 COCc1ccc(c(c1)[N+](=O)[O-])F 7a_100000039452_200000210301 [0,0,0,0,1,0|3,0,0]=4 544 B13R1.387 Cc1ccc(cc1[N+](=O)[O-])CO[13CH3] 7a_100011216690_200025704644 [0,0,0,0,1,0|3,0,0]=4 545 B13R1.387 [13CH3]OCc1ccc(c(c1)[N+](=O)[O-])Cl 7a_100000756607_200025704644 [0,0,0,0,1,0|3,0,0]=4 546 B13R1.387 [13CH3]OCc1ccc(c(c1)[N+](=O)[O-])F 34a_100000039452_200025704644 [0,0,0,0,1,0|3,0,0]=4 547 B13R1.387 [13CH3]OCc1ccc(c(c1)[N+](=O)[O-])F 7a_100000039452_200025704644 [0,0,0,0,1,0|3,0,0]=4 548 B15R1.9632 C=C(C)CNc1cc(ccc1Br)COC 34a_200013033220_100000748629 [0,0,0,0,0,1|2,0,0]=3 549 B15R1.9632 C=C(C)CSc1cc(ccc1C)COC 62a_100000748629_200015395492 [0,0,0,0,0,1|3,0,0]=4 550 B15R1.9632 C=C(C)CSc1cc(ccc1C)COC 62a_200015395492_100000211660 [0,0,0,0,0,1|3,0,0]=4 551 B15R1.9632 C=C(C)CSc1cc(ccc1F)COC 62a_100000748629_200011493689 [0,0,0,0,0,1|3,0,0]=4 552 B15R1.9632 C=C(C)CSc1cc(ccc1F)COC 62a_200011493689_100000211660 [0,0,0,0,0,1|3,0,0]=4 553 B15R1.9632 C=C(F)CNc1cc(ccc1Br)COC 34a_200013033220_100009893438 [0,0,0,0,0,1|2,0,1]=4 554 B15R1.9632 COCc1ccc(c(c1)NCC(=O)N)Br 34a_200013033220_100000187820 [0,0,0,0,0,1|2,0,0]=3 555 B15R1.9632 COCc1ccc(c(c1)NCC(=O)[O-])Br 34a_200013033220_100020667443 [0,0,0,0,0,1|2,0,0]=3 556 B15R1.9632 COCc1ccc(c(c1)NCC(C)C)Br 34a_200013033220_100000210624 [0,0,0,0,0,1|2,0,1]=4 557 B15R1.9632 COCc1ccc(c(c1)NCC(C)O)Br 34a_200013033220_100011218427 [0,0,0,0,0,1|1,0,2]=4 558 B15R1.9632 COCc1ccc(c(c1)NC[C@@H](C)O)Br 34a_200013033220_100009817552 [0,0,0,0,0,1|1,0,2]=4 559 B15R1.9632 COCc1ccc(c(c1)NC[N+](=O)[O-])Br 34a_200013033220_100000761209 [0,0,0,0,0,1|3,0,0]=4 560 B15R1.9632 COCc1ccc(c(c1)SCC(=O)N)C 62a_100000747473_200015395492 [0,0,0,0,0,1|3,0,0]=4 561 B15R1.9632 COCc1ccc(c(c1)SCC(=O)N)C 62a_200015395492_100000747473 [0,0,0,0,0,1|3,0,0]=4 562 B15R1.9632 COCc1ccc(c(c1)SCC(=O)N)F 62a_100000747473_200011493689 [0,0,0,0,0,1|3,0,0]=4 563 B15R1.9632 COCc1ccc(c(c1)SCC(=O)N)F 62a_200011493689_100000747473 [0,0,0,0,0,1|3,0,0]=4 564 B15R1.9632 COCc1ccc(c(c1)SCC(=O)[O-])C 62a_100020667443_200015395492 [0,0,0,0,0,1|3,0,0]=4 565 B15R1.9632 COCc1ccc(c(c1)SCC(=O)[O-])C 62a_200015395492_100020667443 [0,0,0,0,0,1|3,0,0]=4 566 B15R1.9632 COCc1ccc(c(c1)SCC(=O)[O-])F 62a_100020667443_200011493689 [0,0,0,0,0,1|3,0,0]=4 567 B15R1.9632 COCc1ccc(c(c1)SCC(=O)[O-])F 62a_200011493689_100020667443 [0,0,0,0,0,1|3,0,0]=4 568 B12R1.127 CC(=Cc1cc(ccc1O)C)C 271570a_100102525489_100000765521 [2,0,0,0,0,0|2,0,0]=4 569 B12R1.127 CC(=Cc1cc(ccc1O)O)C 271570a_100102525489_100009813629 [2,0,0,0,0,0|2,0,0]=4 570 B12R1.127 CC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_200000210301 [2,0,0,0,0,0|2,0,0]=4 571 B12R1.127 CC(=O)Cc1cc(ccc1C)C 1458a_100000070787_100000184699 [2,0,0,0,0,0|2,0,0]=4 572 B12R1.127 CC(=O)Cc1cc(ccc1C)C 1458a_100000749331_200000210301 [2,0,0,0,0,0|2,0,0]=4 573 B12R1.127 CC(=O)Cc1cc(ccc1Cl)C 1458a_100000070787_100009871730 [2,0,0,0,0,0|2,0,0]=4 574 B12R1.127 CC(=O)Cc1cc(ccc1F)C 1458a_100000070787_100011260760 [2,0,0,0,0,0|2,0,0]=4 575 B12R1.127 CC(=O)Cc1cc(ccc1F)C 1458a_100011667363_200000210301 [2,0,0,0,0,0|2,0,0]=4 576 B12R1.127 CC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200000210301 [2,0,0,0,0,0|2,0,0]=4 577 B12R1.127 CC(=O)Cc1cc(ccc1O)F 1458a_100000070787_100010161318 [2,0,0,0,0,0|2,0,0]=4 578 B12R1.127 CC(=O)Cc1cc(ccc1O)O 1458a_100000038496_200000210301 [2,0,0,0,0,0|1,0,0]=3 579 B12R1.127 CC(=O)Cc1cc(ccc1O)O 271570a_203496583355_200010006938 [2,0,0,0,0,0|1,0,0]=3 580 B12R1.127 CC(=O)Cc1nc(ccc1O)C 1458a_100000070787_100020630696 [2,0,0,0,0,0|2,0,0]=4 581 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br 11a_100000737762_100015343762 [2,0,0,0,0,0|2,0,0]=4 582 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br 1626a_100000737762_100015343762 [2,0,0,0,0,0|2,0,0]=4 583 B12R1.127 CC(=O)Nc1cc(ccc1Br)C 11a_100000745044_100015343762 [2,0,0,0,0,0|1,0,0]=3 584 B12R1.127 CC(=O)Nc1cc(ccc1Br)C 1626a_100000745044_100015343762 [2,0,0,0,0,0|1,0,0]=3 585 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl 11a_100000687073_100015343762 [2,0,0,0,0,0|2,0,0]=4 586 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl 1626a_100000687073_100015343762 [2,0,0,0,0,0|2,0,0]=4 587 B12R1.127 CC(=O)Nc1cc(ccc1Br)F 11a_100000687223_100015343762 [2,0,0,0,0,0|2,0,0]=4 588 B12R1.127 CC(=O)Nc1cc(ccc1Br)F 1626a_100000687223_100015343762 [2,0,0,0,0,0|2,0,0]=4 589 B12R1.127 CC(=O)Nc1cc(ccc1Br)I 11a_100000750456_100015343762 [2,0,0,0,0,0|2,0,0]=4 590 B12R1.127 CC(=O)Nc1cc(ccc1Br)I 1626a_100000750456_100015343762 [2,0,0,0,0,0|2,0,0]=4 591 B12R1.127 CC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100000070787 [2,0,0,0,0,0|1,0,0]=3 592 B12R1.127 CC(=O)Nc1cc(ccc1Br)O 527a_100011999798_100103153847 [2,0,0,0,0,0|1,0,0]=3 593 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 11a_100000741167_100015343762 [2,0,0,0,0,0|2,0,0]=4 594 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 1626a_100000741167_100015343762 [2,0,0,0,0,0|2,0,0]=4 595 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 22a_100000741167_100000070787 [2,0,0,0,0,0|2,0,0]=4 596 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 527a_100000741167_100103153847 [2,0,0,0,0,0|2,0,0]=4 597 B12R1.127 CC(=O)Nc1cc(ccc1C)C 11a_100000185781_100015343762 [2,0,0,0,0,0|1,0,0]=3 598 B12R1.127 CC(=O)Nc1cc(ccc1C)C 1626a_100000185781_100015343762 [2,0,0,0,0,0|1,0,0]=3 599 B12R1.127 CC(=O)Nc1cc(ccc1C)C 22a_100000185781_100000070787 [2,0,0,0,0,0|1,0,0]=3 600 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 11a_100000211374_100015343762 [2,0,0,0,0,0|2,0,0]=4 601 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 1626a_100000211374_100015343762 [2,0,0,0,0,0|2,0,0]=4 602 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 22a_100000211374_100000070787 [2,0,0,0,0,0|2,0,0]=4 603 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 527a_100000211374_100103153847 [2,0,0,0,0,0|2,0,0]=4 604 B12R1.127 CC(=O)Nc1cc(ccc1C)F 11a_100000211107_100015343762 [2,0,0,0,0,0|2,0,0]=4 605 B12R1.127 CC(=O)Nc1cc(ccc1C)F 1626a_100000211107_100015343762 [2,0,0,0,0,0|2,0,0]=4 606 B12R1.127 CC(=O)Nc1cc(ccc1C)F 22a_100000211107_100000070787 [2,0,0,0,0,0|2,0,0]=4 607 B12R1.127 CC(=O)Nc1cc(ccc1C)I 11a_100000761890_100015343762 [2,0,0,0,0,0|2,0,0]=4 608 B12R1.127 CC(=O)Nc1cc(ccc1C)I 1626a_100000761890_100015343762 [2,0,0,0,0,0|2,0,0]=4 609 B12R1.127 CC(=O)Nc1cc(ccc1C)I 22a_100000761890_100000070787 [2,0,0,0,0,0|2,0,0]=4 610 B12R1.127 CC(=O)Nc1cc(ccc1C)I 527a_100000761890_100103153847 [2,0,0,0,0,0|2,0,0]=4 611 B12R1.127 CC(=O)Nc1cc(ccc1C)O 22a_100011216113_100000070787 [2,0,0,0,0,0|1,0,0]=3 612 B12R1.127 CC(=O)Nc1cc(ccc1C)O 271570a_203496583355_100011344836 [2,0,0,0,0,0|1,0,0]=3 613 B12R1.127 CC(=O)Nc1cc(ccc1C)O 527a_100011216113_100103153847 [2,0,0,0,0,0|1,0,0]=3 614 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Br 11a_100000750497_100015343762 [2,0,0,0,0,0|2,0,0]=4 615 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Br 1626a_100000750497_100015343762 [2,0,0,0,0,0|2,0,0]=4 616 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 11a_100011215360_100015343762 [2,0,0,0,0,0|1,0,0]=3 617 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 1626a_100011215360_100015343762 [2,0,0,0,0,0|1,0,0]=3 618 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 22a_100011215360_100000070787 [2,0,0,0,0,0|1,0,0]=3 619 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Cl 11a_100000184485_100015343762 [2,0,0,0,0,0|2,0,0]=4 620 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Cl 1626a_100000184485_100015343762 [2,0,0,0,0,0|2,0,0]=4 621 B12R1.127 CC(=O)Nc1cc(ccc1Cl)F 11a_100000751338_100015343762 [2,0,0,0,0,0|2,0,0]=4 622 B12R1.127 CC(=O)Nc1cc(ccc1Cl)F 1626a_100000751338_100015343762 [2,0,0,0,0,0|2,0,0]=4 623 B12R1.127 CC(=O)Nc1cc(ccc1Cl)I 11a_200000761891_100015343762 [2,0,0,0,0,0|2,0,0]=4 624 B12R1.127 CC(=O)Nc1cc(ccc1Cl)I 1626a_200000761891_100015343762 [2,0,0,0,0,0|2,0,0]=4 625 B12R1.127 CC(=O)Nc1cc(ccc1Cl)O 527a_100011934297_100103153847 [2,0,0,0,0,0|1,0,0]=3 626 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 11a_100000740924_100015343762 [2,0,0,0,0,0|2,0,0]=4 627 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 1626a_100000740924_100015343762 [2,0,0,0,0,0|2,0,0]=4 628 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 22a_100000740924_100000070787 [2,0,0,0,0,0|2,0,0]=4 629 B12R1.127 CC(=O)Nc1cc(ccc1F)C 11a_100000211285_100015343762 [2,0,0,0,0,0|1,0,0]=3 630 B12R1.127 CC(=O)Nc1cc(ccc1F)C 1626a_100000211285_100015343762 [2,0,0,0,0,0|1,0,0]=3 631 B12R1.127 CC(=O)Nc1cc(ccc1F)C 22a_100000211285_100000070787 [2,0,0,0,0,0|1,0,0]=3 632 B12R1.127 CC(=O)Nc1cc(ccc1F)C 527a_100000211285_100103153847 [2,0,0,0,0,0|1,0,0]=3 633 B12R1.127 CC(=O)Nc1cc(ccc1F)Cl 11a_100000212115_100015343762 [2,0,0,0,0,0|2,0,0]=4 634 B12R1.127 CC(=O)Nc1cc(ccc1F)Cl 1626a_100000212115_100015343762 [2,0,0,0,0,0|2,0,0]=4 635 B12R1.127 CC(=O)Nc1cc(ccc1F)F 11a_100000210742_100015343762 [2,0,0,0,0,0|2,0,0]=4 636 B12R1.127 CC(=O)Nc1cc(ccc1F)F 1626a_100000210742_100015343762 [2,0,0,0,0,0|2,0,0]=4 637 B12R1.127 CC(=O)Nc1cc(ccc1F)F 22a_100000210742_100000070787 [2,0,0,0,0,0|2,0,0]=4 638 B12R1.127 CC(=O)Nc1cc(ccc1F)I 11a_100011464823_100015343762 [2,0,0,0,0,0|2,0,0]=4 639 B12R1.127 CC(=O)Nc1cc(ccc1F)I 1626a_100011464823_100015343762 [2,0,0,0,0,0|2,0,0]=4 640 B12R1.127 CC(=O)Nc1cc(ccc1F)O 1626a_100012017239_100015343762 [2,0,0,0,0,0|1,0,0]=3 641 B12R1.127 CC(=O)Nc1cc(ccc1F)O 22a_100012017239_100000070787 [2,0,0,0,0,0|1,0,0]=3 642 B12R1.127 CC(=O)Nc1cc(ccc1F)O 271570a_203496583355_200011951791 [2,0,0,0,0,0|1,0,0]=3 643 B12R1.127 CC(=O)Nc1cc(ccc1F)O 527a_100012017239_100103153847 [2,0,0,0,0,0|1,0,0]=3 644 B12R1.127 CC(=O)Nc1cc(ccc1I)Br 11a_100000743836_100015343762 [2,0,0,0,0,0|2,0,0]=4 645 B12R1.127 CC(=O)Nc1cc(ccc1I)Br 1626a_100000743836_100015343762 [2,0,0,0,0,0|2,0,0]=4 646 B12R1.127 CC(=O)Nc1cc(ccc1I)C 11a_100011216686_100015343762 [2,0,0,0,0,0|1,0,0]=3 647 B12R1.127 CC(=O)Nc1cc(ccc1I)C 1626a_100011216686_100015343762 [2,0,0,0,0,0|1,0,0]=3 648 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 11a_100000761886_100015343762 [2,0,0,0,0,0|2,0,0]=4 649 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 1626a_100000761886_100015343762 [2,0,0,0,0,0|2,0,0]=4 650 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 22a_100000761886_100000070787 [2,0,0,0,0,0|2,0,0]=4 651 B12R1.127 CC(=O)Nc1cc(ccc1I)F 11a_100011218093_100015343762 [2,0,0,0,0,0|2,0,0]=4 652 B12R1.127 CC(=O)Nc1cc(ccc1I)F 1626a_100011218093_100015343762 [2,0,0,0,0,0|2,0,0]=4 653 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000070787 [2,0,0,0,0,0|1,0,0]=3 654 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100103153847 [2,0,0,0,0,0|1,0,0]=3 655 B12R1.127 CC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000070787 [2,0,0,0,0,0|0,0,0]=2 656 B12R1.127 CC(=O)Nc1cc(ccc1O)C 271570a_203496583355_100000182586 [2,0,0,0,0,0|0,0,0]=2 657 B12R1.127 CC(=O)Nc1cc(ccc1O)C 527a_100011215204_100103153847 [2,0,0,0,0,0|0,0,0]=2 658 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000070787 [2,0,0,0,0,0|1,0,0]=3 659 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100103153847 [2,0,0,0,0,0|1,0,0]=3 660 B12R1.127 CC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000070787 [2,0,0,0,0,0|1,0,0]=3 661 B12R1.127 CC(=O)Nc1cc(ccc1O)F 271570a_203496583355_100012558231 [2,0,0,0,0,0|1,0,0]=3 662 B12R1.127 CC(=O)Nc1cc(ccc1O)F 527a_100000759472_100103153847 [2,0,0,0,0,0|1,0,0]=3 663 B12R1.127 CC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000070787 [2,0,0,0,0,0|1,0,0]=3 664 B12R1.127 CC(=O)Nc1cc(ccc1O)I 527a_100000753495_100103153847 [2,0,0,0,0,0|1,0,0]=3 665 B12R1.127 CC(=O)Nc1cc(cnc1C)O 271570a_203496583355_100010117071 [2,0,0,0,0,0|2,0,0]=4 666 B12R1.127 CC(=O)Oc1cc(ccc1C)O 271570a_203496583355_100103282185 [2,0,0,0,0,0|2,0,0]=4 667 B12R1.127 CC(=O)Oc1cc(ccc1O)F 271570a_203496583355_200015685721 [2,0,0,0,0,0|2,0,0]=4 668 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])Br 1458a_100010004923_200025704644 [2,0,0,0,0,0|2,0,0]=4 669 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])C 1458a_100000749331_200025704644 [2,0,0,0,0,0|2,0,0]=4 670 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])F 1458a_100011667363_200025704644 [2,0,0,0,0,0|2,0,0]=4 671 B12R1.127 Cc1ccc(c(c1)NC(C)C)O 34a_100011215204_100000210206 [2,0,0,0,0,0|1,0,1]=4 672 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200025704644 [2,0,0,0,0,0|2,0,0]=4 673 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)O 1458a_100000038496_200025704644 [2,0,0,0,0,0|1,0,0]=3 674 B12R1.270 CC=Cc1cc(ccc1Br)OC 271570a_100016259895_100009992028 [2,0,0,0,0,0|2,0,0]=4 675 B12R1.270 CC=Cc1cc(ccc1C)CO 271570a_100016259895_100000050133 [2,0,0,0,0,0|2,0,0]=4 676 B12R1.270 CC=Cc1cc(ccc1C)OC 271570a_100016259895_100012349166 [2,0,0,0,0,0|2,0,0]=4 677 B12R1.270 CC=Cc1cc(ccc1Cl)OC 271570a_100016259895_100011356938 [2,0,0,0,0,0|2,0,0]=4 678 B12R1.270 CC=Cc1cc(ccc1F)CC 271570a_100016259895_200010244628 [2,0,0,0,0,0|2,0,0]=4 679 B12R1.270 CC=Cc1cc(ccc1F)CO 271570a_100016259895_100000246287 [2,0,0,0,0,0|2,0,0]=4 680 B12R1.270 CC=Cc1cc(ccc1F)OC 271570a_100016259895_100000699733 [2,0,0,0,0,0|2,0,0]=4 681 B12R1.270 CC=Cc1cc(ccc1N)CC 271570a_100016259895_100012339725 [2,0,0,0,0,0|2,0,0]=4 682 B12R1.270 CC=Cc1cc(ccc1N)OC 271570a_100016259895_100015195136 [2,0,0,0,0,0|2,0,0]=4 683 B12R1.270 CC=Cc1cc(ccc1O)CC 271570a_100016259895_100012339963 [2,0,0,0,0,0|1,0,0]=3 684 B12R1.270 CC=Cc1cc(ccc1O)CO 271570a_100016259895_100011191544 [2,0,0,0,0,0|1,0,0]=3 685 B12R1.270 CC=Cc1cc(ccc1O)OC 271570a_100016259895_100000685887 [2,0,0,0,0,0|1,0,0]=3 686 B12R1.270 CC=Cc1nc(ccc1O)CO 271570a_100016259895_200000118097 [2,0,0,0,0,0|2,0,0]=4 687 B12R1.270 CCNc1cc(ccc1Br)CO 34a_100012347568_100000210202 [2,0,0,0,0,0|1,0,1]=4 688 B12R1.270 CCNc1cc(ccc1Br)OC 34a_100000748603_100000210202 [2,0,0,0,0,0|1,0,1]=4 689 B12R1.270 CCNc1cc(ccc1C)CC 2230a_200012022522_100000210202 [2,0,0,0,0,0|1,0,1]=4 690 B12R1.270 CCNc1cc(ccc1C)CC 34a_200012022522_100000210202 [2,0,0,0,0,0|1,0,1]=4 691 B12R1.270 CCNc1cc(ccc1C)CC 7a_200012022522_100000210202 [2,0,0,0,0,0|1,0,1]=4 692 B12R1.270 CCNc1cc(ccc1C)CO 2230a_100000758420_100000210202 [2,0,0,0,0,0|1,0,1]=4 693 B12R1.270 CCNc1cc(ccc1C)CO 34a_100000758420_100000210202 [2,0,0,0,0,0|1,0,1]=4 694 B12R1.270 CCNc1cc(ccc1C)OC 2230a_100000760359_100000210202 [2,0,0,0,0,0|1,0,1]=4 695 B12R1.270 CCNc1cc(ccc1C)OC 34a_100000211784_200000210301 [2,0,0,0,0,0|1,0,1]=4 696 B12R1.270 CCNc1cc(ccc1C)OC 34a_100000760359_100000210202 [2,0,0,0,0,0|1,0,1]=4 697 B12R1.270 CCNc1cc(ccc1C)OC 7a_100000211784_200000210301 [2,0,0,0,0,0|1,0,1]=4 698 B12R1.270 CCNc1cc(ccc1C)O[13CH3] 34a_100000211784_200025704644 [2,0,0,0,0,0|1,0,1]=4 699 B12R1.270 CCNc1cc(ccc1C)O[13CH3] 7a_100000211784_200025704644 [2,0,0,0,0,0|1,0,1]=4 700 B12R1.270 CCNc1cc(ccc1Cl)CO 34a_106256033963_100000210202 [2,0,0,0,0,0|1,0,1]=4 701 B12R1.270 CCNc1cc(ccc1Cl)OC 34a_100000745576_100000210202 [2,0,0,0,0,0|1,0,1]=4 702 B12R1.270 CCNc1cc(ccc1F)CO 2230a_102125399562_100000210202 [2,0,0,0,0,0|1,0,1]=4 703 B12R1.270 CCNc1cc(ccc1F)CO 34a_102125399562_100000210202 [2,0,0,0,0,0|1,0,1]=4 704 B12R1.270 CCNc1cc(ccc1F)OC 34a_100000764331_100000210202 [2,0,0,0,0,0|1,0,1]=4 705 B12R1.270 CCNc1cc(ccc1I)OC 34a_100000748021_100000210202 [2,0,0,0,0,0|1,0,1]=4 706 B12R1.270 CCNc1cc(ccc1O)CC 34a_100000765835_100000210202 [2,0,0,0,0,0|0,0,1]=3 707 B12R1.270 CCNc1cc(ccc1O)CO 34a_100000123545_100000210202 [2,0,0,0,0,0|0,0,1]=3 708 B12R1.270 CCNc1cc(ccc1O)OC 34a_100000188146_100000210202 [2,0,0,0,0,0|0,0,1]=3 709 B12R1.270 CCSc1cc(ccc1O)CC 62a_100000210202_100012339963 [2,0,0,0,0,0|1,0,1]=4 710 B12R1.270 CCSc1cc(ccc1O)CC 62a_100012339963_100000210202 [2,0,0,0,0,0|1,0,1]=4 711 B12R1.270 CCSc1cc(ccc1O)CO 62a_100000210202_100011191544 [2,0,0,0,0,0|1,0,1]=4 712 B12R1.270 CCSc1cc(ccc1O)CO 62a_100011191544_100000210202 [2,0,0,0,0,0|1,0,1]=4 713 B12R1.270 CCSc1cc(ccc1O)OC 62a_100000210202_100000685887 [2,0,0,0,0,0|1,0,1]=4 714 B12R1.270 CCc1ccc(c(c1)NCF)O 34a_100000765835_100015361967 [2,0,0,0,0,0|1,0,1]=4 715 B12R1.270 COc1ccc(c(c1)NCF)O 34a_100000188146_100015361967 [2,0,0,0,0,0|1,0,1]=4 716 B12R1.270 OCc1ccc(c(c1)NCF)O 34a_100000123545_100015361967 [2,0,0,0,0,0|1,0,1]=4 717 B12R1.438 C#Cc1cccc(c1)NC(=O)C 11a_100000735509_100015343762 [2,0,0,0,0,0|0,0,2]=4 718 B12R1.438 C#Cc1cccc(c1)NC(=O)C 1626a_100000735509_100015343762 [2,0,0,0,0,0|0,0,2]=4 719 B12R1.438 C#Cc1cccc(c1)NC(=O)C 22a_100000735509_100000070787 [2,0,0,0,0,0|0,0,2]=4 720 B12R1.438 C#Cc1cccc(c1)NC(=O)C 527a_100000735509_100103153847 [2,0,0,0,0,0|0,0,2]=4 721 B12R1.438 C=Cc1cccc(c1)NC(=O)C 11a_100011827668_100015343762 [2,0,0,0,0,0|0,0,2]=4 722 B12R1.438 C=Cc1cccc(c1)NC(=O)C 1626a_100011827668_100015343762 [2,0,0,0,0,0|0,0,2]=4 723 B12R1.438 C=Cc1cccc(c1)NC(=O)C 22a_100011827668_100000070787 [2,0,0,0,0,0|0,0,2]=4 724 B12R1.438 C=Cc1cccc(c1)NC(=O)C 271570a_100011290941_100000153616 [2,0,0,0,0,0|0,0,2]=4 725 B12R1.438 C=Cc1cccc(c1)NC(=O)C 527a_100011827668_100103153847 [2,0,0,0,0,0|0,0,2]=4 726 B12R1.438 CC(=Cc1cccc(c1)CO)C 271570a_100102525489_100000687537 [2,0,0,0,0,0|2,0,0]=4 727 B12R1.438 CC(=O)Cc1cccc(c1)CO 1458a_100000070787_100010188025 [2,0,0,0,0,0|1,0,0]=3 728 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_100000689217_200025704644 [2,0,0,0,0,0|1,1,0]=4 729 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000689217 [2,0,0,0,0,0|1,1,0]=4 730 B12R1.438 CC(=O)Cc1cccc(n1)CO 1458a_100000070787_100009813551 [2,0,0,0,0,0|2,0,0]=4 731 B12R1.438 CC(=O)Nc1cc(ccn1)S[13CH3] 62a_200025704644_100012362434 [2,0,0,0,0,0|1,1,0]=4 732 B12R1.438 CC(=O)Nc1cccc(c1)C#N 11a_100000210922_100015343762 [2,0,0,0,0,0|1,0,1]=4 733 B12R1.438 CC(=O)Nc1cccc(c1)C#N 1626a_100000210922_100015343762 [2,0,0,0,0,0|1,0,1]=4 734 B12R1.438 CC(=O)Nc1cccc(c1)C#N 22a_100000210922_100000070787 [2,0,0,0,0,0|1,0,1]=4 735 B12R1.438 CC(=O)Nc1cccc(c1)C#N 527a_100000210922_100103153847 [2,0,0,0,0,0|1,0,1]=4 736 B12R1.438 CC(=O)Nc1cccc(c1)CF 11a_100000126320_100015343762 [2,0,0,0,0,0|1,0,0]=3 737 B12R1.438 CC(=O)Nc1cccc(c1)CF 1626a_100000126320_100015343762 [2,0,0,0,0,0|1,0,0]=3 738 B12R1.438 CC(=O)Nc1cccc(c1)CF 22a_100000126320_100000070787 [2,0,0,0,0,0|1,0,0]=3 739 B12R1.438 CC(=O)Nc1cccc(c1)CF 527a_100000126320_100103153847 [2,0,0,0,0,0|1,0,0]=3 740 B12R1.438 CC(=O)Nc1cccc(c1)CO 22a_100000211919_100000070787 [2,0,0,0,0,0|0,0,0]=2 741 B12R1.438 CC(=O)Nc1cccc(c1)N[13CH3] 34a_100000749408_200025704644 [2,0,0,0,0,0|1,0,0]=3 742 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 34a_100000158604_200025704644 [2,0,0,0,0,0|0,0,0]=2 743 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 7a_100000158604_200025704644 [2,0,0,0,0,0|0,0,0]=2 744 B12R1.438 CC(=O)Nc1cccc(c1)S[13CH3] 62a_200025704644_100000153616 [2,0,0,0,0,0|0,1,0]=3 745 B12R1.438 CC(=O)Nc1cccc(n1)S[13CH3] 62a_200025704644_200011307899 [2,0,0,0,0,0|1,1,0]=4 746 B12R1.438 CC(=O)Nc1ccnc(c1)S[13CH3] 62a_200025704644_100000238608 [2,0,0,0,0,0|1,1,0]=4 747 B12R1.438 CC(=O)Nc1cncc(c1)S[13CH3] 62a_200025704644_100012351681 [2,0,0,0,0,0|1,1,0]=4 748 B12R1.438 CC(=O)Oc1cccc(c1)O[13CH3] 7a_100011218754_200025704644 [2,0,0,0,0,0|1,0,0]=3 749 B12R1.438 CC(=O)Oc1cccc(c1)S[13CH3] 62a_200025704644_100009811612 [2,0,0,0,0,0|1,1,0]=4 750 B12R1.438 CC(C)Nc1cccc(c1)CO 2230a_100000211919_100000210206 [2,0,0,0,0,0|1,0,1]=4 751 B12R1.438 CC(C)Nc1cccc(c1)CO 34a_100000211919_100000210206 [2,0,0,0,0,0|1,0,1]=4 752 B12R1.438 CCc1cccc(c1)C=C(C)C 271570a_100102525489_100000684523 [2,0,0,0,0,0|2,0,0]=4 753 B12R1.438 CCc1cccc(c1)NC(=O)C 11a_100000211250_100015343762 [2,0,0,0,0,0|0,0,0]=2 754 B12R1.438 CCc1cccc(c1)NC(=O)C 1626a_100000211250_100015343762 [2,0,0,0,0,0|0,0,0]=2 755 B12R1.438 CCc1cccc(c1)NC(=O)C 22a_100000211250_100000070787 [2,0,0,0,0,0|0,0,0]=2 756 B12R1.438 CCc1cccc(c1)NC(=O)C 527a_100000211250_100103153847 [2,0,0,0,0,0|0,0,0]=2 757 B12R1.438 CCc1cccc(c1)NC(C)C 2230a_100000211250_100000210206 [2,0,0,0,0,0|1,0,1]=4 758 B12R1.438 CCc1cccc(c1)NC(C)C 34a_100000211250_100000210206 [2,0,0,0,0,0|1,0,1]=4 759 B12R1.438 CCc1cccc(c1)NC(C)C 7a_100000211250_100000210206 [2,0,0,0,0,0|1,0,1]=4 760 B12R1.438 CNc1cccc(c1)NC(=O)C 34a_100000749408_200000210301 [2,0,0,0,0,0|1,0,0]=3 761 B12R1.438 CNc1cccc(c1)NC(=O)N 34a_100000736001_200000210301 [2,0,0,0,0,0|2,0,0]=4 762 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000070787_100103152439 [2,0,0,0,0,0|2,0,0]=4 763 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000718155_200000210301 [2,0,0,0,0,0|2,0,0]=4 764 B12R1.438 COc1cc(ccn1)CC(=O)[13CH3] 1458a_100000718155_200025704644 [2,0,0,0,0,0|2,0,0]=4 765 B12R1.438 COc1cccc(c1)C=C(C)C 271570a_100102525489_100000170001 [2,0,0,0,0,0|2,0,0]=4 766 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000070787_100000211672 [2,0,0,0,0,0|1,0,0]=3 767 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000211281_200000210301 [2,0,0,0,0,0|1,0,0]=3 768 B12R1.438 COc1cccc(c1)CC(=O)N 34a_200000747573_200000210301 [2,0,0,0,0,0|2,0,0]=4 769 B12R1.438 COc1cccc(c1)CC(=O)N 7a_200000747573_200000210301 [2,0,0,0,0,0|2,0,0]=4 770 B12R1.438 COc1cccc(c1)CC(=O)[13CH3] 1458a_100000211281_200025704644 [2,0,0,0,0,0|1,0,0]=3 771 B12R1.438 COc1cccc(c1)NC(=O)C 11a_100000210024_100015343762 [2,0,0,0,0,0|0,0,0]=2 772 B12R1.438 COc1cccc(c1)NC(=O)C 1626a_100000210024_100015343762 [2,0,0,0,0,0|0,0,0]=2 773 B12R1.438 COc1cccc(c1)NC(=O)C 22a_100000210024_100000070787 [2,0,0,0,0,0|0,0,0]=2 774 B12R1.438 COc1cccc(c1)NC(=O)C 34a_100000158604_200000210301 [2,0,0,0,0,0|0,0,0]=2 775 B12R1.438 COc1cccc(c1)NC(=O)C 527a_100000210024_100103153847 [2,0,0,0,0,0|0,0,0]=2 776 B12R1.438 COc1cccc(c1)NC(=O)C 7a_100000158604_200000210301 [2,0,0,0,0,0|0,0,0]=2 777 B12R1.438 COc1cccc(c1)NC(=O)N 34a_100011219624_200000210301 [2,0,0,0,0,0|1,0,0]=3 778 B12R1.438 COc1cccc(c1)NC(=O)N 7a_100011219624_200000210301 [2,0,0,0,0,0|1,0,0]=3 779 B12R1.438 COc1cccc(c1)NC(=S)N 7a_100000023991_200000210301 [2,0,0,0,0,0|1,1,0]=4 780 B12R1.438 COc1cccc(c1)NC(C)C 34a_100000210024_100000210206 [2,0,0,0,0,0|1,0,1]=4 781 B12R1.438 COc1cccc(c1)OC(=O)C 7a_100011218754_200000210301 [2,0,0,0,0,0|1,0,0]=3 782 B12R1.438 COc1cccc(n1)CC(=O)C 1458a_100000070787_100000755263 [2,0,0,0,0,0|2,0,0]=4 783 B12R1.438 COc1ccnc(c1)CC(=O)C 1458a_100000070787_100000752681 [2,0,0,0,0,0|2,0,0]=4 784 B12R1.438 CSc1cc(ccn1)NC(=O)C 62a_200000210301_100000238608 [2,0,0,0,0,0|1,1,0]=4 785 B12R1.438 CSc1cccc(c1)CC(=O)C 1458a_100000035702_200000210301 [2,0,0,0,0,0|1,1,0]=4 786 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_100000689217_200000210301 [2,0,0,0,0,0|1,1,0]=4 787 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_200000210301_100000689217 [2,0,0,0,0,0|1,1,0]=4 788 B12R1.438 CSc1cccc(c1)CC(=O)[13CH3] 1458a_100000035702_200025704644 [2,0,0,0,0,0|1,1,0]=4 789 B12R1.438 CSc1cccc(c1)NC(=O)C 11a_100000210049_100015343762 [2,0,0,0,0,0|0,1,0]=3 790 B12R1.438 CSc1cccc(c1)NC(=O)C 1626a_100000210049_100015343762 [2,0,0,0,0,0|0,1,0]=3 791 B12R1.438 CSc1cccc(c1)NC(=O)C 22a_100000210049_100000070787 [2,0,0,0,0,0|0,1,0]=3 792 B12R1.438 CSc1cccc(c1)NC(=O)C 527a_100000210049_100103153847 [2,0,0,0,0,0|0,1,0]=3 793 B12R1.438 CSc1cccc(c1)NC(=O)C 62a_200000210301_100000153616 [2,0,0,0,0,0|0,1,0]=3 794 B12R1.438 CSc1cccc(c1)NC(=O)N 62a_200000210301_100000238923 [2,0,0,0,0,0|1,1,0]=4 795 B12R1.438 CSc1cccc(c1)OC(=O)C 62a_200000210301_100009811612 [2,0,0,0,0,0|1,1,0]=4 796 B12R1.438 CSc1cccc(n1)NC(=O)C 62a_200000210301_200011307899 [2,0,0,0,0,0|1,1,0]=4 797 B12R1.438 CSc1ccnc(c1)NC(=O)C 62a_200000210301_100012362434 [2,0,0,0,0,0|1,1,0]=4 798 B12R1.438 CSc1cncc(c1)NC(=O)C 62a_200000210301_100012351681 [2,0,0,0,0,0|1,1,0]=4 799 B12R1.438 [13CH3]Nc1cccc(c1)NC(=O)N 34a_100000736001_200025704644 [2,0,0,0,0,0|2,0,0]=4 800 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 34a_200000747573_200025704644 [2,0,0,0,0,0|2,0,0]=4 801 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 7a_200000747573_200025704644 [2,0,0,0,0,0|2,0,0]=4 802 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 34a_100011219624_200025704644 [2,0,0,0,0,0|1,0,0]=3 803 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 7a_100011219624_200025704644 [2,0,0,0,0,0|1,0,0]=3 804 B12R1.438 [13CH3]Oc1cccc(c1)NC(=S)N 7a_100000023991_200025704644 [2,0,0,0,0,0|1,1,0]=4 805 B12R1.438 [13CH3]Sc1cccc(c1)NC(=O)N 62a_200025704644_100000238923 [2,0,0,0,0,0|1,1,0]=4 806 B12R1.278 CC=Cc1cccc(c1)CCC 271570a_100016259895_100000694964 [2,0,0,0,0,0|2,0,0]=4 807 B12R1.278 CC=Cc1cccc(c1)CNC 271570a_100016259895_100000187585 [2,0,0,0,0,0|2,0,0]=4 808 B12R1.278 CC=Cc1cccc(c1)COC 271570a_100016259895_100011493687 [2,0,0,0,0,0|1,0,0]=3 809 B12R1.278 CCNc1cccc(c1)COC 2230a_100000737370_100000210202 [2,0,0,0,0,0|0,0,1]=3 810 B12R1.278 CCNc1cccc(c1)COC 34a_100000737370_100000210202 [2,0,0,0,0,0|0,0,1]=3 811 B12R1.278 CCOc1cccc(c1)COC 34a_200011232711_200000210301 [2,0,0,0,0,0|1,0,1]=4 812 B12R1.278 CCOc1cccc(c1)COC 7a_200011232711_200000210301 [2,0,0,0,0,0|1,0,1]=4 813 B12R1.278 CCOc1cccc(c1)CO[13CH3] 34a_200011232711_200025704644 [2,0,0,0,0,0|1,0,1]=4 814 B12R1.278 CCOc1cccc(c1)CO[13CH3] 7a_200011232711_200025704644 [2,0,0,0,0,0|1,0,1]=4 815 B12R1.278 CCSc1cccc(c1)COC 62a_100000210202_100011493687 [2,0,0,0,0,0|1,0,1]=4 816 B12R1.278 CCSc1cccc(c1)COC 62a_100011493687_100000210202 [2,0,0,0,0,0|1,0,1]=4 817 B12R1.278 COCc1cccc(c1)NCF 34a_100000737370_100015361967 [2,0,0,0,0,0|1,0,1]=4 818 B12R1.286 C=Cc1cc(ccc1C)COC 271570a_100011290941_200015395492 [2,0,0,0,0,0|1,0,1]=4 819 B12R1.286 C=Cc1cc(ccc1F)COC 271570a_100011290941_200011493689 [2,0,0,0,0,0|1,0,1]=4 820 B12R1.286 CC=Cc1ccc(c(c1)C=O)O 271570a_100016259895_100000186750 [2,0,0,0,0,0|1,0,1]=4 821 B12R1.286 CCOc1ccc(c(c1)C=O)O 271570a_203496583355_100012345016 [2,0,0,0,0,0|2,0,0]=4 822 B12R1.286 CCSc1ccc(c(c1)C=O)O 62a_100000210202_100000186750 [2,0,0,0,0,0|2,0,0]=4 823 B12R1.286 CNCc1ccc(c(c1)C=O)O 7a_106832991635_100000008128 [2,0,0,0,0,0|1,0,0]=3 824 B12R1.286 CNCc1ccc(c(c1)OC)O 34a_100000185554_200000210301 [2,0,0,0,0,0|2,0,0]=4 825 B12R1.286 CNc1cc(ccc1Br)COC 34a_200013033220_200000210301 [2,0,0,0,0,0|1,0,0]=3 826 B12R1.286 COCc1ccc(c(c1)N[13CH3])Br 34a_200013033220_200025704644 [2,0,0,0,0,0|1,0,0]=3 827 B12R1.286 COCc1ccc(c(c1)OC)Br 34a_100010234685_200000210301 [2,0,0,0,0,0|2,0,0]=4 828 B12R1.286 COCc1ccc(c(c1)OC)Br 34a_100138415774_100010110085 [2,0,0,0,0,0|2,0,0]=4 829 B12R1.286 COCc1ccc(c(c1)OC)Br 7a_100010234685_200000210301 [2,0,0,0,0,0|2,0,0]=4 830 B12R1.286 COCc1ccc(c(c1)OC)C 34a_100000752651_200000210301 [2,0,0,0,0,0|2,0,0]=4 831 B12R1.286 COCc1ccc(c(c1)OC)C 7a_100000752651_200000210301 [2,0,0,0,0,0|2,0,0]=4 832 B12R1.286 COCc1ccc(c(c1)OC)Cl 34a_100012179228_200000210301 [2,0,0,0,0,0|2,0,0]=4 833 B12R1.286 COCc1ccc(c(c1)OC)Cl 34a_100138415774_200010214485 [2,0,0,0,0,0|2,0,0]=4 834 B12R1.286 COCc1ccc(c(c1)OC)F 34a_100000692429_200000210301 [2,0,0,0,0,0|2,0,0]=4 835 B12R1.286 COCc1ccc(c(c1)OC)F 34a_100138415774_100012349856 [2,0,0,0,0,0|2,0,0]=4 836 B12R1.286 COCc1ccc(c(c1)OC)F 7a_100000692429_200000210301 [2,0,0,0,0,0|2,0,0]=4 837 B12R1.286 COCc1ccc(c(c1)OC)N 34a_100000087641_200000210301 [2,0,0,0,0,0|2,0,0]=4 838 B12R1.286 COCc1ccc(c(c1)SC)C 62a_200000210301_200015395492 [2,0,0,0,0,0|2,0,0]=4 839 B12R1.286 COCc1ccc(c(c1)SC)C 62a_200015395492_200000210301 [2,0,0,0,0,0|2,0,0]=4 840 B12R1.286 COCc1ccc(c(c1)SC)F 62a_200000210301_200011493689 [2,0,0,0,0,0|2,0,0]=4 841 B12R1.286 COCc1ccc(c(c1)SC)F 62a_200011493689_200000210301 [2,0,0,0,0,0|2,0,0]=4 842 B12R1.286 COCc1ccc(c(c1)S[13CH3])C 62a_200015395492_200025704644 [2,0,0,0,0,0|2,0,0]=4 843 B12R1.286 COCc1ccc(c(c1)S[13CH3])C 62a_200025704644_200015395492 [2,0,0,0,0,0|2,0,0]=4 844 B12R1.286 COCc1ccc(c(c1)S[13CH3])F 62a_200011493689_200025704644 [2,0,0,0,0,0|2,0,0]=4 845 B12R1.286 COCc1ccc(c(c1)S[13CH3])F 62a_200025704644_200011493689 [2,0,0,0,0,0|2,0,0]=4 846 B12R1.286 COc1cc(ccc1Br)CO[13CH3] 34a_100010234685_200025704644 [2,0,0,0,0,0|2,0,0]=4 847 B12R1.286 COc1cc(ccc1Br)CO[13CH3] 7a_100010234685_200025704644 [2,0,0,0,0,0|2,0,0]=4 848 B12R1.286 COc1cc(ccc1C)CO[13CH3] 34a_100000752651_200025704644 [2,0,0,0,0,0|2,0,0]=4 849 B12R1.286 COc1cc(ccc1C)CO[13CH3] 7a_100000752651_200025704644 [2,0,0,0,0,0|2,0,0]=4 850 B12R1.286 COc1cc(ccc1Cl)CO[13CH3] 34a_100012179228_200025704644 [2,0,0,0,0,0|2,0,0]=4 851 B12R1.286 COc1cc(ccc1F)CO[13CH3] 34a_100000692429_200025704644 [2,0,0,0,0,0|2,0,0]=4 852 B12R1.286 COc1cc(ccc1F)CO[13CH3] 7a_100000692429_200025704644 [2,0,0,0,0,0|2,0,0]=4 853 B12R1.286 COc1cc(ccc1N)CO[13CH3] 34a_100000087641_200025704644 [2,0,0,0,0,0|2,0,0]=4 854 B12R1.286 COc1cc(ccc1O)CN[13CH3] 34a_100000185554_200025704644 [2,0,0,0,0,0|2,0,0]=4 855 B12R1.286 CSCc1ccc(c(c1)C=O)O 62a_200000210301_100000008128 [2,0,0,0,0,0|0,1,0]=3 856 B12R1.286 [13CH3]SCc1ccc(c(c1)C=O)O 62a_200025704644_100000008128 [2,0,0,0,0,0|0,1,0]=3 857 B14R1.578 COc1cc(c(c(c1)C=C(C)C)O)N 271570a_100102525489_200010008348 [1,1,0,0,0,0|2,0,0]=4 858 B14R1.578 COc1cc(c(c(c1)NC(=O)C)O)Br 11a_200010008348_100015343762 [1,1,0,0,0,0|0,0,0]=2 859 B14R1.578 COc1cc(c(c(c1)NC(=O)C)O)Br 22a_200010008348_100000070787 [1,1,0,0,0,0|0,0,0]=2 860 B14R1.578 COc1cc(c(c(c1)NC(=O)C)O)Br 527a_200010008348_100103153847 [1,1,0,0,0,0|0,0,0]=2 861 B14R1.578 COc1cc(c(c(c1)NC(C)C)O)Br 34a_200010008348_100000210206 [1,1,0,0,0,0|1,0,1]=4 862 B14R1.676 C=C(C)c1ccc(c(c1)CC(=O)C)O 271570a_100000694244_200010006938 [1,1,0,0,0,0|1,0,1]=4 863 B14R1.676 C=C(C)c1ccc(c(c1)NC(=O)C)C 271570a_100000694244_100011344836 [1,1,0,0,0,0|1,0,1]=4 864 B14R1.676 C=C(C)c1ccc(c(c1)NC(=O)C)F 271570a_100000694244_200011951791 [1,1,0,0,0,0|1,0,1]=4 865 B14R1.676 CC(=O)Nc1cc(ccc1C)C(=O)C 1458a_100000194935_200000210301 [1,1,0,0,0,0|1,0,1]=4 866 B14R1.676 CC(=O)Nc1cc(ccc1C)C(=O)[13CH3] 1458a_100000194935_200025704644 [1,1,0,0,0,0|1,0,1]=4 867 B14R1.676 CC(=O)Nc1cc(ccc1C)C(C)C 11a_100011216979_100015343762 [1,1,0,0,0,0|1,0,0]=3 868 B14R1.676 CC(=O)Nc1cc(ccc1C)C(C)C 1626a_100011216979_100015343762 [1,1,0,0,0,0|1,0,0]=3 869 B14R1.676 CC(=O)Nc1cc(ccc1C)C(C)C 22a_100011216979_100000070787 [1,1,0,0,0,0|1,0,0]=3 870 B14R1.676 CC(=O)Nc1cc(ccc1C)C(C)C 527a_100011216979_100103153847 [1,1,0,0,0,0|1,0,0]=3 871 B14R1.676 CC(=O)Nc1cc(ccc1C)N(C)C 11a_100015186894_100015343762 [1,1,0,0,0,0|2,0,0]=4 872 B14R1.676 CC(=O)Nc1cc(ccc1C)N(C)C 1626a_100015186894_100015343762 [1,1,0,0,0,0|2,0,0]=4 873 B14R1.676 CC(=O)Nc1cc(ccc1C)N(C)C 22a_100015186894_100000070787 [1,1,0,0,0,0|2,0,0]=4 874 B14R1.676 CC(=O)Nc1cc(ccc1C)N(C)C 527a_100015186894_100103153847 [1,1,0,0,0,0|2,0,0]=4 875 B14R1.676 CC(=O)Nc1cc(ccc1F)C(=O)C 1458a_100000744603_200000210301 [1,1,0,0,0,0|1,0,1]=4 876 B14R1.676 CC(=O)Nc1cc(ccc1F)C(=O)[13CH3] 1458a_100000744603_200025704644 [1,1,0,0,0,0|1,0,1]=4 877 B14R1.676 CC(=O)Nc1cc(ccc1F)C(F)F 11a_100010590353_100015343762 [1,1,0,0,0,0|2,0,0]=4 878 B14R1.676 CC(=O)Nc1cc(ccc1F)C(F)F 1626a_100010590353_100015343762 [1,1,0,0,0,0|2,0,0]=4 879 B14R1.676 CC(=O)Nc1cc(ccc1F)C(F)F 22a_100010590353_100000070787 [1,1,0,0,0,0|2,0,0]=4 880 B14R1.676 CC(=O)Nc1cc(ccc1O)C(C)C 22a_200000187366_100000070787 [1,1,0,0,0,0|0,0,0]=2 881 B14R1.676 CC(=O)Nc1cc(ccc1O)C(C)C 527a_200000187366_100103153847 [1,1,0,0,0,0|0,0,0]=2 882 B14R1.676 CC(=O)Nc1cc(ccc1O)[N+](=O)[O-] 22a_100000181223_100000070787 [1,1,0,0,0,0|1,0,1]=4 883 B14R1.676 CC(=O)Nc1cc(ccc1O)[N+](=O)[O-] 527a_100000181223_100103153847 [1,1,0,0,0,0|1,0,1]=4 884 B14R1.676 CC(C)Nc1cc(ccc1O)C(C)C 34a_200000187366_100000210206 [1,1,0,0,0,0|1,0,1]=4 885 B14R1.676 CC(C)Nc1cc(ccc1O)C(C)C 7a_200000187366_100000210206 [1,1,0,0,0,0|1,0,1]=4 886 B14R1.881 CC(=O)Nc1cc(c(cc1Cl)Cl)O[13CH3] 34a_200000039401_200025704644 [1,1,0,0,0,0|1,0,0]=3 887 B14R1.881 CC(=O)Nc1cc(c(cc1Cl)Cl)O[13CH3] 7a_200000039401_200025704644 [1,1,0,0,0,0|1,0,0]=3 888 B14R1.881 CC(=O)Nc1cc(c(cc1F)F)S[13CH3] 62a_200013902858_200025704644 [1,1,0,0,0,0|1,1,0]=4 889 B14R1.881 CC(=O)Nc1cc(c(cc1F)F)S[13CH3] 62a_200025704644_200013902858 [1,1,0,0,0,0|1,1,0]=4 890 B14R1.881 COc1cc(c(cc1Br)Br)NC(=O)C 11a_100000718616_100015343762 [1,1,0,0,0,0|1,0,0]=3 891 B14R1.881 COc1cc(c(cc1Br)Br)NC(=O)C 1626a_100000718616_100015343762 [1,1,0,0,0,0|1,0,0]=3 892 B14R1.881 COc1cc(c(cc1Br)C)NC(=O)C 11a_100010232211_100015343762 [1,1,0,0,0,0|1,0,0]=3 893 B14R1.881 COc1cc(c(cc1Br)C)NC(=O)C 1626a_100010232211_100015343762 [1,1,0,0,0,0|1,0,0]=3 894 B14R1.881 COc1cc(c(cc1Br)C)NC(=O)C 22a_100010232211_100000070787 [1,1,0,0,0,0|1,0,0]=3 895 B14R1.881 COc1cc(c(cc1Br)C)NC(=O)C 527a_100010232211_100103153847 [1,1,0,0,0,0|1,0,0]=3 896 B14R1.881 COc1cc(c(cc1Br)Cl)NC(=O)C 11a_100012361290_100015343762 [1,1,0,0,0,0|1,0,0]=3 897 B14R1.881 COc1cc(c(cc1Br)Cl)NC(=O)C 1626a_100012361290_100015343762 [1,1,0,0,0,0|1,0,0]=3 898 B14R1.881 COc1cc(c(cc1C)Br)NC(=O)C 11a_100010244135_100015343762 [1,1,0,0,0,0|1,0,0]=3 899 B14R1.881 COc1cc(c(cc1C)Br)NC(=O)C 1626a_100010244135_100015343762 [1,1,0,0,0,0|1,0,0]=3 900 B14R1.881 COc1cc(c(cc1Cl)Br)NC(=O)C 11a_100013022580_100015343762 [1,1,0,0,0,0|1,0,0]=3 901 B14R1.881 COc1cc(c(cc1Cl)Br)NC(=O)C 1626a_100013022580_100015343762 [1,1,0,0,0,0|1,0,0]=3 902 B14R1.881 COc1cc(c(cc1Cl)C)NC(=O)C 11a_100009858536_100015343762 [1,1,0,0,0,0|1,0,0]=3 903 B14R1.881 COc1cc(c(cc1Cl)C)NC(=O)C 1626a_100009858536_100015343762 [1,1,0,0,0,0|1,0,0]=3 904 B14R1.881 COc1cc(c(cc1Cl)C)NC(=O)C 22a_100009858536_100000070787 [1,1,0,0,0,0|1,0,0]=3 905 B14R1.881 COc1cc(c(cc1Cl)C)NC(=O)C 527a_100009858536_100103153847 [1,1,0,0,0,0|1,0,0]=3 906 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 11a_100011830341_100015343762 [1,1,0,0,0,0|1,0,0]=3 907 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 1626a_100011830341_100015343762 [1,1,0,0,0,0|1,0,0]=3 908 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 22a_100011830341_100000070787 [1,1,0,0,0,0|1,0,0]=3 909 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 34a_200000039401_200000210301 [1,1,0,0,0,0|1,0,0]=3 910 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 7a_200000039401_200000210301 [1,1,0,0,0,0|1,0,0]=3 911 B14R1.881 COc1cc(c(cc1Cl)F)NC(=O)C 11a_100009872666_100015343762 [1,1,0,0,0,0|1,0,0]=3 912 B14R1.881 COc1cc(c(cc1Cl)F)NC(=O)C 1626a_100009872666_100015343762 [1,1,0,0,0,0|1,0,0]=3 913 B14R1.881 COc1cc(c(cc1Cl)F)NC(=O)C 22a_100009872666_100000070787 [1,1,0,0,0,0|1,0,0]=3 914 B14R1.881 COc1cc(c(cc1F)Br)NC(=O)C 11a_100010208193_100015343762 [1,1,0,0,0,0|1,0,0]=3 915 B14R1.881 COc1cc(c(cc1F)Br)NC(=O)C 1626a_100010208193_100015343762 [1,1,0,0,0,0|1,0,0]=3 916 B14R1.881 COc1cc(c(cc1F)Cl)NC(=O)C 11a_100009958774_100015343762 [1,1,0,0,0,0|1,0,0]=3 917 B14R1.881 COc1cc(c(cc1F)Cl)NC(=O)C 1626a_100009958774_100015343762 [1,1,0,0,0,0|1,0,0]=3 918 B14R1.881 COc1cc(c(cc1F)Cl)NC(=O)C 22a_100009958774_100000070787 [1,1,0,0,0,0|1,0,0]=3 919 B14R1.881 COc1cc(c(cc1O)Br)CC(=O)C 1458a_100009814189_200000210301 [1,1,0,0,0,0|2,0,0]=4 920 B14R1.881 COc1cc(c(cc1O)Br)CC(=O)[13CH3] 1458a_100009814189_200025704644 [1,1,0,0,0,0|2,0,0]=4 921 B14R1.881 CSc1cc(c(cc1F)F)NC(=O)C 62a_200000210301_200013902858 [1,1,0,0,0,0|1,1,0]=4 922 B14R1.881 CSc1cc(c(cc1F)F)NC(=O)C 62a_200013902858_200000210301 [1,1,0,0,0,0|1,1,0]=4 923 B14R1.2318 CC(=O)Nc1c(ccc(c1F)N[13CH3])F 34a_100009824841_200025704644 [1,1,0,0,0,0|2,0,0]=4 924 B14R1.2318 CNc1ccc(c(c1F)NC(=O)C)F 34a_100009824841_200000210301 [1,1,0,0,0,0|2,0,0]=4 925 B14R1.2318 COc1ccc(c(c1C)NC(=O)C)C 11a_100000089760_100015343762 [1,1,0,0,0,0|1,0,0]=3 926 B14R1.2318 COc1ccc(c(c1C)NC(=O)C)C 1626a_100000089760_100015343762 [1,1,0,0,0,0|1,0,0]=3 927 B14R1.2318 COc1ccc(c(c1C)NC(=O)C)C 22a_100000089760_100000070787 [1,1,0,0,0,0|1,0,0]=3 928 B14R1.2318 COc1ccc(c(c1Cl)NC(=O)C)Cl 11a_100009956855_100015343762 [1,1,0,0,0,0|1,0,0]=3 929 B14R1.2318 COc1ccc(c(c1Cl)NC(=O)C)Cl 1626a_100009956855_100015343762 [1,1,0,0,0,0|1,0,0]=3 930 B14R1.2318 COc1ccc(c(c1Cl)NC(=O)C)F 11a_100000061512_100015343762 [1,1,0,0,0,0|1,0,0]=3 931 B14R1.2318 COc1ccc(c(c1Cl)NC(=O)C)F 1626a_100000061512_100015343762 [1,1,0,0,0,0|1,0,0]=3 932 B14R1.2318 COc1ccc(c(c1F)CC(=O)C)Br 1458a_100000070787_200011099544 [1,1,0,0,0,0|2,0,0]=4 933 B14R1.2318 COc1ccc(c(c1F)CC(=O)C)Cl 1458a_100000061514_200000210301 [1,1,0,0,0,0|2,0,0]=4 934 B14R1.2318 COc1ccc(c(c1F)CC(=O)C)Cl 1458a_100000070787_100009814550 [1,1,0,0,0,0|2,0,0]=4 935 B14R1.2318 COc1ccc(c(c1F)CC(=O)C)F 1458a_100000062057_200000210301 [1,1,0,0,0,0|2,0,0]=4 936 B14R1.2318 COc1ccc(c(c1F)CC(=O)C)F 1458a_100000070787_100009814547 [1,1,0,0,0,0|2,0,0]=4 937 B14R1.2318 COc1ccc(c(c1F)CC(=O)[13CH3])Cl 1458a_100000061514_200025704644 [1,1,0,0,0,0|2,0,0]=4 938 B14R1.2318 COc1ccc(c(c1F)CC(=O)[13CH3])F 1458a_100000062057_200025704644 [1,1,0,0,0,0|2,0,0]=4 939 B14R1.2318 COc1ccc(c(c1F)NC(=O)C)Cl 11a_100000061519_100015343762 [1,1,0,0,0,0|1,0,0]=3 940 B14R1.2318 COc1ccc(c(c1F)NC(=O)C)Cl 1626a_100000061519_100015343762 [1,1,0,0,0,0|1,0,0]=3 941 B14R1.2318 COc1ccc(c(c1F)NC(=O)C)F 11a_200000062051_100015343762 [1,1,0,0,0,0|1,0,0]=3 942 B14R1.2318 COc1ccc(c(c1F)NC(=O)C)F 1626a_200000062051_100015343762 [1,1,0,0,0,0|1,0,0]=3 943 B14R1.2336 CC(C)(C)Nc1cc(ccc1O)CO 34a_100000123545_100000210625 [1,1,0,0,0,0|1,0,1]=4 944 B14R1.2336 CCc1ccc(c(c1)NC(C)(C)C)O 34a_100000765835_100000210625 [1,1,0,0,0,0|1,0,1]=4 945 B14R1.2336 CCc1ccc(c(c1)NS(=O)(=O)C)C 40a_200012022522_100000738038 [1,1,0,0,0,0|2,0,0]=4 946 B14R1.2336 COc1ccc(c(c1)NC(C)(C)C)O 34a_100000188146_100000210625 [1,1,0,0,0,0|1,0,1]=4 947 B14R1.2336 COc1ccc(c(c1)NS(=O)(=O)C)C 40a_100000760359_100000738038 [1,1,0,0,0,0|2,0,0]=4 948 B14R1.2336 COc1ccc(c(c1)NS(=O)(=O)C)Cl 40a_100000745576_100000738038 [1,1,0,0,0,0|2,0,0]=4 949 B14R1.2336 COc1ccc(c(c1)NS(=O)(=O)C)F 40a_100000764331_100000738038 [1,1,0,0,0,0|2,0,0]=4 950 B14R1.2336 COc1ccc(c(c1)NS(=O)(=O)C)I 40a_100000748021_100000738038 [1,1,0,0,0,0|2,0,0]=4 951 B14R1.2336 CS(=O)(=O)Nc1cc(ccc1Br)CO 40a_100012347568_100000738038 [1,1,0,0,0,0|2,0,0]=4 952 B14R1.2336 CS(=O)(=O)Nc1cc(ccc1Cl)CO 40a_106256033963_100000738038 [1,1,0,0,0,0|2,0,0]=4 953 B14R1.2336 CS(=O)(=O)Nc1cc(ccc1F)CO 40a_102125399562_100000738038 [1,1,0,0,0,0|2,0,0]=4 954 B14R1.2336 Cc1ccc(cc1NS(=O)(=O)C)CO 40a_100000758420_100000738038 [1,1,0,0,0,0|2,0,0]=4 955 B14R1.2340 CC(=C(C)c1cc(ccc1O)CO)C 271570a_200000049429_100011191544 [1,1,0,0,0,0|2,0,0]=4 956 B14R1.2340 CCc1ccc(c(c1)C(=C(C)C)C)O 271570a_200000049429_100012339963 [1,1,0,0,0,0|2,0,0]=4 957 B14R1.2340 COc1ccc(c(c1)C(=C(C)C)C)O 271570a_200000049429_100000685887 [1,1,0,0,0,0|2,0,0]=4 958 B14R1.3723 C=Cc1ccc(c(c1)NC(=O)C)OC 271570a_100011290941_200011407902 [1,1,0,0,0,0|0,0,2]=4 959 B14R1.3723 C=Cc1ccc(cc1NC(=O)C)OC 271570a_100011290941_100011665069 [1,1,0,0,0,0|1,0,0]=3 960 B14R1.3723 CC(=Cc1cc(ccc1CO)CO)C 271570a_100102525489_100010881536 [1,1,0,0,0,0|2,0,0]=4 961 B14R1.3723 CCc1ccc(c(c1)C=C(C)C)OC 271570a_100102525489_100010062400 [1,1,0,0,0,0|2,0,0]=4 962 B14R1.3723 CCc1ccc(c(c1)NC(=O)C)OC 11a_100012035449_100015343762 [1,1,0,0,0,0|0,0,0]=2 963 B14R1.3723 CCc1ccc(c(c1)NC(=O)C)OC 1626a_100012035449_100015343762 [1,1,0,0,0,0|0,0,0]=2 964 B14R1.3723 CCc1ccc(c(c1)NC(=O)C)OC 22a_100012035449_100000070787 [1,1,0,0,0,0|0,0,0]=2 965 B14R1.3723 CCc1ccc(c(c1)NC(C)C)OC 2230a_100012035449_100000210206 [1,1,0,0,0,0|1,0,1]=4 966 B14R1.3723 CCc1ccc(c(c1)NC(C)C)OC 34a_100012035449_100000210206 [1,1,0,0,0,0|1,0,1]=4 967 B14R1.3723 CNc1ccc(c(c1)NC(=O)C)OC 34a_100000736378_200000210301 [1,1,0,0,0,0|1,0,0]=3 968 B14R1.3723 CNc1ccc(c(c1)NC(=O)C)OC 7a_100000736378_200000210301 [1,1,0,0,0,0|1,0,0]=3 969 B14R1.3723 COc1ccc(c(c1)C=C(C)C)CO 271570a_100102525489_100011982768 [1,1,0,0,0,0|2,0,0]=4 970 B14R1.3723 COc1ccc(c(c1)C=C(C)C)OC 271570a_100102525489_100011215452 [1,1,0,0,0,0|2,0,0]=4 971 B14R1.3723 COc1ccc(c(c1)CC(=O)C)OC 1458a_100000070787_100000205131 [1,1,0,0,0,0|1,0,0]=3 972 B14R1.3723 COc1ccc(c(c1)CC(=O)C)OC 1458a_100000212042_200000210301 [1,1,0,0,0,0|1,0,0]=3 973 B14R1.3723 COc1ccc(c(c1)CC(=O)C)OC 34a_200000075431_200000210301 [1,1,0,0,0,0|1,0,0]=3 974 B14R1.3723 COc1ccc(c(c1)CC(=O)C)OC 7a_200000075431_200000210301 [1,1,0,0,0,0|1,0,0]=3 975 B14R1.3723 COc1ccc(c(c1)CC(=O)C)O[13CH3] 34a_200000075431_200025704644 [1,1,0,0,0,0|1,0,0]=3 976 B14R1.3723 COc1ccc(c(c1)CC(=O)C)O[13CH3] 7a_200000075431_200025704644 [1,1,0,0,0,0|1,0,0]=3 977 B14R1.3723 COc1ccc(c(c1)CC(=O)[13CH3])OC 1458a_100000212042_200025704644 [1,1,0,0,0,0|1,0,0]=3 978 B14R1.3723 COc1ccc(c(c1)NC(=O)C)C#N 11a_100000687564_100015343762 [1,1,0,0,0,0|1,0,0]=3 979 B14R1.3723 COc1ccc(c(c1)NC(=O)C)C#N 1626a_100000687564_100015343762 [1,1,0,0,0,0|1,0,0]=3 980 B14R1.3723 COc1ccc(c(c1)NC(=O)C)CO 22a_100011998734_100000070787 [1,1,0,0,0,0|0,0,0]=2 981 B14R1.3723 COc1ccc(c(c1)NC(=O)C)CO 527a_100011998734_100103153847 [1,1,0,0,0,0|0,0,0]=2 982 B14R1.3723 COc1ccc(c(c1)NC(=O)C)OC 11a_100000184736_100015343762 [1,1,0,0,0,0|0,0,0]=2 983 B14R1.3723 COc1ccc(c(c1)NC(=O)C)OC 1626a_100000184736_100015343762 [1,1,0,0,0,0|0,0,0]=2 984 B14R1.3723 COc1ccc(c(c1)NC(=O)C)OC 22a_100000184736_100000070787 [1,1,0,0,0,0|0,0,0]=2 985 B14R1.3723 COc1ccc(c(c1)NC(=O)C)SC 62a_200000210301_100011665069 [1,1,0,0,0,0|0,1,0]=3 986 B14R1.3723 COc1ccc(c(c1)NC(=O)C)S[13CH3] 62a_200025704644_100011665069 [1,1,0,0,0,0|0,1,0]=3 987 B14R1.3723 COc1ccc(c(c1)NC(C)C)CO 34a_100011998734_100000210206 [1,1,0,0,0,0|1,0,1]=4 988 B14R1.3723 COc1ccc(c(c1)NC(C)C)OC 2230a_100000184736_100000210206 [1,1,0,0,0,0|1,0,1]=4 989 B14R1.3723 COc1ccc(c(c1)NC(C)C)OC 34a_100000184736_100000210206 [1,1,0,0,0,0|1,0,1]=4 990 B14R1.3723 COc1ccc(cc1C=C(C)C)CO 271570a_100102525489_100000246451 [1,1,0,0,0,0|2,0,0]=4 991 B14R1.3723 COc1ccc(cc1CC(=O)C)SC 62a_200011493461_200000210301 [1,1,0,0,0,0|1,1,0]=4 992 B14R1.3723 COc1ccc(cc1CC(=O)C)S[13CH3] 62a_200011493461_200025704644 [1,1,0,0,0,0|1,1,0]=4 993 B14R1.3723 COc1ccc(cc1NC(=O)C)C#N 11a_100000747721_100015343762 [1,1,0,0,0,0|1,0,1]=4 994 B14R1.3723 COc1ccc(cc1NC(=O)C)C#N 1626a_100000747721_100015343762 [1,1,0,0,0,0|1,0,1]=4 995 B14R1.3723 COc1ccc(cc1NC(=O)C)C#N 22a_100000747721_100000070787 [1,1,0,0,0,0|1,0,1]=4 996 B14R1.3723 COc1ccc(cc1NC(=O)C)CO 22a_100011269841_100000070787 [1,1,0,0,0,0|0,0,0]=2 997 B14R1.3723 COc1ccc(cc1NC(=O)C)N[13CH3] 34a_100000736378_200025704644 [1,1,0,0,0,0|1,0,0]=3 998 B14R1.3723 COc1ccc(cc1NC(=O)C)N[13CH3] 7a_100000736378_200025704644 [1,1,0,0,0,0|1,0,0]=3 999 B14R1.3723 COc1ccc(cc1NC(=O)C)SC 62a_200000210301_200011407902 [1,1,0,0,0,0|0,1,0]=3 1000 B14R1.3723 COc1ccc(cc1NC(=O)C)S[13CH3] 62a_200025704644_200011407902 [1,1,0,0,0,0|0,1,0]=3 1001 B14R1.3723 COc1ccc(cc1NC(C)C)CO 2230a_100011269841_100000210206 [1,1,0,0,0,0|1,0,1]=4 1002 B14R1.3723 COc1ccc(cc1NC(C)C)CO 34a_100011269841_100000210206 [1,1,0,0,0,0|1,0,1]=4 1003 B14R1.3724 C#CC(C)Nc1cc(ccc1O)CC 34a_100000765835_200000035995 [1,1,0,0,0,0|1,0,1]=4 1004 B14R1.3724 C#CC(C)Nc1cc(ccc1O)CO 34a_100000123545_200000035995 [1,1,0,0,0,0|1,0,1]=4 1005 B14R1.3724 C#CC(C)Nc1cc(ccc1O)OC 34a_100000188146_200000035995 [1,1,0,0,0,0|1,0,1]=4 1006 B14R1.3724 C=CC(=O)Nc1cc(ccc1Br)OC 1626a_100000748603_100000185746 [1,1,0,0,0,0|1,0,1]=4 1007 B14R1.3724 C=CC(=O)Nc1cc(ccc1Br)OC 22a_100000748603_100000185746 [1,1,0,0,0,0|1,0,1]=4 1008 B14R1.3724 C=CC(=O)Nc1cc(ccc1C)CC 1626a_200012022522_100000185746 [1,1,0,0,0,0|1,0,1]=4 1009 B14R1.3724 C=CC(=O)Nc1cc(ccc1C)CC 22a_200012022522_100000185746 [1,1,0,0,0,0|1,0,1]=4 1010 B14R1.3724 C=CC(=O)Nc1cc(ccc1C)CO 22a_100000758420_100000185746 [1,1,0,0,0,0|1,0,1]=4 1011 B14R1.3724 C=CC(=O)Nc1cc(ccc1C)OC 1626a_100000760359_100000185746 [1,1,0,0,0,0|1,0,1]=4 1012 B14R1.3724 C=CC(=O)Nc1cc(ccc1C)OC 22a_100000760359_100000185746 [1,1,0,0,0,0|1,0,1]=4 1013 B14R1.3724 C=CC(=O)Nc1cc(ccc1Cl)OC 1626a_100000745576_100000185746 [1,1,0,0,0,0|1,0,1]=4 1014 B14R1.3724 C=CC(=O)Nc1cc(ccc1Cl)OC 22a_100000745576_100000185746 [1,1,0,0,0,0|1,0,1]=4 1015 B14R1.3724 C=CC(=O)Nc1cc(ccc1F)CO 22a_102125399562_100000185746 [1,1,0,0,0,0|1,0,1]=4 1016 B14R1.3724 C=CC(=O)Nc1cc(ccc1F)OC 1626a_100000764331_100000185746 [1,1,0,0,0,0|1,0,1]=4 1017 B14R1.3724 C=CC(=O)Nc1cc(ccc1F)OC 22a_100000764331_100000185746 [1,1,0,0,0,0|1,0,1]=4 1018 B14R1.3724 C=CC(=O)Nc1cc(ccc1I)OC 1626a_100000748021_100000185746 [1,1,0,0,0,0|1,0,1]=4 1019 B14R1.3724 C=CC(=O)Nc1cc(ccc1I)OC 22a_100000748021_100000185746 [1,1,0,0,0,0|1,0,1]=4 1020 B14R1.3724 C=CC(=O)Nc1cc(ccc1O)CC 22a_100000765835_100000185746 [1,1,0,0,0,0|0,0,1]=3 1021 B14R1.3724 C=CC(=O)Nc1cc(ccc1O)CO 22a_100000123545_100000185746 [1,1,0,0,0,0|0,0,1]=3 1022 B14R1.3724 C=CC(=O)Nc1cc(ccc1O)OC 22a_100000188146_100000185746 [1,1,0,0,0,0|0,0,1]=3 1023 B14R1.3724 CC(CO)Nc1cc(ccc1O)CO 34a_100000123545_100012180447 [1,1,0,0,0,0|0,0,2]=4 1024 B14R1.3724 CCC(=O)Cc1cc(ccc1Br)OC 1458a_100000210414_100000761528 [1,1,0,0,0,0|2,0,0]=4 1025 B14R1.3724 CCC(=O)Cc1cc(ccc1Br)OC 1458a_100000690513_100000210202 [1,1,0,0,0,0|2,0,0]=4 1026 B14R1.3724 CCC(=O)Cc1cc(ccc1Cl)OC 1458a_100000210414_100000718613 [1,1,0,0,0,0|2,0,0]=4 1027 B14R1.3724 CCC(=O)Cc1cc(ccc1Cl)OC 1458a_100010217559_100000210202 [1,1,0,0,0,0|2,0,0]=4 1028 B14R1.3724 CCC(=O)Cc1cc(ccc1F)OC 1458a_100000210414_100010243555 [1,1,0,0,0,0|2,0,0]=4 1029 B14R1.3724 CCC(=O)Cc1cc(ccc1F)OC 1458a_100009868546_100000210202 [1,1,0,0,0,0|2,0,0]=4 1030 B14R1.3724 CCC(=O)Nc1cc(ccc1Br)OC 11a_100000748603_100000210414 [1,1,0,0,0,0|1,0,0]=3 1031 B14R1.3724 CCC(=O)Nc1cc(ccc1Br)OC 1626a_100000748603_100000210414 [1,1,0,0,0,0|1,0,0]=3 1032 B14R1.3724 CCC(=O)Nc1cc(ccc1Br)OC 22a_100000748603_100000210414 [1,1,0,0,0,0|1,0,0]=3 1033 B14R1.3724 CCC(=O)Nc1cc(ccc1C)CC 11a_200012022522_100000210414 [1,1,0,0,0,0|1,0,0]=3 1034 B14R1.3724 CCC(=O)Nc1cc(ccc1C)CC 1626a_200012022522_100000210414 [1,1,0,0,0,0|1,0,0]=3 1035 B14R1.3724 CCC(=O)Nc1cc(ccc1C)CC 22a_200012022522_100000210414 [1,1,0,0,0,0|1,0,0]=3 1036 B14R1.3724 CCC(=O)Nc1cc(ccc1C)CC 527a_200012022522_100000210414 [1,1,0,0,0,0|1,0,0]=3 1037 B14R1.3724 CCC(=O)Nc1cc(ccc1C)CO 22a_100000758420_100000210414 [1,1,0,0,0,0|1,0,0]=3 1038 B14R1.3724 CCC(=O)Nc1cc(ccc1C)NC 34a_200011193571_200000210301 [1,1,0,0,0,0|2,0,0]=4 1039 B14R1.3724 CCC(=O)Nc1cc(ccc1C)NC 7a_200011193571_200000210301 [1,1,0,0,0,0|2,0,0]=4 1040 B14R1.3724 CCC(=O)Nc1cc(ccc1C)N[13CH3] 34a_200011193571_200025704644 [1,1,0,0,0,0|2,0,0]=4 1041 B14R1.3724 CCC(=O)Nc1cc(ccc1C)N[13CH3] 7a_200011193571_200025704644 [1,1,0,0,0,0|2,0,0]=4 1042 B14R1.3724 CCC(=O)Nc1cc(ccc1C)OC 11a_100000760359_100000210414 [1,1,0,0,0,0|1,0,0]=3 1043 B14R1.3724 CCC(=O)Nc1cc(ccc1C)OC 1626a_100000760359_100000210414 [1,1,0,0,0,0|1,0,0]=3 1044 B14R1.3724 CCC(=O)Nc1cc(ccc1C)OC 22a_100000760359_100000210414 [1,1,0,0,0,0|1,0,0]=3 1045 B14R1.3724 CCC(=O)Nc1cc(ccc1C)OC 527a_100000760359_100000210414 [1,1,0,0,0,0|1,0,0]=3 1046 B14R1.3724 CCC(=O)Nc1cc(ccc1Cl)OC 11a_100000745576_100000210414 [1,1,0,0,0,0|1,0,0]=3 1047 B14R1.3724 CCC(=O)Nc1cc(ccc1Cl)OC 1626a_100000745576_100000210414 [1,1,0,0,0,0|1,0,0]=3 1048 B14R1.3724 CCC(=O)Nc1cc(ccc1Cl)OC 22a_100000745576_100000210414 [1,1,0,0,0,0|1,0,0]=3 1049 B14R1.3724 CCC(=O)Nc1cc(ccc1F)CO 22a_102125399562_100000210414 [1,1,0,0,0,0|1,0,0]=3 1050 B14R1.3724 CCC(=O)Nc1cc(ccc1F)OC 11a_100000764331_100000210414 [1,1,0,0,0,0|1,0,0]=3 1051 B14R1.3724 CCC(=O)Nc1cc(ccc1F)OC 1626a_100000764331_100000210414 [1,1,0,0,0,0|1,0,0]=3 1052 B14R1.3724 CCC(=O)Nc1cc(ccc1F)OC 22a_100000764331_100000210414 [1,1,0,0,0,0|1,0,0]=3 1053 B14R1.3724 CCC(=O)Nc1cc(ccc1F)OC 527a_100000764331_100000210414 [1,1,0,0,0,0|1,0,0]=3 1054 B14R1.3724 CCC(=O)Nc1cc(ccc1I)OC 11a_100000748021_100000210414 [1,1,0,0,0,0|1,0,0]=3 1055 B14R1.3724 CCC(=O)Nc1cc(ccc1I)OC 1626a_100000748021_100000210414 [1,1,0,0,0,0|1,0,0]=3 1056 B14R1.3724 CCC(=O)Nc1cc(ccc1I)OC 22a_100000748021_100000210414 [1,1,0,0,0,0|1,0,0]=3 1057 B14R1.3724 CCC(=O)Nc1cc(ccc1O)C#N 22a_100000766272_100000210414 [1,1,0,0,0,0|1,0,1]=4 1058 B14R1.3724 CCC(=O)Nc1cc(ccc1O)C#N 527a_100000766272_100000210414 [1,1,0,0,0,0|1,0,1]=4 1059 B14R1.3724 CCC(=O)Nc1cc(ccc1O)CC 22a_100000765835_100000210414 [1,1,0,0,0,0|0,0,0]=2 1060 B14R1.3724 CCC(=O)Nc1cc(ccc1O)CC 527a_100000765835_100000210414 [1,1,0,0,0,0|0,0,0]=2 1061 B14R1.3724 CCC(=O)Nc1cc(ccc1O)CO 22a_100000123545_100000210414 [1,1,0,0,0,0|0,0,0]=2 1062 B14R1.3724 CCC(=O)Nc1cc(ccc1O)CO 527a_100000123545_100000210414 [1,1,0,0,0,0|0,0,0]=2 1063 B14R1.3724 CCC(=O)Nc1cc(ccc1O)OC 22a_100000188146_100000210414 [1,1,0,0,0,0|0,0,0]=2 1064 B14R1.3724 CCC(=O)Nc1cc(ccc1O)OC 527a_100000188146_100000210414 [1,1,0,0,0,0|0,0,0]=2 1065 B14R1.3724 CCC(C)Nc1cc(ccc1O)CO 34a_100000123545_100011215416 [1,1,0,0,0,0|1,0,1]=4 1066 B14R1.3724 CCC(C)Nc1cc(ccc1O)OC 34a_100000188146_100011215416 [1,1,0,0,0,0|1,0,1]=4 1067 B14R1.3724 CCc1ccc(c(c1)NC(=O)CO)C 22a_200012022522_100000210174 [1,1,0,0,0,0|1,0,0]=3 1068 B14R1.3724 CCc1ccc(c(c1)NC(=O)CO)C 527a_200012022522_100000210174 [1,1,0,0,0,0|1,0,0]=3 1069 B14R1.3724 CCc1ccc(c(c1)NC(=O)CO)O 22a_100000765835_100000210174 [1,1,0,0,0,0|0,0,0]=2 1070 B14R1.3724 CCc1ccc(c(c1)NC(=O)CO)O 527a_100000765835_100000210174 [1,1,0,0,0,0|0,0,0]=2 1071 B14R1.3724 CCc1ccc(c(c1)NC(=O)NC)C 2430a_200012022522_100102657272 [1,1,0,0,0,0|1,0,0]=3 1072 B14R1.3724 CCc1ccc(c(c1)NC(=O)NC)O 2430a_100000765835_100102657272 [1,1,0,0,0,0|0,0,0]=2 1073 B14R1.3724 CCc1ccc(c(c1)NC(C)CC)O 34a_100000765835_100011215416 [1,1,0,0,0,0|1,0,1]=4 1074 B14R1.3724 CCc1ccc(c(c1)NC(C)CO)O 34a_100000765835_100012180447 [1,1,0,0,0,0|0,0,2]=4 1075 B14R1.3724 CNC(=O)Cc1cc(ccc1Br)OC 11a_106832991635_100000690513 [1,1,0,0,0,0|2,0,0]=4 1076 B14R1.3724 CNC(=O)Cc1cc(ccc1Br)OC 240690a_100102657272_100000690513 [1,1,0,0,0,0|2,0,0]=4 1077 B14R1.3724 CNC(=O)Cc1cc(ccc1Br)OC 527a_100102657272_100000690513 [1,1,0,0,0,0|2,0,0]=4 1078 B14R1.3724 CNC(=O)Cc1cc(ccc1Cl)OC 11a_106832991635_100010217559 [1,1,0,0,0,0|2,0,0]=4 1079 B14R1.3724 CNC(=O)Cc1cc(ccc1Cl)OC 1626a_100102657272_100010217559 [1,1,0,0,0,0|2,0,0]=4 1080 B14R1.3724 CNC(=O)Cc1cc(ccc1Cl)OC 240690a_100102657272_100010217559 [1,1,0,0,0,0|2,0,0]=4 1081 B14R1.3724 CNC(=O)Cc1cc(ccc1Cl)OC 527a_100102657272_100010217559 [1,1,0,0,0,0|2,0,0]=4 1082 B14R1.3724 CNC(=O)Cc1cc(ccc1F)OC 11a_106832991635_100009868546 [1,1,0,0,0,0|2,0,0]=4 1083 B14R1.3724 CNC(=O)Cc1cc(ccc1F)OC 1626a_100102657272_100009868546 [1,1,0,0,0,0|2,0,0]=4 1084 B14R1.3724 CNC(=O)Cc1cc(ccc1F)OC 240690a_100102657272_100009868546 [1,1,0,0,0,0|2,0,0]=4 1085 B14R1.3724 CNC(=O)Cc1cc(ccc1F)OC 527a_100102657272_100009868546 [1,1,0,0,0,0|2,0,0]=4 1086 B14R1.3724 CNC(=O)Nc1cc(ccc1Br)OC 2430a_100000748603_100102657272 [1,1,0,0,0,0|1,0,0]=3 1087 B14R1.3724 CNC(=O)Nc1cc(ccc1C)OC 2430a_100000760359_100102657272 [1,1,0,0,0,0|1,0,0]=3 1088 B14R1.3724 CNC(=O)Nc1cc(ccc1C)OC 512a_106832991638_100000760359 [1,1,0,0,0,0|1,0,0]=3 1089 B14R1.3724 CNC(=O)Nc1cc(ccc1Cl)OC 2430a_100000745576_100102657272 [1,1,0,0,0,0|1,0,0]=3 1090 B14R1.3724 CNC(=O)Nc1cc(ccc1F)OC 2430a_100000764331_100102657272 [1,1,0,0,0,0|1,0,0]=3 1091 B14R1.3724 CNC(=O)Nc1cc(ccc1I)OC 2430a_100000748021_100102657272 [1,1,0,0,0,0|1,0,0]=3 1092 B14R1.3724 CNC(=O)Nc1cc(ccc1O)C#N 2430a_100000766272_100102657272 [1,1,0,0,0,0|1,0,1]=4 1093 B14R1.3724 CNC(=O)Nc1cc(ccc1O)OC 2430a_100000188146_100102657272 [1,1,0,0,0,0|0,0,0]=2 1094 B14R1.3724 COC(=O)Cc1cc(ccc1O)SC 62a_100010185610_200000210301 [1,1,0,0,0,0|1,1,0]=4 1095 B14R1.3724 COC(=O)Cc1cc(ccc1O)SC 62a_200000210301_100010185610 [1,1,0,0,0,0|1,1,0]=4 1096 B14R1.3724 COC(=O)Cc1cc(ccc1O)S[13CH3] 62a_100010185610_200025704644 [1,1,0,0,0,0|1,1,0]=4 1097 B14R1.3724 COC(=O)Cc1cc(ccc1O)S[13CH3] 62a_200025704644_100010185610 [1,1,0,0,0,0|1,1,0]=4 1098 B14R1.3724 COc1ccc(c(c1)CC(=O)CF)Br 1458a_100000690513_100015361967 [1,1,0,0,0,0|2,0,0]=4 1099 B14R1.3724 COc1ccc(c(c1)CC(=O)CF)Cl 1458a_100010217559_100015361967 [1,1,0,0,0,0|2,0,0]=4 1100 B14R1.3724 COc1ccc(c(c1)CC(=O)CF)F 1458a_100009868546_100015361967 [1,1,0,0,0,0|2,0,0]=4 1101 B14R1.3724 COc1ccc(c(c1)CC(=O)CO)Br 1458a_100000210174_100000761528 [1,1,0,0,0,0|2,0,0]=4 1102 B14R1.3724 COc1ccc(c(c1)CC(=O)CO)Cl 1458a_100000210174_100000718613 [1,1,0,0,0,0|2,0,0]=4 1103 B14R1.3724 COc1ccc(c(c1)CC(=O)CO)F 1458a_100000210174_100010243555 [1,1,0,0,0,0|2,0,0]=4 1104 B14R1.3724 COc1ccc(c(c1)NC(=O)CO)Br 22a_100000748603_100000210174 [1,1,0,0,0,0|1,0,0]=3 1105 B14R1.3724 COc1ccc(c(c1)NC(=O)CO)C 22a_100000760359_100000210174 [1,1,0,0,0,0|1,0,0]=3 1106 B14R1.3724 COc1ccc(c(c1)NC(=O)CO)C 527a_100000760359_100000210174 [1,1,0,0,0,0|1,0,0]=3 1107 B14R1.3724 COc1ccc(c(c1)NC(=O)CO)Cl 22a_100000745576_100000210174 [1,1,0,0,0,0|1,0,0]=3 1108 B14R1.3724 COc1ccc(c(c1)NC(=O)CO)F 22a_100000764331_100000210174 [1,1,0,0,0,0|1,0,0]=3 1109 B14R1.3724 COc1ccc(c(c1)NC(=O)CO)F 527a_100000764331_100000210174 [1,1,0,0,0,0|1,0,0]=3 1110 B14R1.3724 COc1ccc(c(c1)NC(=O)CO)I 22a_100000748021_100000210174 [1,1,0,0,0,0|1,0,0]=3 1111 B14R1.3724 COc1ccc(c(c1)NC(=O)CO)O 22a_100000188146_100000210174 [1,1,0,0,0,0|0,0,0]=2 1112 B14R1.3724 COc1ccc(c(c1)NC(=O)CO)O 527a_100000188146_100000210174 [1,1,0,0,0,0|0,0,0]=2 1113 B14R1.3724 COc1ccc(c(c1)NC(C)CO)O 34a_100000188146_100012180447 [1,1,0,0,0,0|0,0,2]=4 1114 B14R1.3724 Cc1ccc(cc1NC(=O)CO)CO 22a_100000758420_100000210174 [1,1,0,0,0,0|1,0,0]=3 1115 B14R1.3724 N#Cc1ccc(c(c1)NC(=O)CO)O 22a_100000766272_100000210174 [1,1,0,0,0,0|1,0,1]=4 1116 B14R1.3724 N#Cc1ccc(c(c1)NC(=O)CO)O 527a_100000766272_100000210174 [1,1,0,0,0,0|1,0,1]=4 1117 B14R1.3724 O=C(CO)Nc1cc(ccc1F)CO 22a_102125399562_100000210174 [1,1,0,0,0,0|1,0,0]=3 1118 B14R1.3724 O=C(CO)Nc1cc(ccc1O)CO 22a_100000123545_100000210174 [1,1,0,0,0,0|0,0,0]=2 1119 B14R1.3724 O=C(CO)Nc1cc(ccc1O)CO 527a_100000123545_100000210174 [1,1,0,0,0,0|0,0,0]=2 1120 B14R1.439 CC=Cc1cc(ccc1C)NC(=O)C 271570a_100016259895_100011221169 [1,1,0,0,0,0|1,0,1]=4 1121 B14R1.439 CC=Cc1cc(ccc1F)NC(=O)C 271570a_100016259895_100012348134 [1,1,0,0,0,0|1,0,1]=4 1122 B14R1.439 CCNc1cc(ccc1C)NC(=O)C 34a_100000739390_100000210202 [1,1,0,0,0,0|2,0,0]=4 1123 B14R1.439 CCNc1cc(ccc1C)NC(=O)C 7a_100000739390_100000210202 [1,1,0,0,0,0|2,0,0]=4 1124 B14R1.439 CCNc1cc(ccc1Cl)NC(=O)C 34a_100000742996_100000210202 [1,1,0,0,0,0|2,0,0]=4 1125 B14R1.439 CCNc1cc(ccc1F)NC(=O)C 34a_106454645589_100000210202 [1,1,0,0,0,0|2,0,0]=4 1126 B14R1.439 CCOc1cc(ccc1Br)NC(=O)C 11a_200016990551_100015343762 [1,1,0,0,0,0|2,0,0]=4 1127 B14R1.439 CCOc1cc(ccc1Br)NC(=O)C 1626a_200016990551_100015343762 [1,1,0,0,0,0|2,0,0]=4 1128 B14R1.439 CCOc1cc(ccc1Br)NC(=O)C 22a_200016990551_100000070787 [1,1,0,0,0,0|2,0,0]=4 1129 B14R1.439 CCOc1cc(ccc1Br)NC(=O)C 527a_200016990551_100103153847 [1,1,0,0,0,0|2,0,0]=4 1130 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 11a_100011964961_100015343762 [1,1,0,0,0,0|2,0,0]=4 1131 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 1626a_100011964961_100015343762 [1,1,0,0,0,0|2,0,0]=4 1132 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 22a_100011964961_100000070787 [1,1,0,0,0,0|2,0,0]=4 1133 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 34a_100011935283_100000210202 [1,1,0,0,0,0|2,0,0]=4 1134 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 527a_100011964961_100103153847 [1,1,0,0,0,0|2,0,0]=4 1135 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 7a_100011935283_100000210202 [1,1,0,0,0,0|2,0,0]=4 1136 B14R1.439 CCSc1cc(ccc1C)NC(=O)C 62a_100000210202_100011221169 [1,1,0,0,0,0|2,0,0]=4 1137 B14R1.439 CCSc1cc(ccc1F)NC(=O)C 62a_100000210202_100012348134 [1,1,0,0,0,0|2,0,0]=4 1138 B14R1.439 CNCc1cc(ccc1Br)OC(=O)C 270004a_106832991635_100009816906 [1,1,0,0,0,0|2,0,0]=4 1139 B14R1.439 CNCc1cc(ccc1Cl)NC(=O)C 26a_100102657272_100011935283 [1,1,0,0,0,0|1,0,0]=3 1140 B14R1.439 COCc1cc(ccc1Br)C=C(C)C 271570a_100102525489_202125822959 [1,1,0,0,0,0|2,0,0]=4 1141 B14R1.439 COCc1cc(ccc1F)C=C(C)C 271570a_100102525489_100010140362 [1,1,0,0,0,0|2,0,0]=4 1142 B14R1.444 COCc1cc(cc(c1)C=C(C)C)F 271570a_100102525489_100012630430 [1,1,0,0,0,0|2,0,0]=4 1143 B14R1.469 CNCc1cccc(c1)NS(=O)(=O)C 207a_100102657272_100011218829 [1,1,0,0,0,0|2,0,0]=4 1144 B14R1.469 CNCc1cccc(c1)NS(=O)(=O)C 2230a_100000735428_200000210301 [1,1,0,0,0,0|2,0,0]=4 1145 B14R1.469 CNCc1cccc(c1)NS(=O)(=O)C 270004a_106832991635_100011218829 [1,1,0,0,0,0|2,0,0]=4 1146 B14R1.469 CNCc1cccc(c1)NS(=O)(=O)C 34a_100000735428_200000210301 [1,1,0,0,0,0|2,0,0]=4 1147 B14R1.469 COCc1cccc(c1)NC(C)(C)C 34a_100000737370_100000210625 [1,1,0,0,0,0|1,0,1]=4 1148 B14R1.469 COCc1cccc(c1)NS(=O)(=O)C 34a_100000198350_200000210301 [1,1,0,0,0,0|1,0,0]=3 1149 B14R1.469 COCc1cccc(c1)NS(=O)(=O)C 40a_100000737370_100000738038 [1,1,0,0,0,0|1,0,0]=3 1150 B14R1.469 COCc1cccc(c1)NS(=O)(=O)C 7a_100000198350_200000210301 [1,1,0,0,0,0|1,0,0]=3 1151 B14R1.469 CS(=O)(=O)Nc1cccc(c1)CN[13CH3] 2230a_100000735428_200025704644 [1,1,0,0,0,0|2,0,0]=4 1152 B14R1.469 CS(=O)(=O)Nc1cccc(c1)CN[13CH3] 34a_100000735428_200025704644 [1,1,0,0,0,0|2,0,0]=4 1153 B14R1.469 CS(=O)(=O)Nc1cccc(c1)CO[13CH3] 34a_100000198350_200025704644 [1,1,0,0,0,0|1,0,0]=3 1154 B14R1.469 CS(=O)(=O)Nc1cccc(c1)CO[13CH3] 7a_100000198350_200025704644 [1,1,0,0,0,0|1,0,0]=3 1155 B14R1.470 C#CC(C)Nc1cccc(c1)COC 34a_100000737370_200000035995 [1,1,0,0,0,0|1,0,1]=4 1156 B14R1.470 C=CC(=O)Nc1cccc(c1)CNC 26a_100102657272_100011235909 [1,1,0,0,0,0|1,0,1]=4 1157 B14R1.470 C=CC(=O)Nc1cccc(c1)COC 1626a_100000737370_100000185746 [1,1,0,0,0,0|0,0,1]=3 1158 B14R1.470 C=CC(=O)Nc1cccc(c1)COC 22a_100000737370_100000185746 [1,1,0,0,0,0|0,0,1]=3 1159 B14R1.470 CCC(=O)Nc1cccc(c1)CC#N 11a_100000017804_100000210414 [1,1,0,0,0,0|2,0,0]=4 1160 B14R1.470 CCC(=O)Nc1cccc(c1)CC#N 1626a_100000017804_100000210414 [1,1,0,0,0,0|2,0,0]=4 1161 B14R1.470 CCC(=O)Nc1cccc(c1)CC#N 22a_100000017804_100000210414 [1,1,0,0,0,0|2,0,0]=4 1162 B14R1.470 CCC(=O)Nc1cccc(c1)CC#N 527a_100000017804_100000210414 [1,1,0,0,0,0|2,0,0]=4 1163 B14R1.470 CCC(=O)Nc1cccc(c1)CCO 22a_100011996697_100000210414 [1,1,0,0,0,0|2,0,0]=4 1164 B14R1.470 CCC(=O)Nc1cccc(c1)CCO 527a_100011996697_100000210414 [1,1,0,0,0,0|2,0,0]=4 1165 B14R1.470 CCC(=O)Nc1cccc(c1)CNC 2230a_100000740940_200000210301 [1,1,0,0,0,0|1,0,0]=3 1166 B14R1.470 CCC(=O)Nc1cccc(c1)CNC 34a_100000740940_200000210301 [1,1,0,0,0,0|1,0,0]=3 1167 B14R1.470 CCC(=O)Nc1cccc(c1)CN[13CH3] 2230a_100000740940_200025704644 [1,1,0,0,0,0|1,0,0]=3 1168 B14R1.470 CCC(=O)Nc1cccc(c1)CN[13CH3] 34a_100000740940_200025704644 [1,1,0,0,0,0|1,0,0]=3 1169 B14R1.470 CCC(=O)Nc1cccc(c1)COC 11a_100000737370_100000210414 [1,1,0,0,0,0|0,0,0]=2 1170 B14R1.470 CCC(=O)Nc1cccc(c1)COC 1626a_100000737370_100000210414 [1,1,0,0,0,0|0,0,0]=2 1171 B14R1.470 CCC(=O)Nc1cccc(c1)COC 22a_100000737370_100000210414 [1,1,0,0,0,0|0,0,0]=2 1172 B14R1.470 CCC(=O)Nc1cccc(c1)COC 527a_100000737370_100000210414 [1,1,0,0,0,0|0,0,0]=2 1173 B14R1.470 CCC(C)Nc1cccc(c1)COC 2230a_100000737370_100000758301 [1,1,0,0,0,0|1,0,1]=4 1174 B14R1.470 CCC(C)Nc1cccc(c1)COC 34a_100000737370_100011215416 [1,1,0,0,0,0|1,0,1]=4 1175 B14R1.470 CCNc1cccc(c1)NC(=O)CC 34a_100000186510_100000210202 [1,1,0,0,0,0|2,0,0]=4 1176 B14R1.470 CCOc1cccc(c1)NC(=O)CC 11a_100000742568_100000210414 [1,1,0,0,0,0|2,0,0]=4 1177 B14R1.470 CCOc1cccc(c1)NC(=O)CC 1626a_100000742568_100000210414 [1,1,0,0,0,0|2,0,0]=4 1178 B14R1.470 CCOc1cccc(c1)NC(=O)CC 22a_100000742568_100000210414 [1,1,0,0,0,0|2,0,0]=4 1179 B14R1.470 CCOc1cccc(c1)NC(=O)CC 34a_100000158609_100000210202 [1,1,0,0,0,0|2,0,0]=4 1180 B14R1.470 CCOc1cccc(c1)NC(=O)CC 527a_100000742568_100000210414 [1,1,0,0,0,0|2,0,0]=4 1181 B14R1.470 CCOc1cccc(c1)NC(=O)CC 7a_100000158609_100000210202 [1,1,0,0,0,0|2,0,0]=4 1182 B14R1.470 CCOc1cccc(c1)NC(=O)CCl 34a_100011236192_100000210202 [1,1,0,0,0,0|2,0,0]=4 1183 B14R1.470 CCOc1cccc(c1)NC(=O)CCl 7a_100011236192_100000210202 [1,1,0,0,0,0|2,0,0]=4 1184 B14R1.470 CCOc1cccc(c1)NC(=O)CO 22a_100000742568_100000210174 [1,1,0,0,0,0|2,0,0]=4 1185 B14R1.470 CCOc1cccc(c1)NC(=O)CO 527a_100000742568_100000210174 [1,1,0,0,0,0|2,0,0]=4 1186 B14R1.470 CCOc1cccc(c1)NC(=O)NC 2430a_100000742568_100102657272 [1,1,0,0,0,0|2,0,0]=4 1187 B14R1.470 CCOc1cccc(c1)NC(=O)OC 34a_100000741004_100000210202 [1,1,0,0,0,0|2,0,0]=4 1188 B14R1.470 CCOc1cccc(c1)NC(=O)OC 7a_100000741004_100000210202 [1,1,0,0,0,0|2,0,0]=4 1189 B14R1.470 CNC(=O)Nc1cccc(c1)CC#N 2430a_100000017804_100102657272 [1,1,0,0,0,0|2,0,0]=4 1190 B14R1.470 CNC(=O)Nc1cccc(c1)CC#N 512a_100000017804_100102657272 [1,1,0,0,0,0|2,0,0]=4 1191 B14R1.470 CNC(=O)Nc1cccc(c1)CCO 512a_100011996697_100102657272 [1,1,0,0,0,0|2,0,0]=4 1192 B14R1.470 CNC(=O)Nc1cccc(c1)COC 2430a_100000737370_100102657272 [1,1,0,0,0,0|0,0,0]=2 1193 B14R1.470 CNC(=O)Nc1cccc(c1)COC 512a_100000737370_100102657272 [1,1,0,0,0,0|0,0,0]=2 1194 B14R1.470 COCc1cccc(c1)NC(=O)CO 22a_100000737370_100000210174 [1,1,0,0,0,0|0,0,0]=2 1195 B14R1.470 COCc1cccc(c1)NC(=O)CO 527a_100000737370_100000210174 [1,1,0,0,0,0|0,0,0]=2 1196 B14R1.470 COCc1cccc(c1)NC(C)C#N 2230a_100000737370_100000184139 [1,1,0,0,0,0|1,0,1]=4 1197 B14R1.470 COCc1cccc(c1)NC(C)CO 2230a_100000737370_100012180447 [1,1,0,0,0,0|0,0,2]=4 1198 B14R1.470 COCc1cccc(c1)NC(C)CO 34a_100000737370_100012180447 [1,1,0,0,0,0|0,0,2]=4 1199 B14R1.470 N#CCc1cccc(c1)NC(=O)CO 22a_100000017804_100000210174 [1,1,0,0,0,0|2,0,0]=4 1200 B14R1.470 N#CCc1cccc(c1)NC(=O)CO 527a_100000017804_100000210174 [1,1,0,0,0,0|2,0,0]=4 1201 B14R1.470 O=C(CO)Nc1cccc(c1)CCO 22a_100011996697_100000210174 [1,1,0,0,0,0|2,0,0]=4 1202 B14R1.470 O=C(CO)Nc1cccc(c1)CCO 527a_100011996697_100000210174 [1,1,0,0,0,0|2,0,0]=4 1203 B14R1.472 CCNc1cccc(c1C)NC(=O)C 34a_100000736503_100000210202 [1,1,0,0,0,0|2,0,0]=4 1204 B14R1.472 CCNc1cccc(c1C)NC(=O)C 7a_100000736503_100000210202 [1,1,0,0,0,0|2,0,0]=4 1205 B14R1.472 COCc1cccc(c1C)C=C(C)C 271570a_100102525489_100102485947 [1,1,0,0,0,0|2,0,0]=4 1206 B14R1.733 CCC(=O)c1cccc(c1)NC(=O)C 1458a_100000188798_100000210202 [1,1,0,0,0,0|1,0,1]=4 1207 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 11a_100000185133_100015343762 [1,1,0,0,0,0|1,0,1]=4 1208 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 11a_106832991635_100000188798 [1,1,0,0,0,0|1,0,1]=4 1209 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 1626a_100000185133_100015343762 [1,1,0,0,0,0|1,0,1]=4 1210 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 1626a_100102657272_100000188798 [1,1,0,0,0,0|1,0,1]=4 1211 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 22a_100000185133_100000070787 [1,1,0,0,0,0|1,0,1]=4 1212 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 240690a_100102657272_100000188798 [1,1,0,0,0,0|1,0,1]=4 1213 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 527a_100000185133_100103153847 [1,1,0,0,0,0|1,0,1]=4 1214 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 527a_100102657272_100000188798 [1,1,0,0,0,0|1,0,1]=4 1215 B14R1.733 CNC(C)c1cccc(c1)NC(=O)C 269862a_106832991636_100000155543 [1,1,0,0,0,0|1,0,0]=3 1216 B14R1.733 CNC(C)c1cccc(c1)OC(=O)C 269862a_106832991636_100000002162 [1,1,0,0,0,0|2,0,0]=4 1217 B14R1.733 COC(=O)c1cccc(c1)CC(=O)C 1458a_100000070787_100000184886 [1,1,0,0,0,0|1,0,1]=4 1218 B14R1.733 COC(=O)c1cccc(c1)CC(=O)C 1458a_100000111006_200000210301 [1,1,0,0,0,0|1,0,1]=4 1219 B14R1.733 COC(=O)c1cccc(c1)CC(=O)[13CH3] 1458a_100000111006_200025704644 [1,1,0,0,0,0|1,0,1]=4 1220 B14R1.733 COC(=O)c1cccc(c1)NC(=O)C 188690a_100020604953_100015343762 [1,1,0,0,0,0|0,0,1]=3 1221 B14R1.778 C#CCNc1cccc(c1)NC(=O)C 34a_100000749408_100000184674 [1,1,0,0,0,0|1,0,1]=4 1222 B14R1.778 C#CCOc1cccc(c1)NC(=O)C 34a_100000158604_100000184674 [1,1,0,0,0,0|1,0,1]=4 1223 B14R1.778 C#CCOc1cccc(c1)NC(=O)C 7a_100000158604_100000038162 [1,1,0,0,0,0|1,0,1]=4 1224 B14R1.778 C#CCSc1cccc(c1)NC(=O)C 62a_100000038162_100000153616 [1,1,0,0,0,0|1,0,1]=4 1225 B14R1.778 C=CCNc1cccc(c1)NC(=O)C 34a_100000749408_100015514636 [1,1,0,0,0,0|1,0,1]=4 1226 B14R1.778 C=CCOc1cccc(c1)NC(=O)C 34a_100000158604_100015514636 [1,1,0,0,0,0|1,0,1]=4 1227 B14R1.778 C=CCOc1cccc(c1)NC(=O)C 7a_100000158604_100015514636 [1,1,0,0,0,0|1,0,1]=4 1228 B14R1.778 C=CCSc1cccc(c1)NC(=O)C 62a_100000210623_100000153616 [1,1,0,0,0,0|1,0,1]=4 1229 B14R1.778 CC(=O)Nc1cccc(c1)CCCO 22a_200000698965_100000070787 [1,1,0,0,0,0|1,0,0]=3 1230 B14R1.778 CC(=O)Nc1cccc(c1)CCCO 527a_200000698965_100103153847 [1,1,0,0,0,0|1,0,0]=3 1231 B14R1.778 CC(=O)Nc1cccc(c1)CNCF 34a_100000740035_100015361967 [1,1,0,0,0,0|1,0,0]=3 1232 B14R1.778 CC(=O)Nc1cccc(c1)NCC=O 34a_100000749408_200009817547 [1,1,0,0,0,0|2,0,0]=4 1233 B14R1.778 CC(=O)Nc1cccc(c1)NCCF 34a_100000749408_100011217306 [1,1,0,0,0,0|2,0,0]=4 1234 B14R1.778 CC(=O)Nc1cccc(c1)NCCO 34a_100000749408_100000211926 [1,1,0,0,0,0|2,0,0]=4 1235 B14R1.778 CC(=O)Nc1cccc(c1)OCC#N 11a_100000739570_100015343762 [1,1,0,0,0,0|2,0,0]=4 1236 B14R1.778 CC(=O)Nc1cccc(c1)OCC#N 1626a_100000739570_100015343762 [1,1,0,0,0,0|2,0,0]=4 1237 B14R1.778 CC(=O)Nc1cccc(c1)OCC#N 22a_100000739570_100000070787 [1,1,0,0,0,0|2,0,0]=4 1238 B14R1.778 CC(=O)Nc1cccc(c1)OCC#N 527a_100000739570_100103153847 [1,1,0,0,0,0|2,0,0]=4 1239 B14R1.778 CC(=O)Nc1cccc(c1)OCC#N 7a_100000158604_100011215382 [1,1,0,0,0,0|2,0,0]=4 1240 B14R1.778 CC(=O)Nc1cccc(c1)OCC=O 34a_100000158604_200009817547 [1,1,0,0,0,0|2,0,0]=4 1241 B14R1.778 CC(=O)Nc1cccc(c1)OCC=O 7a_100000158604_200015260668 [1,1,0,0,0,0|2,0,0]=4 1242 B14R1.778 CC(=O)Nc1cccc(c1)OCCF 34a_100000158604_100011217306 [1,1,0,0,0,0|2,0,0]=4 1243 B14R1.778 CC(=O)Nc1cccc(c1)OCCF 7a_100000158604_100011217306 [1,1,0,0,0,0|2,0,0]=4 1244 B14R1.778 CC(=O)Nc1cccc(c1)OCCO 22a_100011232151_100000070787 [1,1,0,0,0,0|2,0,0]=4 1245 B14R1.778 CC(=O)Nc1cccc(c1)OCCO 34a_100000158604_100000211926 [1,1,0,0,0,0|2,0,0]=4 1246 B14R1.778 CC(=O)Nc1cccc(c1)OCCO 527a_100011232151_100103153847 [1,1,0,0,0,0|2,0,0]=4 1247 B14R1.778 CC(=O)Nc1cccc(c1)OCCO 7a_100000158604_100000211926 [1,1,0,0,0,0|2,0,0]=4 1248 B14R1.778 CC(=O)Nc1cccc(c1)SCC#N 62a_100011215382_100000153616 [1,1,0,0,0,0|2,0,0]=4 1249 B14R1.778 CC(=O)Nc1cccc(c1)SCC=O 62a_200015260668_100000153616 [1,1,0,0,0,0|2,0,0]=4 1250 B14R1.778 CC(=O)Nc1cccc(c1)SCCF 62a_100011217306_100000153616 [1,1,0,0,0,0|2,0,0]=4 1251 B14R1.778 CC(=O)Nc1cccc(c1)SCCO 62a_100000211926_100000153616 [1,1,0,0,0,0|2,0,0]=4 1252 B14R1.778 CC(=O)Oc1cccc(c1)CSCF 62a_100015361967_200009816940 [1,1,0,0,0,0|1,1,0]=4 1253 B14R1.778 CC(=O)Oc1cccc(c1)CSCF 62a_200009816940_100015361967 [1,1,0,0,0,0|1,1,0]=4 1254 B14R1.778 CCCCc1cc(ccn1)NC(=O)C 271570a_100020621405_100000238608 [1,1,0,0,0,0|2,0,0]=4 1255 B14R1.778 CCCCc1cccc(c1)CC(=O)C 271570a_100020621405_100000689217 [1,1,0,0,0,0|2,0,0]=4 1256 B14R1.778 CCCCc1cccc(c1)NC(=O)C 11a_200012017287_100015343762 [1,1,0,0,0,0|1,0,0]=3 1257 B14R1.778 CCCCc1cccc(c1)NC(=O)C 1626a_200012017287_100015343762 [1,1,0,0,0,0|1,0,0]=3 1258 B14R1.778 CCCCc1cccc(c1)NC(=O)C 22a_200012017287_100000070787 [1,1,0,0,0,0|1,0,0]=3 1259 B14R1.778 CCCCc1cccc(c1)NC(=O)C 271570a_100020621405_100000153616 [1,1,0,0,0,0|1,0,0]=3 1260 B14R1.778 CCCCc1cccc(c1)NC(=O)C 527a_200012017287_100103153847 [1,1,0,0,0,0|1,0,0]=3 1261 B14R1.778 CCCCc1cccc(c1)NC(=O)N 271570a_100020621405_100000238923 [1,1,0,0,0,0|2,0,0]=4 1262 B14R1.778 CCCCc1cccc(c1)OC(=O)C 271570a_100020621405_100009811612 [1,1,0,0,0,0|2,0,0]=4 1263 B14R1.778 CCCCc1cccc(n1)NC(=O)C 271570a_100020621405_200011307899 [1,1,0,0,0,0|2,0,0]=4 1264 B14R1.778 CCCCc1ccnc(c1)NC(=O)C 271570a_100020621405_100012362434 [1,1,0,0,0,0|2,0,0]=4 1265 B14R1.778 CCCCc1cncc(c1)NC(=O)C 271570a_100020621405_100012351681 [1,1,0,0,0,0|2,0,0]=4 1266 B14R1.778 CCCNc1cccc(c1)NC(=O)C 34a_100000749408_100000210303 [1,1,0,0,0,0|1,0,0]=3 1267 B14R1.778 CCCNc1cccc(c1)NC(=O)N 34a_100000736001_100000210303 [1,1,0,0,0,0|2,0,0]=4 1268 B14R1.778 CCCOc1cccc(c1)CC(=O)C 1458a_100000690745_200000210301 [1,1,0,0,0,0|2,0,0]=4 1269 B14R1.778 CCCOc1cccc(c1)CC(=O)[13CH3] 1458a_100000690745_200025704644 [1,1,0,0,0,0|2,0,0]=4 1270 B14R1.778 CCCOc1cccc(c1)NC(=O)C 34a_100000158604_100000210303 [1,1,0,0,0,0|1,0,0]=3 1271 B14R1.778 CCCOc1cccc(c1)NC(=O)C 7a_100000158604_100000210303 [1,1,0,0,0,0|1,0,0]=3 1272 B14R1.778 CCCOc1cccc(c1)NC(=O)N 34a_100011219624_100000210303 [1,1,0,0,0,0|2,0,0]=4 1273 B14R1.778 CCCOc1cccc(c1)NC(=O)N 7a_100011219624_100000210303 [1,1,0,0,0,0|2,0,0]=4 1274 B14R1.778 CCCOc1cccc(c1)OC(=O)C 7a_100011218754_100000210303 [1,1,0,0,0,0|2,0,0]=4 1275 B14R1.778 CCCSc1cc(ccn1)NC(=O)C 62a_100000210303_100000238608 [1,1,0,0,0,0|2,0,0]=4 1276 B14R1.778 CCCSc1cccc(c1)CC(=O)C 62a_100000210303_100000689217 [1,1,0,0,0,0|2,0,0]=4 1277 B14R1.778 CCCSc1cccc(c1)CC(=O)C 62a_100000689217_100000210303 [1,1,0,0,0,0|2,0,0]=4 1278 B14R1.778 CCCSc1cccc(c1)NC(=O)C 62a_100000210303_100000153616 [1,1,0,0,0,0|1,0,0]=3 1279 B14R1.778 CCCSc1cccc(c1)NC(=O)N 62a_100000210303_100000238923 [1,1,0,0,0,0|2,0,0]=4 1280 B14R1.778 CCCSc1cccc(c1)OC(=O)C 62a_100000210303_100009811612 [1,1,0,0,0,0|2,0,0]=4 1281 B14R1.778 CCCSc1cccc(n1)NC(=O)C 62a_100000210303_200011307899 [1,1,0,0,0,0|2,0,0]=4 1282 B14R1.778 CCCSc1ccnc(c1)NC(=O)C 62a_100000210303_100012362434 [1,1,0,0,0,0|2,0,0]=4 1283 B14R1.778 CCCSc1cncc(c1)NC(=O)C 62a_100000210303_100012351681 [1,1,0,0,0,0|2,0,0]=4 1284 B14R1.778 CCNCc1cccc(c1)NC(=O)C 207a_100015525214_100011257792 [1,1,0,0,0,0|1,0,0]=3 1285 B14R1.778 CCNCc1cccc(c1)NC(=O)C 2230a_100000740035_100000210202 [1,1,0,0,0,0|1,0,0]=3 1286 B14R1.778 CCNCc1cccc(c1)NC(=O)C 270004a_100015525214_100011257792 [1,1,0,0,0,0|1,0,0]=3 1287 B14R1.778 CCNCc1cccc(c1)NC(=O)C 34a_100000740035_100000210202 [1,1,0,0,0,0|1,0,0]=3 1288 B14R1.778 CCNCc1cccc(c1)OC(=O)C 207a_100015525214_100000014719 [1,1,0,0,0,0|2,0,0]=4 1289 B14R1.778 CCNCc1cccc(c1)OC(=O)C 2230a_100015525214_200009816940 [1,1,0,0,0,0|2,0,0]=4 1290 B14R1.778 CCNCc1cccc(c1)OC(=O)C 270004a_100015525214_100000014719 [1,1,0,0,0,0|2,0,0]=4 1291 B14R1.778 CCOCc1cccc(c1)C=C(C)C 271570a_100102525489_100011493694 [1,1,0,0,0,0|2,0,0]=4 1292 B14R1.778 CCOCc1cccc(c1)OC(=O)C 34a_100121572206_200009816940 [1,1,0,0,0,0|1,0,0]=3 1293 B14R1.778 CCSCc1cccc(c1)OC(=O)C 62a_100000210202_200009816940 [1,1,0,0,0,0|1,1,0]=4 1294 B14R1.778 CCSCc1cccc(c1)OC(=O)C 62a_200009816940_100000210202 [1,1,0,0,0,0|1,1,0]=4 1295 B14R1.778 COCNc1cccc(c1)CC(=O)N 2230a_200011690101_100000766300 [1,1,0,0,0,0|2,0,0]=4 1296 B14R1.778 COCOc1cccc(c1)C=C(C)C 271570a_100102525489_100012265688 [1,1,0,0,0,0|2,0,0]=4 1297 B14R1.778 COCOc1cccc(c1)NC(=O)C 11a_100012265470_100015343762 [1,1,0,0,0,0|0,0,0]=2 1298 B14R1.778 COCOc1cccc(c1)NC(=O)C 1626a_100012265470_100015343762 [1,1,0,0,0,0|0,0,0]=2 1299 B14R1.778 COCOc1cccc(c1)NC(=O)C 22a_100012265470_100000070787 [1,1,0,0,0,0|0,0,0]=2 1300 B14R1.778 COCOc1cccc(c1)NC(=O)C 527a_100012265470_100103153847 [1,1,0,0,0,0|0,0,0]=2 1301 B14R1.778 COCOc1cccc(c1)NC(C)C 34a_100012265470_100000210206 [1,1,0,0,0,0|1,0,1]=4 1302 B14R1.778 COCSc1cc(ccn1)NC(=O)C 62a_100000766300_100000238608 [1,1,0,0,0,0|1,0,0]=3 1303 B14R1.778 COCSc1cccc(c1)CC(=O)C 62a_100000689217_100000766300 [1,1,0,0,0,0|1,0,0]=3 1304 B14R1.778 COCSc1cccc(c1)CC(=O)C 62a_100000766300_100000689217 [1,1,0,0,0,0|1,0,0]=3 1305 B14R1.778 COCSc1cccc(c1)CC(=O)N 62a_100000766300_100011586816 [1,1,0,0,0,0|2,0,0]=4 1306 B14R1.778 COCSc1cccc(c1)CC(=O)N 62a_100011586816_100000766300 [1,1,0,0,0,0|2,0,0]=4 1307 B14R1.778 COCSc1cccc(c1)NC(=O)C 62a_100000766300_100000153616 [1,1,0,0,0,0|0,0,0]=2 1308 B14R1.778 COCSc1cccc(c1)NC(=O)N 62a_100000766300_100000238923 [1,1,0,0,0,0|1,0,0]=3 1309 B14R1.778 COCSc1cccc(c1)NC(C)C 62a_100000219649_100000766300 [1,1,0,0,0,0|1,0,1]=4 1310 B14R1.778 COCSc1cccc(c1)NC(C)C 62a_100000766300_100000219649 [1,1,0,0,0,0|1,0,1]=4 1311 B14R1.778 COCSc1cccc(c1)OC(=O)C 62a_100000766300_100009811612 [1,1,0,0,0,0|1,0,0]=3 1312 B14R1.778 COCSc1cccc(n1)NC(=O)C 62a_100000766300_200011307899 [1,1,0,0,0,0|1,0,0]=3 1313 B14R1.778 COCSc1ccnc(c1)NC(=O)C 62a_100000766300_100012362434 [1,1,0,0,0,0|1,0,0]=3 1314 B14R1.778 COCSc1cncc(c1)NC(=O)C 62a_100000766300_100012351681 [1,1,0,0,0,0|1,0,0]=3 1315 B14R1.778 COCSc1cncc(n1)NC(=O)C 62a_100000766300_100000703374 [1,1,0,0,0,0|2,0,0]=4 1316 B14R1.778 CSCNc1cccc(c1)NC(=O)C 34a_100000749408_100011218213 [1,1,0,0,0,0|0,1,0]=3 1317 B14R1.778 CSCNc1cccc(c1)NC(=O)N 34a_100000736001_100011218213 [1,1,0,0,0,0|1,1,0]=4 1318 B14R1.778 CSCOc1cccc(c1)NC(=O)C 34a_100000158604_100011218213 [1,1,0,0,0,0|0,1,0]=3 1319 B14R1.778 CSCOc1cccc(c1)NC(=O)N 34a_100011219624_100011218213 [1,1,0,0,0,0|1,1,0]=4 1320 B14R1.778 CSCSc1cc(ccn1)NC(=O)C 62a_100011218213_100000238608 [1,1,0,0,0,0|1,1,0]=4 1321 B14R1.778 CSCSc1cccc(c1)CC(=O)C 62a_100000689217_100011218213 [1,1,0,0,0,0|1,1,0]=4 1322 B14R1.778 CSCSc1cccc(c1)CC(=O)C 62a_100011218213_100000689217 [1,1,0,0,0,0|1,1,0]=4 1323 B14R1.778 CSCSc1cccc(c1)NC(=O)C 62a_100011218213_100000153616 [1,1,0,0,0,0|0,1,0]=3 1324 B14R1.778 CSCSc1cccc(c1)NC(=O)N 62a_100011218213_100000238923 [1,1,0,0,0,0|1,1,0]=4 1325 B14R1.778 CSCSc1cccc(c1)OC(=O)C 62a_100011218213_100009811612 [1,1,0,0,0,0|1,1,0]=4 1326 B14R1.778 CSCSc1cccc(n1)NC(=O)C 62a_100011218213_200011307899 [1,1,0,0,0,0|1,1,0]=4 1327 B14R1.778 CSCSc1ccnc(c1)NC(=O)C 62a_100011218213_100012362434 [1,1,0,0,0,0|1,1,0]=4 1328 B14R1.778 CSCSc1cncc(c1)NC(=O)C 62a_100011218213_100012351681 [1,1,0,0,0,0|1,1,0]=4 1329 B14R1.811 CC(=O)Cc1cccc(c1)OC(=O)C 1458a_100000070787_200009816940 [1,1,0,0,0,0|2,0,0]=4 1330 B14R1.811 CC(=O)Nc1cccc(c1)C=C(C)C 271570a_100102525489_100000153616 [1,1,0,0,0,0|1,0,1]=4 1331 B14R1.811 CC(=O)Nc1cccc(c1)CC(=O)N 11a_200011690101_100015343762 [1,1,0,0,0,0|2,0,0]=4 1332 B14R1.811 CC(=O)Nc1cccc(c1)CC(=O)N 1626a_200011690101_100015343762 [1,1,0,0,0,0|2,0,0]=4 1333 B14R1.811 CC(=O)Nc1cccc(c1)CC(=O)N 22a_200011690101_100000070787 [1,1,0,0,0,0|2,0,0]=4 1334 B14R1.811 CC(=O)Nc1cccc(c1)CC(=O)N 527a_200011690101_100103153847 [1,1,0,0,0,0|2,0,0]=4 1335 B14R1.811 CC(=O)Nc1cccc(c1)CN(C)C 11a_100000738294_100015343762 [1,1,0,0,0,0|1,0,0]=3 1336 B14R1.811 CC(=O)Nc1cccc(c1)CN(C)C 22a_100000738294_100000070787 [1,1,0,0,0,0|1,0,0]=3 1337 B14R1.811 CC(=O)Nc1cccc(c1)CN(C)C 270004a_100102631434_100011257792 [1,1,0,0,0,0|1,0,0]=3 1338 B14R1.811 CC(=O)Nc1cccc(c1)CN(C)C 527a_100000738294_100103153847 [1,1,0,0,0,0|1,0,0]=3 1339 B14R1.811 CC(=O)Nc1cccc(c1)NC(=O)C 11a_100000749408_100015343762 [1,1,0,0,0,0|2,0,0]=4 1340 B14R1.811 CC(=O)Nc1cccc(c1)NC(=O)C 1626a_100000749408_100015343762 [1,1,0,0,0,0|2,0,0]=4 1341 B14R1.811 CC(=O)Nc1cccc(c1)NC(=O)C 22a_100000749408_100000070787 [1,1,0,0,0,0|2,0,0]=4 1342 B14R1.811 CC(=O)Nc1cccc(c1)NC(=O)C 527a_100000749408_100103153847 [1,1,0,0,0,0|2,0,0]=4 1343 B14R1.811 CC(=O)Nc1cccc(c1)NC(C)C 34a_100000749408_100000210206 [1,1,0,0,0,0|2,0,0]=4 1344 B14R1.811 CC(=O)Nc1cccc(c1)OC(C)C 11a_100011194262_100015343762 [1,1,0,0,0,0|2,0,0]=4 1345 B14R1.811 CC(=O)Nc1cccc(c1)OC(C)C 1626a_100011194262_100015343762 [1,1,0,0,0,0|2,0,0]=4 1346 B14R1.811 CC(=O)Nc1cccc(c1)OC(C)C 22a_100011194262_100000070787 [1,1,0,0,0,0|2,0,0]=4 1347 B14R1.811 CC(=O)Nc1cccc(c1)OC(C)C 34a_100000158604_100000210206 [1,1,0,0,0,0|2,0,0]=4 1348 B14R1.811 CC(=O)Nc1cccc(c1)OC(C)C 527a_100011194262_100103153847 [1,1,0,0,0,0|2,0,0]=4 1349 B14R1.811 CC(=O)Nc1cccc(c1)OC(C)C 7a_100000158604_100000210206 [1,1,0,0,0,0|2,0,0]=4 1350 B14R1.811 CC(=O)Nc1cccc(c1)SC(C)C 62a_100000210206_100000153616 [1,1,0,0,0,0|2,0,0]=4 1351 B14R1.811 CC(=O)Oc1cccc(c1)CN(C)C 2230a_100102631434_200009816940 [1,1,0,0,0,0|2,0,0]=4 1352 B14R1.811 CC(=O)Oc1cccc(c1)CN(C)C 269982a_100102631434_200009816940 [1,1,0,0,0,0|2,0,0]=4 1353 B14R1.811 CC(=O)Oc1cccc(c1)CN(C)C 270004a_100102631434_100000014719 [1,1,0,0,0,0|2,0,0]=4 1354 B14R1.3326 CC(=O)N(C)c1cccc(c1)CN[13CH3] 2230a_100020605210_200025704644 [1,1,0,0,0,0|1,0,0]=3 1355 B14R1.3326 CCNc1cccc(c1)N(C)C(=O)C 34a_100000765750_100000210202 [1,1,0,0,0,0|2,0,0]=4 1356 B14R1.3326 CNCc1cccc(c1)N(C)C(=O)C 2230a_100020605210_200000210301 [1,1,0,0,0,0|1,0,0]=3 1357 B14R1.3326 COCc1cccc(c1)C(=C(C)C)C 271570a_200000049429_100011493687 [1,1,0,0,0,0|2,0,0]=4 1358 B14R1.436 CC=Cc1cc(ccc1O)C(=O)OC 271570a_100016259895_100000216328 [1,1,0,0,0,0|1,0,1]=4 1359 B14R1.761 C=CCNc1cc(ccc1Br)COC 34a_200013033220_100015514636 [1,1,0,0,0,0|1,0,1]=4 1360 B14R1.761 CCCNc1cc(ccc1Br)COC 34a_200013033220_100000210303 [1,1,0,0,0,0|1,0,1]=4 1361 B14R1.761 COCc1ccc(c(c1)NCC=O)Br 34a_200013033220_200009817547 [1,1,0,0,0,0|1,0,0]=3 1362 B14R1.761 COCc1ccc(c(c1)NCCF)Br 34a_200013033220_100011217306 [1,1,0,0,0,0|1,0,1]=4 1363 B14R1.761 COCc1ccc(c(c1)NCCO)Br 34a_200013033220_100000211926 [1,1,0,0,0,0|1,0,1]=4 1364 B14R1.761 COCc1ccc(c(c1)NCSC)Br 34a_200013033220_100011218213 [1,1,0,0,0,0|1,0,1]=4 1365 B14R1.761 COCc1ccc(c(c1)SCC=O)C 62a_200015260668_200015395492 [1,1,0,0,0,0|2,0,0]=4 1366 B14R1.761 COCc1ccc(c(c1)SCC=O)C 62a_200015395492_200015260668 [1,1,0,0,0,0|2,0,0]=4 1367 B14R1.761 COCc1ccc(c(c1)SCC=O)F 62a_200011493689_200015260668 [1,1,0,0,0,0|2,0,0]=4 1368 B14R1.761 COCc1ccc(c(c1)SCC=O)F 62a_200015260668_200011493689 [1,1,0,0,0,0|2,0,0]=4 1369 B14R1.791 CC=Cc1cc(ccc1C)OCOC 271570a_100016259895_200015918306 [1,1,0,0,0,0|2,0,0]=4 1370 B14R1.791 CCNc1cc(ccc1N)SCOC 62a_100000696630_100000766300 [1,1,0,0,0,0|1,0,1]=4 1371 B14R1.791 CCNc1cc(ccc1N)SCOC 62a_100000766300_100000696630 [1,1,0,0,0,0|1,0,1]=4 1372 B14R1.791 CNCc1cc(ccc1O)SCOC 62a_100000766300_100011602694 [1,1,0,0,0,0|2,0,0]=4 1373 B14R1.791 CNCc1cc(ccc1O)SCOC 62a_100011602694_100000766300 [1,1,0,0,0,0|2,0,0]=4 1374 B14R1.705 C=C(C)c1cc(ccc1O)CC(=O)C 271570a_100000694244_100010141077 [0,1,0,0,1,0|2,0,0]=4 1375 B14R1.705 CC(=O)Nc1ccc(c(c1)C(=O)C)O 1458a_100000743812_200000210301 [0,1,0,0,1,0|2,0,0]=4 1376 B14R1.705 CC(=O)Nc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000743812_200025704644 [0,1,0,0,1,0|2,0,0]=4 1377 B14R1.705 CC(=O)c1cc(ccc1O)C=C(C)C 271570a_100102525489_100000212127 [0,1,0,0,1,0|1,0,1]=4 1378 B14R1.748 C=C(C)c1cc(ccc1O)C(=O)OC 271570a_100000694244_100000216328 [0,1,0,0,1,0|1,0,1]=4 1379 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)C)Br 1458a_100010710364_200000210301 [0,1,0,0,1,0|1,0,1]=4 1380 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)C)Cl 1458a_200000732520_200000210301 [0,1,0,0,1,0|1,0,1]=4 1381 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)C)O 271570a_203496583355_200016005208 [0,1,0,0,1,0|0,0,1]=3 1382 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)[13CH3])Br 1458a_100010710364_200025704644 [0,1,0,0,1,0|1,0,1]=4 1383 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)[13CH3])Cl 1458a_200000732520_200025704644 [0,1,0,0,1,0|1,0,1]=4 1384 B14R1.794 C=C(C)c1cc(ccc1C)OCOC 271570a_100000694244_200015918306 [0,1,0,0,1,0|2,0,0]=4 1385 B14R1.794 CCCCc1ccc(c(c1)C(=O)C)C 271570a_100020621405_100012706819 [0,1,0,0,1,0|2,0,0]=4 1386 B14R1.794 CCCCc1ccc(c(c1)C(=O)C)Cl 271570a_100020621405_100010712560 [0,1,0,0,1,0|2,0,0]=4 1387 B14R1.794 CCCCc1ccc(c(c1)C(=O)C)F 271570a_100020621405_100000689017 [0,1,0,0,1,0|2,0,0]=4 1388 B14R1.794 CCCCc1ccc(c(c1)C(=O)C)N 271570a_100020621405_100000695420 [0,1,0,0,1,0|2,0,0]=4 1389 B14R1.794 CCCCc1ccc(c(c1)C(=O)C)O 271570a_100020621405_100000212127 [0,1,0,0,1,0|1,0,0]=3 1390 B14R1.794 CCCCc1ccc(c(c1)C(=O)N)O 271570a_100020621405_100000192807 [0,1,0,0,1,0|2,0,0]=4 1391 B14R1.794 CCCOc1ccc(c(c1)C(=O)C)Cl 34a_100009867868_100000210303 [0,1,0,0,1,0|2,0,0]=4 1392 B14R1.794 CCCOc1ccc(c(c1)C(=O)C)Cl 7a_100009867868_100000210303 [0,1,0,0,1,0|2,0,0]=4 1393 B14R1.794 CCCOc1ccc(c(c1)C(=O)C)F 34a_100000091700_100000210303 [0,1,0,0,1,0|2,0,0]=4 1394 B14R1.794 CCCOc1ccc(c(c1)C(=O)C)F 7a_100000091700_100000210303 [0,1,0,0,1,0|2,0,0]=4 1395 B14R1.794 CCCSc1ccc(c(c1)C(=O)C)C 62a_100012706819_100000210303 [0,1,0,0,1,0|2,0,0]=4 1396 B14R1.794 CCCSc1ccc(c(c1)C(=O)C)Cl 62a_100010712560_100000210303 [0,1,0,0,1,0|2,0,0]=4 1397 B14R1.794 CCCSc1ccc(c(c1)C(=O)C)F 62a_100000210303_100010254839 [0,1,0,0,1,0|2,0,0]=4 1398 B14R1.794 CCCSc1ccc(c(c1)C(=O)C)F 62a_100000689017_100000210303 [0,1,0,0,1,0|2,0,0]=4 1399 B14R1.794 CCCSc1ccc(c(c1)C(=O)C)N 62a_100000695420_100000210303 [0,1,0,0,1,0|2,0,0]=4 1400 B14R1.794 CCCSc1ccc(c(c1)C(=O)N)O 62a_100000192807_100000210303 [0,1,0,0,1,0|2,0,0]=4 1401 B14R1.794 COCOc1ccc(c(c1)C(=O)C)Br 1458a_200012945975_200000210301 [0,1,0,0,1,0|1,0,0]=3 1402 B14R1.794 COCOc1ccc(c(c1)C(=O)[13CH3])Br 1458a_200012945975_200025704644 [0,1,0,0,1,0|1,0,0]=3 1403 B14R1.794 COCSc1cc(c(cn1)F)C(=O)C 62a_100000697832_100000766300 [0,1,0,0,1,0|2,0,0]=4 1404 B14R1.794 COCSc1cc(c(cn1)F)C(=O)C 62a_100000766300_100000697832 [0,1,0,0,1,0|2,0,0]=4 1405 B14R1.794 COCSc1ccc(c(c1)C(=O)C)C 62a_100012706819_100000766300 [0,1,0,0,1,0|1,0,0]=3 1406 B14R1.794 COCSc1ccc(c(c1)C(=O)C)Cl 62a_100010712560_100000766300 [0,1,0,0,1,0|1,0,0]=3 1407 B14R1.794 COCSc1ccc(c(c1)C(=O)C)F 62a_100000689017_100000766300 [0,1,0,0,1,0|1,0,0]=3 1408 B14R1.794 COCSc1ccc(c(c1)C(=O)C)F 62a_100000766300_100010254839 [0,1,0,0,1,0|1,0,0]=3 1409 B14R1.794 COCSc1ccc(c(c1)C(=O)C)N 62a_100000695420_100000766300 [0,1,0,0,1,0|1,0,0]=3 1410 B14R1.794 COCSc1ccc(c(c1)C(=O)N)C 62a_100000766300_100012257281 [0,1,0,0,1,0|2,0,0]=4 1411 B14R1.794 COCSc1ccc(c(c1)C(=O)N)C 62a_100012257281_100000766300 [0,1,0,0,1,0|2,0,0]=4 1412 B14R1.794 COCSc1ccc(c(c1)C(=O)N)F 62a_100000162119_100000766300 [0,1,0,0,1,0|2,0,0]=4 1413 B14R1.794 COCSc1ccc(c(c1)C(=O)N)N 62a_100000740421_100000766300 [0,1,0,0,1,0|2,0,0]=4 1414 B14R1.794 COCSc1ccc(c(c1)C(=O)N)O 62a_100000192807_100000766300 [0,1,0,0,1,0|1,0,0]=3 1415 B14R1.794 COCSc1ccc(c(c1)C(C)C)O 62a_100000691460_100000766300 [0,1,0,0,1,0|1,0,1]=4 1416 B14R1.794 COCSc1ccc(c(c1)C(C)C)O 62a_100000766300_100000691460 [0,1,0,0,1,0|1,0,1]=4 1417 B14R1.794 COCSc1ccc(c(n1)C(=O)C)F 62a_100000766300_100009887703 [0,1,0,0,1,0|2,0,0]=4 1418 B14R1.794 COCSc1ccc(c(n1)C(=O)C)F 62a_100009887703_100000766300 [0,1,0,0,1,0|2,0,0]=4 1419 B14R1.794 COCSc1cnc(c(c1)C(=O)C)C 62a_100000766300_100138557192 [0,1,0,0,1,0|2,0,0]=4 1420 B14R1.794 COCSc1cnc(c(c1)C(=O)C)C 62a_100138557192_100000766300 [0,1,0,0,1,0|2,0,0]=4 1421 B14R1.794 COCSc1cnc(c(c1)C(=O)C)F 62a_100000766300_100010254234 [0,1,0,0,1,0|2,0,0]=4 1422 B14R1.794 COCSc1cnc(c(c1)C(=O)C)F 62a_100010254234_100000766300 [0,1,0,0,1,0|2,0,0]=4 1423 B14R1.794 COCSc1cnc(c(c1)C(=O)C)N 62a_100000766300_100010173950 [0,1,0,0,1,0|2,0,0]=4 1424 B14R1.794 COCSc1cnc(c(c1)C(=O)C)N 62a_100010173950_100000766300 [0,1,0,0,1,0|2,0,0]=4 1425 B14R1.794 CSCOc1ccc(c(c1)C(=O)C)Cl 34a_100009867868_100011218213 [0,1,0,0,1,0|1,1,0]=4 1426 B14R1.794 CSCOc1ccc(c(c1)C(=O)C)F 34a_100000091700_100011218213 [0,1,0,0,1,0|1,1,0]=4 1427 B14R1.794 CSCSc1ccc(c(c1)C(=O)C)C 62a_100012706819_100011218213 [0,1,0,0,1,0|1,1,0]=4 1428 B14R1.794 CSCSc1ccc(c(c1)C(=O)C)Cl 62a_100010712560_100011218213 [0,1,0,0,1,0|1,1,0]=4 1429 B14R1.794 CSCSc1ccc(c(c1)C(=O)C)F 62a_100000689017_100011218213 [0,1,0,0,1,0|1,1,0]=4 1430 B14R1.794 CSCSc1ccc(c(c1)C(=O)C)F 62a_100011218213_100010254839 [0,1,0,0,1,0|1,1,0]=4 1431 B14R1.794 CSCSc1ccc(c(c1)C(=O)C)N 62a_100000695420_100011218213 [0,1,0,0,1,0|1,1,0]=4 1432 B14R1.794 CSCSc1ccc(c(c1)C(=O)N)O 62a_100000192807_100011218213 [0,1,0,0,1,0|1,1,0]=4 1433 B14R1.3329 CC=Cc1cc(c(cc1C)O)C(=O)C 271570a_100016259895_200010233951 [0,1,0,0,1,0|1,0,1]=4 1434 B14R1.3329 CC=Cc1cc(c(cc1F)O)C(=O)C 271570a_100016259895_100000691652 [0,1,0,0,1,0|1,0,1]=4 1435 B14R1.3329 CCSc1cc(c(cc1C)O)C(=O)C 62a_200010233951_100000210202 [0,1,0,0,1,0|2,0,0]=4 1436 B14R1.3329 CCSc1cc(c(cc1F)O)C(=O)C 62a_100000691652_100000210202 [0,1,0,0,1,0|2,0,0]=4 1437 B14R1.6794 CC=Cc1ccc(c(c1)C(=O)C)OC 271570a_100016259895_100000173343 [0,1,0,0,1,0|1,0,1]=4 1438 B14R1.6794 CCCc1ccc(c(c1)C(=O)C)OC 34a_200011698639_200000210301 [0,1,0,0,1,0|1,0,0]=3 1439 B14R1.6794 CCCc1ccc(c(c1)C(=O)C)OC 7a_200011698639_200000210301 [0,1,0,0,1,0|1,0,0]=3 1440 B14R1.6794 CCCc1ccc(c(c1)C(=O)C)O[13CH3] 34a_200011698639_200025704644 [0,1,0,0,1,0|1,0,0]=3 1441 B14R1.6794 CCCc1ccc(c(c1)C(=O)C)O[13CH3] 7a_200011698639_200025704644 [0,1,0,0,1,0|1,0,0]=3 1442 B14R1.6794 CCOc1ccc(c(c1)C(=O)C)OC 34a_100000081070_100000210202 [0,1,0,0,1,0|2,0,0]=4 1443 B14R1.6794 CCOc1ccc(c(c1)C(=O)C)OC 7a_100000081070_100000210202 [0,1,0,0,1,0|2,0,0]=4 1444 B14R1.6794 CCSc1ccc(c(c1)C(=O)C)OC 62a_100000173343_100000210202 [0,1,0,0,1,0|2,0,0]=4 1445 B14R1.6794 COCc1ccc(c(c1)[N+](=O)[O-])OC 34a_100011218723_200000210301 [0,1,0,0,1,0|2,0,0]=4 1446 B14R1.6794 COCc1ccc(c(c1)[N+](=O)[O-])OC 34a_100138415774_100000737651 [0,1,0,0,1,0|2,0,0]=4 1447 B14R1.6794 COCc1ccc(c(c1)[N+](=O)[O-])OC 7a_100011218723_200000210301 [0,1,0,0,1,0|2,0,0]=4 1448 B14R1.6794 COc1ccc(cc1[N+](=O)[O-])CO[13CH3] 34a_100011218723_200025704644 [0,1,0,0,1,0|2,0,0]=4 1449 B14R1.6794 COc1ccc(cc1[N+](=O)[O-])CO[13CH3] 7a_100011218723_200025704644 [0,1,0,0,1,0|2,0,0]=4 1450 B16R1.13503 CCC(=O)CSc1cc(ccc1C)COC 62a_100000747405_200015395492 [0,1,0,0,0,1|2,0,0]=4 1451 B16R1.13503 CCC(=O)CSc1cc(ccc1C)COC 62a_200015395492_100000747405 [0,1,0,0,0,1|2,0,0]=4 1452 B16R1.13503 CCC(=O)CSc1cc(ccc1F)COC 62a_100000747405_200011493689 [0,1,0,0,0,1|2,0,0]=4 1453 B16R1.13503 CCC(=O)CSc1cc(ccc1F)COC 62a_200011493689_100000747405 [0,1,0,0,0,1|2,0,0]=4 1454 B16R1.13503 CNC(=O)CNc1cc(ccc1Br)COC 34a_200013033220_100000183359 [0,1,0,0,0,1|1,0,0]=3 1455 B16R1.13503 CNC(=O)CSc1cc(ccc1C)COC 62a_100000183359_200015395492 [0,1,0,0,0,1|2,0,0]=4 1456 B16R1.13503 CNC(=O)CSc1cc(ccc1C)COC 62a_200015395492_100000183359 [0,1,0,0,0,1|2,0,0]=4 1457 B16R1.13503 CNC(=O)CSc1cc(ccc1F)COC 62a_100000183359_200011493689 [0,1,0,0,0,1|2,0,0]=4 1458 B16R1.13503 CNC(=O)CSc1cc(ccc1F)COC 62a_200011493689_100000183359 [0,1,0,0,0,1|2,0,0]=4 1459 B16R1.13503 COCc1ccc(c(c1)NCC(=O)OC)Br 34a_200013033220_100000747449 [0,1,0,0,0,1|1,0,0]=3 1460 B16R1.13503 COCc1ccc(c(c1)SCC(=O)OC)C 62a_100000747449_200015395492 [0,1,0,0,0,1|2,0,0]=4 1461 B16R1.13503 COCc1ccc(c(c1)SCC(=O)OC)C 62a_200015395492_100000747449 [0,1,0,0,0,1|2,0,0]=4 1462 B16R1.13503 COCc1ccc(c(c1)SCC(=O)OC)F 62a_100000747449_200011493689 [0,1,0,0,0,1|2,0,0]=4 1463 B16R1.13503 COCc1ccc(c(c1)SCC(=O)OC)F 62a_200011493689_100000747449 [0,1,0,0,0,1|2,0,0]=4 1464 B16R1.13505 CNCc1ccc(c(c1)COC(=O)C)OC 270004a_106832991635_100000028344 [0,1,0,0,0,1|2,0,0]=4 1465 B16R1.13526 C=C(C)C(=O)Nc1cc(ccc1Br)COC 11a_200013033220_100000185857 [0,1,0,0,0,1|2,0,0]=4 1466 B16R1.13526 C=C(C)C(=O)Nc1cc(ccc1Br)COC 1626a_200013033220_100000185857 [0,1,0,0,0,1|2,0,0]=4 1467 B16R1.13526 COCc1ccc(c(c1)NC(C)C(=O)N)Br 34a_200013033220_100000702099 [0,1,0,0,0,1|2,0,0]=4 1468 B16R1.13526 COCc1ccc(c(c1)NC(F)C(=O)N)Br 34a_200013033220_100009813875 [0,1,0,0,0,1|2,0,0]=4 1469 B16R1.13526 COCc1ccc(c(c1)NC(F)C(=O)[O-])Br 34a_200013033220_100020610796 [0,1,0,0,0,1|2,0,0]=4 1470 B16R1.13526 COCc1ccc(c(c1)SC(C)C(=O)C)C 62a_100009814033_200015395492 [0,1,0,0,0,1|2,0,0]=4 1471 B16R1.13526 COCc1ccc(c(c1)SC(C)C(=O)C)C 62a_200015395492_100009814033 [0,1,0,0,0,1|2,0,0]=4 1472 B16R1.13526 COCc1ccc(c(c1)SC(C)C(=O)C)F 62a_100009814033_200011493689 [0,1,0,0,0,1|2,0,0]=4 1473 B16R1.13526 COCc1ccc(c(c1)SC(C)C(=O)C)F 62a_200011493689_100009814033 [0,1,0,0,0,1|2,0,0]=4 1474 B16R1.1044 CC(=O)Nc1cc(ccc1O)C(=O)N(C)C 240690a_100102631434_100011219828 [0,2,0,0,0,0|1,0,1]=4 1475 B16R1.4315 COc1ccc(cc1NC(=O)C)C=C(C)C 271570a_100102525489_200011407902 [0,2,0,0,0,0|1,0,1]=4 1476 B16R1.4315 COc1ccc(cc1NC(=O)C)NC(=O)C 11a_100000211725_100015343762 [0,2,0,0,0,0|2,0,0]=4 1477 B16R1.4315 COc1ccc(cc1NC(=O)C)NC(=O)C 11a_100000736378_100015343762 [0,2,0,0,0,0|2,0,0]=4 1478 B16R1.4315 COc1ccc(cc1NC(=O)C)NC(=O)C 1626a_100000211725_100015343762 [0,2,0,0,0,0|2,0,0]=4 1479 B16R1.4315 COc1ccc(cc1NC(=O)C)NC(=O)C 1626a_100000736378_100015343762 [0,2,0,0,0,0|2,0,0]=4 1480 B16R1.4315 COc1ccc(cc1NC(=O)C)NC(=O)C 22a_100000211725_100000070787 [0,2,0,0,0,0|2,0,0]=4 1481 B16R1.4315 COc1ccc(cc1NC(=O)C)NC(=O)C 22a_100000736378_100000070787 [0,2,0,0,0,0|2,0,0]=4 1482 B16R1.4315 COc1ccc(cc1NC(=O)C)NC(=O)C 527a_100000211725_100103153847 [0,2,0,0,0,0|2,0,0]=4 1483 B16R1.4315 COc1ccc(cc1NC(=O)C)NC(=O)C 527a_100000736378_100103153847 [0,2,0,0,0,0|2,0,0]=4 1484 B16R1.4315 COc1ccc(cc1NC(=O)C)NC(C)C 34a_100000736378_100000210206 [0,2,0,0,0,0|2,0,0]=4 1485 B16R1.4315 COc1ccc(cc1NC(=O)C)NC(C)C 7a_100000736378_100000210206 [0,2,0,0,0,0|2,0,0]=4 1486 B16R1.4315 COc1ccc(cc1NC(=O)C)SC(C)C 62a_100000210206_200011407902 [0,2,0,0,0,0|2,0,0]=4 1487 B16R1.4315 COc1ccc(cc1OC(=O)C)CN(C)C 270004a_100102631434_100000014717 [0,2,0,0,0,0|2,0,0]=4 1488 B16R1.4420 C#CC(C)Nc1ccc(c(c1)NC(=O)C)O 34a_100000070259_200000035995 [0,2,0,0,0,0|1,0,1]=4 1489 B16R1.4420 CC(=O)Nc1cc(ccc1O)NC(=O)CO 22a_100000070259_100000210174 [0,2,0,0,0,0|2,0,0]=4 1490 B16R1.4420 CC(=O)Nc1cc(ccc1O)NC(=O)CO 527a_100000070259_100000210174 [0,2,0,0,0,0|2,0,0]=4 1491 B16R1.4420 CC(=O)Nc1cc(ccc1O)NC(C)C#N 7a_100000070259_100000703298 [0,2,0,0,0,0|2,0,0]=4 1492 B16R1.4420 CC(=O)Nc1cc(ccc1O)NC(C)CO 34a_100000070259_100012180447 [0,2,0,0,0,0|2,0,0]=4 1493 B16R1.4420 CC(=O)Nc1cc(ccc1O)NC(C)CO 7a_100000070259_100012180447 [0,2,0,0,0,0|2,0,0]=4 1494 B16R1.4420 CCC(=O)Nc1ccc(c(c1)NC(=O)C)O 22a_100000070259_100000210414 [0,2,0,0,0,0|1,0,1]=4 1495 B16R1.4420 CCC(=O)Nc1ccc(c(c1)NC(=O)C)O 527a_100000070259_100000210414 [0,2,0,0,0,0|1,0,1]=4 1496 B16R1.4420 CCC(C)Nc1ccc(c(c1)NC(=O)C)C 34a_100000740626_100011215416 [0,2,0,0,0,0|2,0,0]=4 1497 B16R1.4420 CCC(C)Nc1ccc(c(c1)NC(=O)C)C 7a_100000740626_100000758301 [0,2,0,0,0,0|2,0,0]=4 1498 B16R1.4420 CCC(C)Nc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_100011215416 [0,2,0,0,0,0|2,0,0]=4 1499 B16R1.4420 CCC(C)Nc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_100000758301 [0,2,0,0,0,0|2,0,0]=4 1500 B16R1.4420 CCC(C)Nc1ccc(c(c1)NC(=O)C)F 34a_100000736141_100011215416 [0,2,0,0,0,0|2,0,0]=4 1501 B16R1.4420 CCC(C)Nc1ccc(c(c1)NC(=O)C)F 7a_100000736141_100000758301 [0,2,0,0,0,0|2,0,0]=4 1502 B16R1.4420 CCC(C)Nc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100011215416 [0,2,0,0,0,0|1,0,0]=3 1503 B16R1.4420 CCC(C)Nc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000758301 [0,2,0,0,0,0|1,0,0]=3 1504 B16R1.4420 CCC(C)Sc1ccc(c(c1)CC(=O)C)O 62a_100000758301_200010006938 [0,2,0,0,0,0|2,0,0]=4 1505 B16R1.4420 CCC(C)Sc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100000758301 [0,2,0,0,0,0|2,0,0]=4 1506 B16R1.4420 CCC(C)Sc1ccc(c(c1)NC(=O)C)C 62a_100000758301_100011344836 [0,2,0,0,0,0|2,0,0]=4 1507 B16R1.4420 CCC(C)Sc1ccc(c(c1)NC(=O)C)F 62a_100000758301_200011951791 [0,2,0,0,0,0|2,0,0]=4 1508 B16R1.4420 CNC(=O)Nc1ccc(c(c1)NC(=O)C)O 2430a_100000070259_100102657272 [0,2,0,0,0,0|1,0,1]=4 1509 B16R1.4420 COC(=O)Cc1ccc(c(c1)C=C(C)C)O 271570a_100102525489_100010222482 [0,2,0,0,0,0|2,0,0]=4 1510 B16R1.4420 COC(=O)Cc1ccc(c(c1)NC(=O)C)Cl 188690a_100009845532_100015343762 [0,2,0,0,0,0|1,0,0]=3 1511 B16R1.4420 COC(=O)Cc1ccc(c(c1)NC(=O)C)O 188690a_100000067991_100015343762 [0,2,0,0,0,0|0,0,0]=2 1512 B16R1.4420 COC(C)Sc1ccc(c(c1)CC(=O)C)O 62a_100009879195_200010006938 [0,2,0,0,0,0|1,0,0]=3 1513 B16R1.4420 COC(C)Sc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100009879195 [0,2,0,0,0,0|1,0,0]=3 1514 B16R1.4420 COC(C)Sc1ccc(c(c1)NC(=O)C)C 62a_100009879195_100011344836 [0,2,0,0,0,0|1,0,0]=3 1515 B16R1.4420 COC(C)Sc1ccc(c(c1)NC(=O)C)F 62a_100009879195_200011951791 [0,2,0,0,0,0|1,0,0]=3 1516 B16R1.4420 COC(C)Sc1ccc(c(c1)OC(=O)C)C 62a_100009879195_100103282185 [0,2,0,0,0,0|2,0,0]=4 1517 B16R1.4420 COC(C)Sc1ccc(c(c1)OC(=O)C)C 62a_100103282185_100009879195 [0,2,0,0,0,0|2,0,0]=4 1518 B16R1.4420 COC(C)Sc1cnc(c(c1)NC(=O)C)C 62a_100009879195_100010117071 [0,2,0,0,0,0|2,0,0]=4 1519 B16R1.4420 COC(C)Sc1cnc(c(c1)NC(=O)C)C 62a_100010117071_100009879195 [0,2,0,0,0,0|2,0,0]=4 1520 B16R1.16543 CC(=O)Nc1cc(ccc1O)CS(=O)(=O)N 11a_200010686696_100015343762 [0,2,0,0,0,0|1,1,0]=4 1521 B16R1.16543 CC(=O)Nc1cc(ccc1O)CS(=O)(=O)N 22a_200010686696_100000070787 [0,2,0,0,0,0|1,1,0]=4 1522 B16R1.16543 CC(=O)Nc1cc(ccc1O)NC(C)(C)C 34a_100000070259_100000210625 [0,2,0,0,0,0|2,0,0]=4 1523 B16R1.16543 CC(=O)Nc1cc(ccc1O)NS(=O)(=O)C 40a_100000070259_100000738038 [0,2,0,0,0,0|1,1,0]=4 1524 B16R1.379 CCC(C)(C)c1ccc(c(c1)NC(=O)C)O 1626a_100011217233_100015343762 [0,2,0,0,0,0|1,0,0]=3 1525 B16R1.379 CCC(C)(C)c1ccc(c(c1)NC(=O)C)O 22a_100011217233_100000070787 [0,2,0,0,0,0|1,0,0]=3 1526 B16R1.379 CCC(C)(C)c1ccc(c(c1)NC(=O)C)O 527a_100011217233_100103153847 [0,2,0,0,0,0|1,0,0]=3 1527 B16R1.379 CCS(=O)(=O)c1ccc(c(c1)NC(=O)C)O 22a_100000210498_100000070787 [0,2,0,0,0,0|2,0,0]=4 1528 B16R1.379 CCS(=O)(=O)c1ccc(c(c1)NC(=O)C)O 527a_100000210498_100103153847 [0,2,0,0,0,0|2,0,0]=4 1529 B16R1.379 CNS(=O)(=O)c1ccc(c(c1)NC(=O)C)O 22a_100000732981_100000070787 [0,2,0,0,0,0|2,0,0]=4 1530 B16R1.379 CNS(=O)(=O)c1ccc(c(c1)NC(=O)C)O 527a_100000732981_100103153847 [0,2,0,0,0,0|2,0,0]=4 1531 B16R1.966 CCCC(=O)c1ccc(c(c1)NC(=O)C)C 1458a_100000194935_100000210303 [0,2,0,0,0,0|2,0,0]=4 1532 B16R1.966 CCCC(=O)c1ccc(c(c1)NC(=O)C)F 1458a_100000744603_100000210303 [0,2,0,0,0,0|2,0,0]=4 1533 B16R1.966 CCNC(=O)c1ccc(c(c1)NC(=O)C)O 240690a_100015525214_100011219828 [0,2,0,0,0,0|1,0,1]=4 1534 B16R1.966 CCOC(=O)c1ccc(c(c1)NC(=O)C)Br 188690a_200011450955_100015343762 [0,2,0,0,0,0|1,0,1]=4 1535 B16R1.966 CCOC(=O)c1ccc(c(c1)NC(=O)C)C 188690a_100000246206_100015343762 [0,2,0,0,0,0|1,0,1]=4 1536 B16R1.966 CCOC(=O)c1ccc(c(c1)NC(=O)C)F 188690a_100011356284_100015343762 [0,2,0,0,0,0|1,0,1]=4 1537 B16R1.966 CCOC(=O)c1ccc(c(c1)NC(=O)C)O 188690a_100011450745_100015343762 [0,2,0,0,0,0|0,0,1]=3 1538 B16R1.4312 CNC(=O)c1ccc(c(c1)NC(=O)C)OC 11a_100000740754_100015343762 [0,2,0,0,0,0|1,0,1]=4 1539 B16R1.4312 CNC(=O)c1ccc(c(c1)NC(=O)C)OC 1626a_100000740754_100015343762 [0,2,0,0,0,0|1,0,1]=4 1540 B16R1.4312 CNC(=O)c1ccc(c(c1)NC(=O)C)OC 22a_100000740754_100000070787 [0,2,0,0,0,0|1,0,1]=4 1541 B16R1.4312 CNC(C)c1ccc(c(c1)NC(=O)C)OC 269862a_106832991636_100000058992 [0,2,0,0,0,0|1,0,0]=3 1542 B16R1.4312 COC(=O)c1ccc(c(c1)CC(=O)C)OC 1458a_100000070787_200010762020 [0,2,0,0,0,0|1,0,1]=4 1543 B16R1.4312 COC(=O)c1ccc(c(c1)NC(=O)C)OC 188690a_100011217029_100015343762 [0,2,0,0,0,0|0,0,1]=3 1544 B16R1.4312 COC(=O)c1cnc(c(c1)NC(=O)C)OC 188690a_100009959742_100015343762 [0,2,0,0,0,0|1,0,1]=4 1545 B16R1.4375 CCC(=O)Nc1cc(ccc1Br)C(=O)OC 188690a_100011450966_100000210414 [0,2,0,0,0,0|1,0,1]=4 1546 B16R1.4375 CCC(=O)Nc1cc(ccc1C)C(=O)OC 188690a_100000742527_100000210414 [0,2,0,0,0,0|1,0,1]=4 1547 B16R1.4375 CCC(=O)Nc1cc(ccc1F)C(=O)OC 188690a_100000735820_100000210414 [0,2,0,0,0,0|1,0,1]=4 1548 B16R1.4375 CCC(=O)Nc1cc(ccc1O)C(=O)OC 188690a_100000724433_100000210414 [0,2,0,0,0,0|0,0,1]=3 1549 B16R1.4375 COC(=O)c1ccc(c(c1)NC(=O)CO)Br 188690a_100011450966_100000210174 [0,2,0,0,0,0|1,0,1]=4 1550 B16R1.4375 COC(=O)c1ccc(c(c1)NC(=O)CO)C 188690a_100000742527_100000210174 [0,2,0,0,0,0|1,0,1]=4 1551 B16R1.4375 COC(=O)c1ccc(c(c1)NC(=O)CO)F 188690a_100000735820_100000210174 [0,2,0,0,0,0|1,0,1]=4 1552 B16R1.4375 COC(=O)c1ccc(c(c1)NC(=O)CO)O 188690a_100000724433_100000210174 [0,2,0,0,0,0|0,0,1]=3 1553 B16R1.17267 COC(=O)c1cc(c(cc1Br)C)NC(=O)C 188690a_100000730709_100015343762 [0,2,0,0,0,0|1,0,1]=4 1554 B16R1.17267 COC(=O)c1cc(c(cc1C)C)NC(=O)C 188690a_100000717011_100015343762 [0,2,0,0,0,0|1,0,1]=4 1555 B16R1.17267 COC(=O)c1cc(c(cc1Cl)Br)NC(=O)C 188690a_100011794319_100015343762 [0,2,0,0,0,0|1,0,1]=4 1556 B16R1.17267 COC(=O)c1cc(c(cc1Cl)F)NC(=O)C 188690a_100011794259_100015343762 [0,2,0,0,0,0|1,0,1]=4 1557 B16R1.17267 COC(=O)c1cc(c(cc1F)Br)NC(=O)C 188690a_100000760059_100015343762 [0,2,0,0,0,0|1,0,1]=4 1558 B16R1.17267 COC(=O)c1cc(c(cc1F)C)NC(=O)C 188690a_100012720804_100015343762 [0,2,0,0,0,0|1,0,1]=4 1559 B16R1.17267 COC(=O)c1cc(c(cc1F)F)NC(=O)C 188690a_100000735891_100015343762 [0,2,0,0,0,0|1,0,1]=4 1560 B16R1.17267 COC(=O)c1cc(c(cc1O)O)NC(=O)C 188690a_200011155615_100015343762 [0,2,0,0,0,0|0,0,1]=3 1561 B16R1.76827 COC(=O)c1ccc(c(c1C)NC(=O)C)C 188690a_100010688716_100015343762 [0,2,0,0,0,0|1,0,1]=4 1562 B16R1.76827 COC(=O)c1ccc(c(c1C)NC(=O)C)F 188690a_100010588117_100015343762 [0,2,0,0,0,0|1,0,1]=4 1563 B16R1.76827 COC(=O)c1ccc(c(c1Cl)NC(=O)C)C 188690a_100009984613_100015343762 [0,2,0,0,0,0|1,0,1]=4 1564 B16R1.94469 COC(=O)c1cc(c(c(c1)NC(=O)C)C)Br 188690a_100012353609_100015343762 [0,2,0,0,0,0|1,0,1]=4 1565 B16R1.94469 COC(=O)c1cc(c(c(c1)NC(=O)C)F)Br 188690a_200010713629_100015343762 [0,2,0,0,0,0|1,0,1]=4 1566 B16R1.94469 COC(=O)c1cc(c(c(c1)NC(=O)C)O)Cl 188690a_100010571316_100015343762 [0,2,0,0,0,0|0,0,1]=3 1567 B16R1.1045 C=C(C)CNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_100000748629 [0,2,0,0,0,0|2,0,0]=4 1568 B16R1.1045 C=C(C)CNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_100000748629 [0,2,0,0,0,0|2,0,0]=4 1569 B16R1.1045 C=C(C)CNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_100000748629 [0,2,0,0,0,0|2,0,0]=4 1570 B16R1.1045 C=C(C)CNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_100000748629 [0,2,0,0,0,0|2,0,0]=4 1571 B16R1.1045 C=C(C)CNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_100000748629 [0,2,0,0,0,0|2,0,0]=4 1572 B16R1.1045 C=C(C)CNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_100000748629 [0,2,0,0,0,0|2,0,0]=4 1573 B16R1.1045 C=C(C)CNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100000748629 [0,2,0,0,0,0|1,0,0]=3 1574 B16R1.1045 C=C(C)CNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000748629 [0,2,0,0,0,0|1,0,0]=3 1575 B16R1.1045 C=C(C)CSc1ccc(c(c1)CC(=O)C)O 62a_100000748629_200010006938 [0,2,0,0,0,0|2,0,0]=4 1576 B16R1.1045 C=C(C)CSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100000211660 [0,2,0,0,0,0|2,0,0]=4 1577 B16R1.1045 C=C(C)CSc1ccc(c(c1)NC(=O)C)C 62a_100000748629_100011344836 [0,2,0,0,0,0|2,0,0]=4 1578 B16R1.1045 C=C(C)CSc1ccc(c(c1)NC(=O)C)F 62a_100000748629_200011951791 [0,2,0,0,0,0|2,0,0]=4 1579 B16R1.1045 C=C(F)CNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100009893438 [0,2,0,0,0,0|1,0,1]=4 1580 B16R1.1045 C=C(F)CNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000042424 [0,2,0,0,0,0|1,0,1]=4 1581 B16R1.1045 CC(=O)Cc1cc(ccc1O)SCC(C)C 62a_100000210624_200010006938 [0,2,0,0,0,0|2,0,0]=4 1582 B16R1.1045 CC(=O)Cc1cc(ccc1O)SCC(C)C 62a_200010006938_100000210760 [0,2,0,0,0,0|2,0,0]=4 1583 B16R1.1045 CC(=O)Cc1cc(ccc1O)SCC(C)O 62a_100011218427_200010006938 [0,2,0,0,0,0|2,0,0]=4 1584 B16R1.1045 CC(=O)Cc1cc(ccc1O)SCC(C)O 62a_200010006938_100011218427 [0,2,0,0,0,0|2,0,0]=4 1585 B16R1.1045 CC(=O)Cc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_200010006938 [0,2,0,0,0,0|2,0,0]=4 1586 B16R1.1045 CC(=O)Cc1cc(ccc1O)SC[C@@H](C)O 62a_200010006938_100009817552 [0,2,0,0,0,0|2,0,0]=4 1587 B16R1.1045 CC(=O)Nc1cc(ccc1C)NCC(C)C 34a_100000740626_100000210624 [0,2,0,0,0,0|2,0,0]=4 1588 B16R1.1045 CC(=O)Nc1cc(ccc1C)NCC(C)C 7a_100000740626_100000210760 [0,2,0,0,0,0|2,0,0]=4 1589 B16R1.1045 CC(=O)Nc1cc(ccc1C)NCC(C)O 34a_100000740626_100011218427 [0,2,0,0,0,0|2,0,0]=4 1590 B16R1.1045 CC(=O)Nc1cc(ccc1C)NCC(C)O 7a_100000740626_100011218427 [0,2,0,0,0,0|2,0,0]=4 1591 B16R1.1045 CC(=O)Nc1cc(ccc1C)NC[C@@H](C)O 34a_100000740626_100009817552 [0,2,0,0,0,0|2,0,0]=4 1592 B16R1.1045 CC(=O)Nc1cc(ccc1C)NC[C@@H](C)O 7a_100000740626_100009817552 [0,2,0,0,0,0|2,0,0]=4 1593 B16R1.1045 CC(=O)Nc1cc(ccc1C)SCC(C)C 62a_100000210624_100011344836 [0,2,0,0,0,0|2,0,0]=4 1594 B16R1.1045 CC(=O)Nc1cc(ccc1C)SCC(C)O 62a_100011218427_100011344836 [0,2,0,0,0,0|2,0,0]=4 1595 B16R1.1045 CC(=O)Nc1cc(ccc1C)SC[C@@H](C)O 62a_100009817552_100011344836 [0,2,0,0,0,0|2,0,0]=4 1596 B16R1.1045 CC(=O)Nc1cc(ccc1Cl)NCC(C)C 34a_100000745429_100000210624 [0,2,0,0,0,0|2,0,0]=4 1597 B16R1.1045 CC(=O)Nc1cc(ccc1Cl)NCC(C)C 7a_100000745429_100000210760 [0,2,0,0,0,0|2,0,0]=4 1598 B16R1.1045 CC(=O)Nc1cc(ccc1Cl)NCC(C)O 34a_100000745429_100011218427 [0,2,0,0,0,0|2,0,0]=4 1599 B16R1.1045 CC(=O)Nc1cc(ccc1Cl)NCC(C)O 7a_100000745429_100011218427 [0,2,0,0,0,0|2,0,0]=4 1600 B16R1.1045 CC(=O)Nc1cc(ccc1Cl)NC[C@@H](C)O 34a_100000745429_100009817552 [0,2,0,0,0,0|2,0,0]=4 1601 B16R1.1045 CC(=O)Nc1cc(ccc1Cl)NC[C@@H](C)O 7a_100000745429_100009817552 [0,2,0,0,0,0|2,0,0]=4 1602 B16R1.1045 CC(=O)Nc1cc(ccc1F)NCC(C)C 34a_100000736141_100000210624 [0,2,0,0,0,0|2,0,0]=4 1603 B16R1.1045 CC(=O)Nc1cc(ccc1F)NCC(C)C 7a_100000736141_100000210760 [0,2,0,0,0,0|2,0,0]=4 1604 B16R1.1045 CC(=O)Nc1cc(ccc1F)NCC(C)O 34a_100000736141_100011218427 [0,2,0,0,0,0|2,0,0]=4 1605 B16R1.1045 CC(=O)Nc1cc(ccc1F)NCC(C)O 7a_100000736141_100011218427 [0,2,0,0,0,0|2,0,0]=4 1606 B16R1.1045 CC(=O)Nc1cc(ccc1F)NC[C@@H](C)O 34a_100000736141_100009817552 [0,2,0,0,0,0|2,0,0]=4 1607 B16R1.1045 CC(=O)Nc1cc(ccc1F)NC[C@@H](C)O 7a_100000736141_100009817552 [0,2,0,0,0,0|2,0,0]=4 1608 B16R1.1045 CC(=O)Nc1cc(ccc1F)SCC(C)C 62a_100000210624_200011951791 [0,2,0,0,0,0|2,0,0]=4 1609 B16R1.1045 CC(=O)Nc1cc(ccc1F)SCC(C)O 62a_100011218427_200011951791 [0,2,0,0,0,0|2,0,0]=4 1610 B16R1.1045 CC(=O)Nc1cc(ccc1F)SC[C@@H](C)O 62a_100009817552_200011951791 [0,2,0,0,0,0|2,0,0]=4 1611 B16R1.1045 CC(=O)Nc1cc(ccc1O)NCC(=O)N 34a_100000070259_100000187820 [0,2,0,0,0,0|2,0,0]=4 1612 B16R1.1045 CC(=O)Nc1cc(ccc1O)NCC(=O)N 7a_100000070259_100000187820 [0,2,0,0,0,0|2,0,0]=4 1613 B16R1.1045 CC(=O)Nc1cc(ccc1O)NCC(=O)[O-] 34a_100000070259_100020667443 [0,2,0,0,0,0|2,0,0]=4 1614 B16R1.1045 CC(=O)Nc1cc(ccc1O)NCC(C)C 34a_100000070259_100000210624 [0,2,0,0,0,0|1,0,0]=3 1615 B16R1.1045 CC(=O)Nc1cc(ccc1O)NCC(C)C 7a_100000070259_100000210760 [0,2,0,0,0,0|1,0,0]=3 1616 B16R1.1045 CC(=O)Nc1cc(ccc1O)NCC(C)O 34a_100000070259_100011218427 [0,2,0,0,0,0|1,0,0]=3 1617 B16R1.1045 CC(=O)Nc1cc(ccc1O)NCC(C)O 7a_100000070259_100011218427 [0,2,0,0,0,0|1,0,0]=3 1618 B16R1.1045 CC(=O)Nc1cc(ccc1O)NCC(F)F 34a_100000070259_100011934356 [0,2,0,0,0,0|2,0,0]=4 1619 B16R1.1045 CC(=O)Nc1cc(ccc1O)NCC(F)F 7a_100000070259_100011934356 [0,2,0,0,0,0|2,0,0]=4 1620 B16R1.1045 CC(=O)Nc1cc(ccc1O)NC[C@@H](C)O 34a_100000070259_100009817552 [0,2,0,0,0,0|1,0,0]=3 1621 B16R1.1045 CC(=O)Nc1cc(ccc1O)NC[C@@H](C)O 7a_100000070259_100009817552 [0,2,0,0,0,0|1,0,0]=3 1622 B16R1.1045 CC(=O)Nc1cc(ccc1O)NC[N+](=O)[O-] 34a_100000070259_100000761209 [0,2,0,0,0,0|2,0,0]=4 1623 B16R1.1432 C#CCCNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100000688953 [0,2,0,0,0,0|1,0,1]=4 1624 B16R1.1432 C#CCCNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000688953 [0,2,0,0,0,0|1,0,1]=4 1625 B16R1.1432 C/C=C/CNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_100102629194 [0,2,0,0,0,0|2,0,0]=4 1626 B16R1.1432 C/C=C/CNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_100102629194 [0,2,0,0,0,0|2,0,0]=4 1627 B16R1.1432 C/C=C/CNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_100102629194 [0,2,0,0,0,0|2,0,0]=4 1628 B16R1.1432 C/C=C/CNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_100102629194 [0,2,0,0,0,0|2,0,0]=4 1629 B16R1.1432 C/C=C/CNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_100102629194 [0,2,0,0,0,0|2,0,0]=4 1630 B16R1.1432 C/C=C/CNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_100102629194 [0,2,0,0,0,0|2,0,0]=4 1631 B16R1.1432 C/C=C/CNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100102629194 [0,2,0,0,0,0|1,0,0]=3 1632 B16R1.1432 C/C=C/CNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100102629194 [0,2,0,0,0,0|1,0,0]=3 1633 B16R1.1432 C/C=C/CSc1ccc(c(c1)CC(=O)C)O 62a_100102629194_200010006938 [0,2,0,0,0,0|2,0,0]=4 1634 B16R1.1432 C/C=C/CSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100102629194 [0,2,0,0,0,0|2,0,0]=4 1635 B16R1.1432 C/C=C/CSc1ccc(c(c1)NC(=O)C)C 62a_100102629194_100011344836 [0,2,0,0,0,0|2,0,0]=4 1636 B16R1.1432 C/C=C/CSc1ccc(c(c1)NC(=O)C)F 62a_100102629194_200011951791 [0,2,0,0,0,0|2,0,0]=4 1637 B16R1.1432 C=CCCNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100000754431 [0,2,0,0,0,0|1,0,1]=4 1638 B16R1.1432 C=CCCNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000754431 [0,2,0,0,0,0|1,0,1]=4 1639 B16R1.1432 CC#CCNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_100000748600 [0,2,0,0,0,0|2,0,0]=4 1640 B16R1.1432 CC#CCNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_100000748600 [0,2,0,0,0,0|2,0,0]=4 1641 B16R1.1432 CC#CCNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_100000748600 [0,2,0,0,0,0|2,0,0]=4 1642 B16R1.1432 CC#CCNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_100000748600 [0,2,0,0,0,0|2,0,0]=4 1643 B16R1.1432 CC#CCNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_100000748600 [0,2,0,0,0,0|2,0,0]=4 1644 B16R1.1432 CC#CCNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_100000748600 [0,2,0,0,0,0|2,0,0]=4 1645 B16R1.1432 CC#CCNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100000748600 [0,2,0,0,0,0|1,0,0]=3 1646 B16R1.1432 CC#CCNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000748600 [0,2,0,0,0,0|1,0,0]=3 1647 B16R1.1432 CC#CCSc1ccc(c(c1)CC(=O)C)O 62a_100000748600_200010006938 [0,2,0,0,0,0|2,0,0]=4 1648 B16R1.1432 CC#CCSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100000748600 [0,2,0,0,0,0|2,0,0]=4 1649 B16R1.1432 CC#CCSc1ccc(c(c1)NC(=O)C)C 62a_100000748600_100011344836 [0,2,0,0,0,0|2,0,0]=4 1650 B16R1.1432 CC#CCSc1ccc(c(c1)NC(=O)C)F 62a_100000748600_200011951791 [0,2,0,0,0,0|2,0,0]=4 1651 B16R1.1432 CC(=O)Cc1cc(ccc1O)SCCCF 62a_100011934791_200010006938 [0,2,0,0,0,0|2,0,0]=4 1652 B16R1.1432 CC(=O)Cc1cc(ccc1O)SCCCF 62a_200010006938_100011934791 [0,2,0,0,0,0|2,0,0]=4 1653 B16R1.1432 CC(=O)Cc1cc(ccc1O)SCCCO 62a_100011215043_200010006938 [0,2,0,0,0,0|2,0,0]=4 1654 B16R1.1432 CC(=O)Cc1cc(ccc1O)SCCCO 62a_200010006938_100011215043 [0,2,0,0,0,0|2,0,0]=4 1655 B16R1.1432 CC(=O)Nc1cc(ccc1C)NCCCF 34a_100000740626_100011934791 [0,2,0,0,0,0|2,0,0]=4 1656 B16R1.1432 CC(=O)Nc1cc(ccc1C)NCCCF 7a_100000740626_100011934791 [0,2,0,0,0,0|2,0,0]=4 1657 B16R1.1432 CC(=O)Nc1cc(ccc1C)NCCCO 34a_100000740626_100000230001 [0,2,0,0,0,0|2,0,0]=4 1658 B16R1.1432 CC(=O)Nc1cc(ccc1C)NCCCO 7a_100000740626_100011215043 [0,2,0,0,0,0|2,0,0]=4 1659 B16R1.1432 CC(=O)Nc1cc(ccc1C)SCCCF 62a_100011934791_100011344836 [0,2,0,0,0,0|2,0,0]=4 1660 B16R1.1432 CC(=O)Nc1cc(ccc1C)SCCCO 62a_100011215043_100011344836 [0,2,0,0,0,0|2,0,0]=4 1661 B16R1.1432 CC(=O)Nc1cc(ccc1Cl)NCCCF 34a_100000745429_100011934791 [0,2,0,0,0,0|2,0,0]=4 1662 B16R1.1432 CC(=O)Nc1cc(ccc1Cl)NCCCF 7a_100000745429_100011934791 [0,2,0,0,0,0|2,0,0]=4 1663 B16R1.1432 CC(=O)Nc1cc(ccc1Cl)NCCCO 34a_100000745429_100000230001 [0,2,0,0,0,0|2,0,0]=4 1664 B16R1.1432 CC(=O)Nc1cc(ccc1Cl)NCCCO 7a_100000745429_100011215043 [0,2,0,0,0,0|2,0,0]=4 1665 B16R1.1432 CC(=O)Nc1cc(ccc1F)NCCCF 34a_100000736141_100011934791 [0,2,0,0,0,0|2,0,0]=4 1666 B16R1.1432 CC(=O)Nc1cc(ccc1F)NCCCF 7a_100000736141_100011934791 [0,2,0,0,0,0|2,0,0]=4 1667 B16R1.1432 CC(=O)Nc1cc(ccc1F)NCCCO 34a_100000736141_100000230001 [0,2,0,0,0,0|2,0,0]=4 1668 B16R1.1432 CC(=O)Nc1cc(ccc1F)NCCCO 7a_100000736141_100011215043 [0,2,0,0,0,0|2,0,0]=4 1669 B16R1.1432 CC(=O)Nc1cc(ccc1F)SCCCF 62a_100011934791_200011951791 [0,2,0,0,0,0|2,0,0]=4 1670 B16R1.1432 CC(=O)Nc1cc(ccc1F)SCCCO 62a_100011215043_200011951791 [0,2,0,0,0,0|2,0,0]=4 1671 B16R1.1432 CC(=O)Nc1cc(ccc1O)NCCC#N 7a_100000070259_100000184422 [0,2,0,0,0,0|1,0,1]=4 1672 B16R1.1432 CC(=O)Nc1cc(ccc1O)NCCCF 34a_100000070259_100011934791 [0,2,0,0,0,0|1,0,0]=3 1673 B16R1.1432 CC(=O)Nc1cc(ccc1O)NCCCF 7a_100000070259_100011934791 [0,2,0,0,0,0|1,0,0]=3 1674 B16R1.1432 CC(=O)Nc1cc(ccc1O)NCCCO 34a_100000070259_100000230001 [0,2,0,0,0,0|1,0,0]=3 1675 B16R1.1432 CC(=O)Nc1cc(ccc1O)NCCCO 7a_100000070259_100011215043 [0,2,0,0,0,0|1,0,0]=3 1676 B16R1.1432 CC=CCNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_100000070051 [0,2,0,0,0,0|2,0,0]=4 1677 B16R1.1432 CC=CCNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_100000070051 [0,2,0,0,0,0|2,0,0]=4 1678 B16R1.1432 CC=CCNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_100000070051 [0,2,0,0,0,0|2,0,0]=4 1679 B16R1.1432 CC=CCNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_100000070051 [0,2,0,0,0,0|2,0,0]=4 1680 B16R1.1432 CC=CCNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_100000070051 [0,2,0,0,0,0|2,0,0]=4 1681 B16R1.1432 CC=CCNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_100000070051 [0,2,0,0,0,0|2,0,0]=4 1682 B16R1.1432 CC=CCNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100000070051 [0,2,0,0,0,0|1,0,0]=3 1683 B16R1.1432 CC=CCNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000070051 [0,2,0,0,0,0|1,0,0]=3 1684 B16R1.1432 CC=CCSc1ccc(c(c1)CC(=O)C)O 62a_100000070051_200010006938 [0,2,0,0,0,0|2,0,0]=4 1685 B16R1.1432 CC=CCSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100000070051 [0,2,0,0,0,0|2,0,0]=4 1686 B16R1.1432 CC=CCSc1ccc(c(c1)NC(=O)C)C 62a_100000070051_100011344836 [0,2,0,0,0,0|2,0,0]=4 1687 B16R1.1432 CC=CCSc1ccc(c(c1)NC(=O)C)F 62a_100000070051_200011951791 [0,2,0,0,0,0|2,0,0]=4 1688 B16R1.1432 CCCC=Cc1ccc(c(c1)CC(=O)C)O 271570a_100016258520_200010006938 [0,2,0,0,0,0|2,0,0]=4 1689 B16R1.1432 CCCC=Cc1ccc(c(c1)NC(=O)C)C 271570a_100016258520_100011344836 [0,2,0,0,0,0|2,0,0]=4 1690 B16R1.1432 CCCC=Cc1ccc(c(c1)NC(=O)C)F 271570a_100016258520_200011951791 [0,2,0,0,0,0|2,0,0]=4 1691 B16R1.1432 CCCCNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_100000210210 [0,2,0,0,0,0|2,0,0]=4 1692 B16R1.1432 CCCCNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_100000210211 [0,2,0,0,0,0|2,0,0]=4 1693 B16R1.1432 CCCCNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_100000210210 [0,2,0,0,0,0|2,0,0]=4 1694 B16R1.1432 CCCCNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_100000210211 [0,2,0,0,0,0|2,0,0]=4 1695 B16R1.1432 CCCCNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_100000210210 [0,2,0,0,0,0|2,0,0]=4 1696 B16R1.1432 CCCCNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_100000210211 [0,2,0,0,0,0|2,0,0]=4 1697 B16R1.1432 CCCCNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100000210210 [0,2,0,0,0,0|1,0,0]=3 1698 B16R1.1432 CCCCNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000210211 [0,2,0,0,0,0|1,0,0]=3 1699 B16R1.1432 CCCCSc1ccc(c(c1)CC(=O)C)O 62a_100000210211_200010006938 [0,2,0,0,0,0|2,0,0]=4 1700 B16R1.1432 CCCCSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100000210210 [0,2,0,0,0,0|2,0,0]=4 1701 B16R1.1432 CCCCSc1ccc(c(c1)NC(=O)C)C 62a_100000210211_100011344836 [0,2,0,0,0,0|2,0,0]=4 1702 B16R1.1432 CCCCSc1ccc(c(c1)NC(=O)C)F 62a_100000210211_200011951791 [0,2,0,0,0,0|2,0,0]=4 1703 B16R1.1432 CCOC=Cc1ccc(c(c1)CC(=O)C)O 271570a_100016256518_200010006938 [0,2,0,0,0,0|1,0,1]=4 1704 B16R1.1432 CCOC=Cc1ccc(c(c1)NC(=O)C)C 271570a_100016256518_100011344836 [0,2,0,0,0,0|1,0,1]=4 1705 B16R1.1432 CCOC=Cc1ccc(c(c1)NC(=O)C)F 271570a_100016256518_200011951791 [0,2,0,0,0,0|1,0,1]=4 1706 B16R1.1432 CCOCSc1ccc(c(c1)CC(=O)C)O 62a_100000739092_200010006938 [0,2,0,0,0,0|1,0,0]=3 1707 B16R1.1432 CCOCSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100000739092 [0,2,0,0,0,0|1,0,0]=3 1708 B16R1.1432 CCOCSc1ccc(c(c1)NC(=O)C)C 62a_100000739092_100011344836 [0,2,0,0,0,0|1,0,0]=3 1709 B16R1.1432 CCOCSc1ccc(c(c1)NC(=O)C)F 62a_100000739092_200011951791 [0,2,0,0,0,0|1,0,0]=3 1710 B16R1.1432 CCOCSc1ccc(c(c1)OC(=O)C)C 62a_100000739092_100103282185 [0,2,0,0,0,0|2,0,0]=4 1711 B16R1.1432 CCOCSc1ccc(c(c1)OC(=O)C)C 62a_100103282185_100000739092 [0,2,0,0,0,0|2,0,0]=4 1712 B16R1.1432 CCOCSc1cnc(c(c1)NC(=O)C)C 62a_100000739092_100010117071 [0,2,0,0,0,0|2,0,0]=4 1713 B16R1.1432 CCOCSc1cnc(c(c1)NC(=O)C)C 62a_100010117071_100000739092 [0,2,0,0,0,0|2,0,0]=4 1714 B16R1.1432 COCC=Cc1ccc(c(c1)CC(=O)C)O 271570a_100016286323_200010006938 [0,2,0,0,0,0|1,0,0]=3 1715 B16R1.1432 COCC=Cc1ccc(c(c1)NC(=O)C)C 271570a_100016286323_100011344836 [0,2,0,0,0,0|1,0,0]=3 1716 B16R1.1432 COCC=Cc1ccc(c(c1)NC(=O)C)F 271570a_100016286323_200011951791 [0,2,0,0,0,0|1,0,0]=3 1717 B16R1.1432 COCC=Cc1ccc(c(c1)OC(=O)C)C 271570a_100016286323_100103282185 [0,2,0,0,0,0|2,0,0]=4 1718 B16R1.1432 COCC=Cc1cnc(c(c1)NC(=O)C)C 271570a_100016286323_100010117071 [0,2,0,0,0,0|2,0,0]=4 1719 B16R1.1432 COCCNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_100011201679 [0,2,0,0,0,0|1,0,0]=3 1720 B16R1.1432 COCCNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_100000233755 [0,2,0,0,0,0|1,0,0]=3 1721 B16R1.1432 COCCNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_100011201679 [0,2,0,0,0,0|1,0,0]=3 1722 B16R1.1432 COCCNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_100000233755 [0,2,0,0,0,0|1,0,0]=3 1723 B16R1.1432 COCCNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_100011201679 [0,2,0,0,0,0|1,0,0]=3 1724 B16R1.1432 COCCNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_100000233755 [0,2,0,0,0,0|1,0,0]=3 1725 B16R1.1432 COCCNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100011201679 [0,2,0,0,0,0|0,0,0]=2 1726 B16R1.1432 COCCNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000233755 [0,2,0,0,0,0|0,0,0]=2 1727 B16R1.1432 COCCSc1ccc(c(c1)CC(=O)C)O 62a_100000233755_200010006938 [0,2,0,0,0,0|1,0,0]=3 1728 B16R1.1432 COCCSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100000233755 [0,2,0,0,0,0|1,0,0]=3 1729 B16R1.1432 COCCSc1ccc(c(c1)NC(=O)C)C 62a_100000233755_100011344836 [0,2,0,0,0,0|1,0,0]=3 1730 B16R1.1432 COCCSc1ccc(c(c1)NC(=O)C)F 62a_100000233755_200011951791 [0,2,0,0,0,0|1,0,0]=3 1731 B16R1.1432 COCCSc1ccc(c(c1)OC(=O)C)C 62a_100000233755_100103282185 [0,2,0,0,0,0|2,0,0]=4 1732 B16R1.1432 COCCSc1ccc(c(c1)OC(=O)C)C 62a_100103282185_100000233755 [0,2,0,0,0,0|2,0,0]=4 1733 B16R1.1432 COCCSc1cnc(c(c1)NC(=O)C)C 62a_100000233755_100010117071 [0,2,0,0,0,0|2,0,0]=4 1734 B16R1.1432 COCCSc1cnc(c(c1)NC(=O)C)C 62a_100010117071_100000233755 [0,2,0,0,0,0|2,0,0]=4 1735 B16R1.1432 CSCCNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_100000212216 [0,2,0,0,0,0|1,1,0]=4 1736 B16R1.1432 CSCCNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_100000212216 [0,2,0,0,0,0|1,1,0]=4 1737 B16R1.1432 CSCCNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_100000212216 [0,2,0,0,0,0|1,1,0]=4 1738 B16R1.1432 CSCCNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_100000212216 [0,2,0,0,0,0|1,1,0]=4 1739 B16R1.1432 CSCCNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_100000212216 [0,2,0,0,0,0|1,1,0]=4 1740 B16R1.1432 CSCCNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_100000212216 [0,2,0,0,0,0|1,1,0]=4 1741 B16R1.1432 CSCCNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100000212216 [0,2,0,0,0,0|0,1,0]=3 1742 B16R1.1432 CSCCNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000212216 [0,2,0,0,0,0|0,1,0]=3 1743 B16R1.1432 CSCCSc1ccc(c(c1)CC(=O)C)O 62a_100000212216_200010006938 [0,2,0,0,0,0|1,1,0]=4 1744 B16R1.1432 CSCCSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100000751147 [0,2,0,0,0,0|1,1,0]=4 1745 B16R1.1432 CSCCSc1ccc(c(c1)NC(=O)C)C 62a_100000212216_100011344836 [0,2,0,0,0,0|1,1,0]=4 1746 B16R1.1432 CSCCSc1ccc(c(c1)NC(=O)C)F 62a_100000212216_200011951791 [0,2,0,0,0,0|1,1,0]=4 1747 B16R1.7367 CCCCc1cc(c(cc1F)F)NC(=O)C 271570a_100020621405_200013902858 [0,2,0,0,0,0|2,0,0]=4 1748 B16R1.7367 CCCOc1cc(c(cc1Br)F)NC(=O)C 11a_100021428089_100015343762 [0,2,0,0,0,0|2,0,0]=4 1749 B16R1.7367 CCCOc1cc(c(cc1Br)F)NC(=O)C 1626a_100021428089_100015343762 [0,2,0,0,0,0|2,0,0]=4 1750 B16R1.7367 CCCOc1cc(c(cc1Br)F)NC(=O)C 22a_100021428089_100000070787 [0,2,0,0,0,0|2,0,0]=4 1751 B16R1.7367 CCCOc1cc(c(cc1Br)F)NC(=O)C 527a_100021428089_100103153847 [0,2,0,0,0,0|2,0,0]=4 1752 B16R1.7367 CCCOc1cc(c(cc1Cl)Cl)NC(=O)C 34a_200000039401_100000210303 [0,2,0,0,0,0|2,0,0]=4 1753 B16R1.7367 CCCOc1cc(c(cc1Cl)Cl)NC(=O)C 7a_200000039401_100000210303 [0,2,0,0,0,0|2,0,0]=4 1754 B16R1.7367 CCCSc1cc(c(cc1F)F)NC(=O)C 62a_100000210303_200013902858 [0,2,0,0,0,0|2,0,0]=4 1755 B16R1.7367 CCCSc1cc(c(cc1F)F)NC(=O)C 62a_200013902858_100000210303 [0,2,0,0,0,0|2,0,0]=4 1756 B16R1.7367 COCSc1cc(c(cc1F)F)NC(=O)C 62a_100000766300_200013902858 [0,2,0,0,0,0|1,0,0]=3 1757 B16R1.7367 COCSc1cc(c(cc1F)F)NC(=O)C 62a_200013902858_100000766300 [0,2,0,0,0,0|1,0,0]=3 1758 B16R1.7367 CSCOc1cc(c(cc1Cl)Cl)NC(=O)C 34a_200000039401_100011218213 [0,2,0,0,0,0|1,1,0]=4 1759 B16R1.7367 CSCSc1cc(c(cc1F)F)NC(=O)C 62a_100011218213_200013902858 [0,2,0,0,0,0|1,1,0]=4 1760 B16R1.7367 CSCSc1cc(c(cc1F)F)NC(=O)C 62a_200013902858_100011218213 [0,2,0,0,0,0|1,1,0]=4 1761 B16R1.17978 C#CCNc1ccc(c(c1)NC(=O)C)OC 34a_100000736378_100000184674 [0,2,0,0,0,0|1,0,1]=4 1762 B16R1.17978 C#CCNc1ccc(c(c1)NC(=O)C)OC 7a_100000736378_100000038162 [0,2,0,0,0,0|1,0,1]=4 1763 B16R1.17978 C#CCSc1ccc(c(c1)NC(=O)C)OC 62a_100000038162_200011407902 [0,2,0,0,0,0|1,0,1]=4 1764 B16R1.17978 C=CCNc1ccc(c(c1)NC(=O)C)OC 34a_100000736378_100015514636 [0,2,0,0,0,0|1,0,1]=4 1765 B16R1.17978 C=CCNc1ccc(c(c1)NC(=O)C)OC 7a_100000736378_100015514636 [0,2,0,0,0,0|1,0,1]=4 1766 B16R1.17978 C=CCSc1ccc(c(c1)NC(=O)C)OC 62a_100000210623_200011407902 [0,2,0,0,0,0|1,0,1]=4 1767 B16R1.17978 CCCCc1ccc(c(c1)CC(=O)C)OC 271570a_100020621405_200011493461 [0,2,0,0,0,0|2,0,0]=4 1768 B16R1.17978 CCCCc1ccc(c(c1)NC(=O)C)OC 271570a_100020621405_200011407902 [0,2,0,0,0,0|1,0,0]=3 1769 B16R1.17978 CCCCc1ccc(c(c1)OC(=O)C)OC 271570a_100020621405_200011016479 [0,2,0,0,0,0|2,0,0]=4 1770 B16R1.17978 CCCNc1ccc(c(c1)NC(=O)C)OC 34a_100000736378_100000210303 [0,2,0,0,0,0|1,0,0]=3 1771 B16R1.17978 CCCNc1ccc(c(c1)NC(=O)C)OC 7a_100000736378_100000210303 [0,2,0,0,0,0|1,0,0]=3 1772 B16R1.17978 CCCSc1ccc(c(c1)CC(=O)C)OC 62a_200011493461_100000210303 [0,2,0,0,0,0|2,0,0]=4 1773 B16R1.17978 CCCSc1ccc(c(c1)NC(=O)C)OC 62a_100000210303_200011407902 [0,2,0,0,0,0|1,0,0]=3 1774 B16R1.17978 CCNCc1ccc(c(c1)OC(=O)C)OC 207a_100015525214_100000014717 [0,2,0,0,0,0|2,0,0]=4 1775 B16R1.17978 CCNCc1ccc(c(c1)OC(=O)C)OC 270004a_100015525214_100000014717 [0,2,0,0,0,0|2,0,0]=4 1776 B16R1.17978 COCOc1ccc(c(c1)C=C(C)C)OC 271570a_100102525489_200161107199 [0,2,0,0,0,0|2,0,0]=4 1777 B16R1.17978 COCSc1ccc(c(c1)CC(=O)C)OC 62a_200011493461_100000766300 [0,2,0,0,0,0|1,0,0]=3 1778 B16R1.17978 COCSc1ccc(c(c1)NC(=O)C)OC 62a_100000766300_200011407902 [0,2,0,0,0,0|0,0,0]=2 1779 B16R1.17978 COc1ccc(cc1CC(=O)C)SCSC 62a_200011493461_100011218213 [0,2,0,0,0,0|1,1,0]=4 1780 B16R1.17978 COc1ccc(cc1NC(=O)C)NCC#N 7a_100000736378_100011215382 [0,2,0,0,0,0|2,0,0]=4 1781 B16R1.17978 COc1ccc(cc1NC(=O)C)NCC=O 34a_100000736378_200009817547 [0,2,0,0,0,0|2,0,0]=4 1782 B16R1.17978 COc1ccc(cc1NC(=O)C)NCC=O 7a_100000736378_200015260668 [0,2,0,0,0,0|2,0,0]=4 1783 B16R1.17978 COc1ccc(cc1NC(=O)C)NCCF 34a_100000736378_100011217306 [0,2,0,0,0,0|2,0,0]=4 1784 B16R1.17978 COc1ccc(cc1NC(=O)C)NCCF 7a_100000736378_100011217306 [0,2,0,0,0,0|2,0,0]=4 1785 B16R1.17978 COc1ccc(cc1NC(=O)C)NCCO 34a_100000736378_100000211926 [0,2,0,0,0,0|2,0,0]=4 1786 B16R1.17978 COc1ccc(cc1NC(=O)C)NCCO 7a_100000736378_100000211926 [0,2,0,0,0,0|2,0,0]=4 1787 B16R1.17978 COc1ccc(cc1NC(=O)C)NCSC 34a_100000736378_100011218213 [0,2,0,0,0,0|0,1,0]=3 1788 B16R1.17978 COc1ccc(cc1NC(=O)C)SCC#N 62a_100011215382_200011407902 [0,2,0,0,0,0|2,0,0]=4 1789 B16R1.17978 COc1ccc(cc1NC(=O)C)SCC=O 62a_200015260668_200011407902 [0,2,0,0,0,0|2,0,0]=4 1790 B16R1.17978 COc1ccc(cc1NC(=O)C)SCCF 62a_100011217306_200011407902 [0,2,0,0,0,0|2,0,0]=4 1791 B16R1.17978 COc1ccc(cc1NC(=O)C)SCCO 62a_100000211926_200011407902 [0,2,0,0,0,0|2,0,0]=4 1792 B16R1.17978 COc1ccc(cc1NC(=O)C)SCSC 62a_100011218213_200011407902 [0,2,0,0,0,0|0,1,0]=3 1793 B16R1.17979 CCC(=O)Nc1cc(ccc1C)NCSC 34a_200011193571_100011218213 [0,2,0,0,0,0|1,1,0]=4 1794 B16R1.17979 CCCCc1ccc(c(c1)CC(=O)OC)O 271570a_100020621405_100010185610 [0,2,0,0,0,0|2,0,0]=4 1795 B16R1.17979 CCCNc1ccc(c(c1)NC(=O)CC)C 34a_200011193571_100000210303 [0,2,0,0,0,0|2,0,0]=4 1796 B16R1.17979 CCCNc1ccc(c(c1)NC(=O)CC)C 7a_200011193571_100000210303 [0,2,0,0,0,0|2,0,0]=4 1797 B16R1.17979 CCCSc1ccc(c(c1)CC(=O)OC)O 62a_100000210303_100010185610 [0,2,0,0,0,0|2,0,0]=4 1798 B16R1.17979 CCCSc1ccc(c(c1)CC(=O)OC)O 62a_100010185610_100000210303 [0,2,0,0,0,0|2,0,0]=4 1799 B16R1.17979 COC(=O)Cc1cc(ccc1O)SCSC 62a_100010185610_100011218213 [0,2,0,0,0,0|1,1,0]=4 1800 B16R1.17979 COC(=O)Cc1cc(ccc1O)SCSC 62a_100011218213_100010185610 [0,2,0,0,0,0|1,1,0]=4 1801 B16R1.17979 COCSc1ccc(c(c1)CC(=O)OC)O 62a_100000766300_100010185610 [0,2,0,0,0,0|1,0,0]=3 1802 B16R1.17979 COCSc1ccc(c(c1)CC(=O)OC)O 62a_100010185610_100000766300 [0,2,0,0,0,0|1,0,0]=3 1803 B16R1.39546 CCCNc1ccc(c(c1F)NC(=O)C)F 34a_100009824841_100000210303 [0,2,0,0,0,0|2,0,0]=4 1804 B16R1.39546 COCOc1ccc(c(c1C)NC(=O)C)C 11a_100154351052_100015343762 [0,2,0,0,0,0|1,0,0]=3 1805 B16R1.39546 COCOc1ccc(c(c1C)NC(=O)C)C 1626a_100154351052_100015343762 [0,2,0,0,0,0|1,0,0]=3 1806 B16R1.39546 COCOc1ccc(c(c1C)NC(=O)C)C 22a_100154351052_100000070787 [0,2,0,0,0,0|1,0,0]=3 1807 B16R1.39546 COCOc1ccc(c(c1C)NC(=O)C)C 527a_100154351052_100103153847 [0,2,0,0,0,0|1,0,0]=3 1808 B16R1.39546 CSCNc1ccc(c(c1F)NC(=O)C)F 34a_100009824841_100011218213 [0,2,0,0,0,0|1,1,0]=4 1809 B16R1.13520 CCS(=O)(=O)Nc1cc(ccc1Br)COC 232682a_200013033220_100000211323 [0,2,0,0,0,0|2,0,0]=4 1810 B16R1.13478 CCOc1ccc(c(c1)NC(=O)C)OCC 11a_100000211849_100015343762 [0,2,0,0,0,0|2,0,0]=4 1811 B16R1.13478 CCOc1ccc(c(c1)NC(=O)C)OCC 1626a_100000211849_100015343762 [0,2,0,0,0,0|2,0,0]=4 1812 B16R1.13478 CCOc1ccc(c(c1)NC(=O)C)OCC 22a_100000211849_100000070787 [0,2,0,0,0,0|2,0,0]=4 1813 B16R1.13476 C#CCC(=O)Nc1cc(ccc1Br)COC 1626a_200013033220_100011220946 [0,2,0,0,0,0|1,0,0]=3 1814 B16R1.13476 C=CCC(=O)Nc1cc(ccc1Br)COC 11a_200013033220_100000210193 [0,2,0,0,0,0|1,0,0]=3 1815 B16R1.13476 C=CCC(=O)Nc1cc(ccc1Br)COC 1626a_200013033220_100000210193 [0,2,0,0,0,0|1,0,0]=3 1816 B16R1.13476 CC=CC(=O)Nc1cc(ccc1Br)COC 11a_200013033220_100000210699 [0,2,0,0,0,0|1,0,0]=3 1817 B16R1.13476 CC=CC(=O)Nc1cc(ccc1Br)COC 1626a_200013033220_100000210699 [0,2,0,0,0,0|1,0,0]=3 1818 B16R1.13476 CCCC(=O)Nc1cc(ccc1Br)COC 11a_200013033220_100000211992 [0,2,0,0,0,0|1,0,0]=3 1819 B16R1.13476 CCCC(=O)Nc1cc(ccc1Br)COC 1626a_200013033220_100000211992 [0,2,0,0,0,0|1,0,0]=3 1820 B16R1.13476 CCNC(=O)Nc1cc(ccc1Br)COC 2430a_200013033220_100015525214 [0,2,0,0,0,0|1,0,0]=3 1821 B16R1.13476 COCC(=O)Nc1cc(ccc1Br)COC 11a_200013033220_100000210968 [0,2,0,0,0,0|1,0,0]=3 1822 B16R1.13476 COCC(=O)Nc1cc(ccc1Br)COC 1626a_200013033220_100000210968 [0,2,0,0,0,0|1,0,0]=3 1823 B16R1.13476 COCc1ccc(c(c1)NC(=O)C=CBr)Br 1626a_200013033220_100016273825 [0,2,0,0,0,0|1,0,1]=4 1824 B16R1.13476 COCc1ccc(c(c1)NC(=O)C=CCl)Br 11a_200013033220_200016279998 [0,2,0,0,0,0|1,0,1]=4 1825 B16R1.13476 COCc1ccc(c(c1)NC(=O)C=CCl)Br 1626a_200013033220_200016279998 [0,2,0,0,0,0|1,0,1]=4 1826 B16R1.13476 COCc1ccc(c(c1)NC(=O)C=CI)Br 1626a_200013033220_100016256311 [0,2,0,0,0,0|1,0,1]=4 1827 B16R1.13476 COCc1ccc(c(c1)NC(=O)CC#N)Br 1626a_200013033220_100051588842 [0,2,0,0,0,0|1,0,0]=3 1828 B16R1.13476 COCc1ccc(c(c1)NC(=O)CSC)Br 11a_200013033220_100000184570 [0,2,0,0,0,0|1,0,0]=3 1829 B16R1.13476 COCc1ccc(c(c1)NC(=O)CSC)Br 1626a_200013033220_100000184570 [0,2,0,0,0,0|1,0,0]=3 1830 B14R1.142 COCc1ccc(cc1)CNC(=O)C 11a_100000738208_100015343762 [0,0,1,1,0,0|1,0,1]=4 1831 B14R1.142 COCc1ccc(cc1)CNC(=O)C 1626a_100000738208_100015343762 [0,0,1,1,0,0|1,0,1]=4 1832 B14R1.142 COCc1ccc(cc1)CNC(=O)C 240690a_100000738208_100015343762 [0,0,1,1,0,0|1,0,1]=4 1833 B14R1.142 COCc1ccc(cc1)CNC(=O)C 527a_100000738208_100103153847 [0,0,1,1,0,0|1,0,1]=4 1834 B14R2.134 C=Cc1ccc2c(c1)NC(=O)CO2 271570a_100011290941_100000244627 [1,0,0,1,0,0|0,0,2]=4 1835 B14R2.134 CNc1ccc2c(c1)NC(=O)CC2 2230a_100000055022_200000210301 [1,0,0,1,0,0|2,0,0]=4 1836 B14R2.134 CNc1ccc2c(c1)NC(=O)CC2 34a_100000055022_200000210301 [1,0,0,1,0,0|2,0,0]=4 1837 B14R2.134 CNc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_200000210301 [1,0,0,1,0,0|1,0,0]=3 1838 B14R2.134 COc1ccc2c(c1)CC(=O)CC2 34a_200000081095_200000210301 [1,0,0,1,0,0|2,0,0]=4 1839 B14R2.134 COc1ccc2c(c1)CC(=O)CC2 7a_200000081095_200000210301 [1,0,0,1,0,0|2,0,0]=4 1840 B14R2.134 COc1ccc2c(c1)NC(=O)CC2 34a_100000708604_200000210301 [1,0,0,1,0,0|1,0,0]=3 1841 B14R2.134 COc1ccc2c(c1)NC(=O)CO2 34a_100009876821_200000210301 [1,0,0,1,0,0|0,0,0]=2 1842 B14R2.134 COc1ccc2c(c1)OC(=O)CC2 7a_100000044819_200000210301 [1,0,0,1,0,0|2,0,0]=4 1843 B14R2.134 CSc1ccc2c(c1)NC(=O)CC2 62a_100000763451_200000210301 [1,0,0,1,0,0|1,1,0]=4 1844 B14R2.134 CSc1ccc2c(c1)NC(=O)CC2 62a_200000210301_100000763451 [1,0,0,1,0,0|1,1,0]=4 1845 B14R2.134 CSc1cnc2c(c1)NC(=O)CO2 62a_200000210301_100000699640 [1,0,0,1,0,0|1,1,0]=4 1846 B14R2.134 [13CH3]Nc1ccc2c(c1)NC(=O)CC2 2230a_100000055022_200025704644 [1,0,0,1,0,0|2,0,0]=4 1847 B14R2.134 [13CH3]Nc1ccc2c(c1)NC(=O)CC2 34a_100000055022_200025704644 [1,0,0,1,0,0|2,0,0]=4 1848 B14R2.134 [13CH3]Nc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_200025704644 [1,0,0,1,0,0|1,0,0]=3 1849 B14R2.134 [13CH3]Oc1ccc2c(c1)CC(=O)CC2 34a_200000081095_200025704644 [1,0,0,1,0,0|2,0,0]=4 1850 B14R2.134 [13CH3]Oc1ccc2c(c1)CC(=O)CC2 7a_200000081095_200025704644 [1,0,0,1,0,0|2,0,0]=4 1851 B14R2.134 [13CH3]Oc1ccc2c(c1)NC(=O)CC2 34a_100000708604_200025704644 [1,0,0,1,0,0|1,0,0]=3 1852 B14R2.134 [13CH3]Oc1ccc2c(c1)NC(=O)CO2 34a_100009876821_200025704644 [1,0,0,1,0,0|0,0,0]=2 1853 B14R2.134 [13CH3]Oc1ccc2c(c1)OC(=O)CC2 7a_100000044819_200025704644 [1,0,0,1,0,0|2,0,0]=4 1854 B14R2.134 [13CH3]Sc1ccc2c(c1)NC(=O)CC2 62a_100000763451_200025704644 [1,0,0,1,0,0|1,1,0]=4 1855 B14R2.134 [13CH3]Sc1ccc2c(c1)NC(=O)CC2 62a_200025704644_100000763451 [1,0,0,1,0,0|1,1,0]=4 1856 B14R2.134 [13CH3]Sc1cnc2c(c1)NC(=O)CO2 62a_200025704644_100000699640 [1,0,0,1,0,0|1,1,0]=4 1857 B14R2.161 CCc1ccc(c(c1)NC2CC2)O 34a_100000765835_100000211595 [1,0,0,1,0,0|1,0,1]=4 1858 B14R2.161 COc1ccc(c(c1)NC2CC2)O 34a_100000188146_100000211595 [1,0,0,1,0,0|1,0,1]=4 1859 B14R2.161 OCc1ccc(c(c1)NC2CC2)O 34a_100000123545_100000211595 [1,0,0,1,0,0|1,0,1]=4 1860 B14R2.1726 CSc1ccc(c2c1CC(=O)N2)F 62a_200000210301_100012355367 [1,0,0,1,0,0|1,1,0]=4 1861 B14R2.1726 [13CH3]Sc1ccc(c2c1CC(=O)N2)F 62a_200025704644_100012355367 [1,0,0,1,0,0|1,1,0]=4 1862 B14R2.535 CC=Cc1cccc2c1CC(=O)N2 271570a_100016259895_100009816812 [1,0,0,1,0,0|1,0,1]=4 1863 B14R2.535 CCSc1cccc2c1CC(=O)N2 62a_100000210202_100009816812 [1,0,0,1,0,0|2,0,0]=4 1864 B14R2.1007 CC(=O)Cc1cccc(c1)C2CC2 271570a_100011220607_100000689217 [1,0,0,1,0,0|2,0,0]=4 1865 B14R2.1007 CC(=O)Nc1cc(ccn1)C2CC2 271570a_100011220607_100012362434 [1,0,0,1,0,0|2,0,0]=4 1866 B14R2.1007 CC(=O)Nc1cccc(c1)C2CC2 11a_100025755985_100015343762 [1,0,0,1,0,0|1,0,0]=3 1867 B14R2.1007 CC(=O)Nc1cccc(c1)C2CC2 1626a_100025755985_100015343762 [1,0,0,1,0,0|1,0,0]=3 1868 B14R2.1007 CC(=O)Nc1cccc(c1)C2CC2 22a_100025755985_100000070787 [1,0,0,1,0,0|1,0,0]=3 1869 B14R2.1007 CC(=O)Nc1cccc(c1)C2CC2 271570a_100011220607_100000153616 [1,0,0,1,0,0|1,0,0]=3 1870 B14R2.1007 CC(=O)Nc1cccc(c1)C2CC2 527a_100025755985_100103153847 [1,0,0,1,0,0|1,0,0]=3 1871 B14R2.1007 CC(=O)Nc1cccc(n1)C2CC2 271570a_100011220607_200011307899 [1,0,0,1,0,0|2,0,0]=4 1872 B14R2.1007 CC(=O)Nc1ccnc(c1)C2CC2 271570a_100011220607_100000238608 [1,0,0,1,0,0|2,0,0]=4 1873 B14R2.1007 CC(=O)Nc1cncc(c1)C2CC2 271570a_100011220607_100012351681 [1,0,0,1,0,0|2,0,0]=4 1874 B14R2.1007 CC(=O)Oc1cccc(c1)C2CC2 271570a_100011220607_100009811612 [1,0,0,1,0,0|2,0,0]=4 1875 B14R2.1007 NC(=O)Nc1cccc(c1)C2CC2 271570a_100011220607_100000238923 [1,0,0,1,0,0|2,0,0]=4 1876 B14R2.1008 CC(=Cc1ccc2c(c1)COC2)C 271570a_100102525489_100000698232 [1,0,0,1,0,0|2,0,0]=4 1877 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCC2 11a_100000211504_100015343762 [1,0,0,1,0,0|1,0,0]=3 1878 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100015343762 [1,0,0,1,0,0|1,0,0]=3 1879 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000070787 [1,0,0,1,0,0|1,0,0]=3 1880 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCC2 527a_100000211504_100103153847 [1,0,0,1,0,0|1,0,0]=3 1881 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 11a_100000736984_100015343762 [1,0,0,1,0,0|2,0,0]=4 1882 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 1626a_100000736984_100015343762 [1,0,0,1,0,0|2,0,0]=4 1883 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 22a_100000736984_100000070787 [1,0,0,1,0,0|2,0,0]=4 1884 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 527a_100000736984_100103153847 [1,0,0,1,0,0|2,0,0]=4 1885 B14R2.1008 CC(=O)Nc1ccc2c(c1)COC2 11a_100011728444_100015343762 [1,0,0,1,0,0|0,0,0]=2 1886 B14R2.1008 CC(=O)Nc1ccc2c(c1)COC2 1626a_100011728444_100015343762 [1,0,0,1,0,0|0,0,0]=2 1887 B14R2.1008 CC(=O)Nc1ccc2c(c1)COC2 22a_100011728444_100000070787 [1,0,0,1,0,0|0,0,0]=2 1888 B14R2.1008 CC(=O)Nc1ccc2c(c1)COC2 527a_100011728444_100103153847 [1,0,0,1,0,0|0,0,0]=2 1889 B14R2.1008 CC(C)Nc1ccc2c(c1)COC2 2230a_100011728444_100000210206 [1,0,0,1,0,0|1,0,1]=4 1890 B14R2.1008 CC(C)Nc1ccc2c(c1)COC2 34a_100011728444_100000210206 [1,0,0,1,0,0|1,0,1]=4 1891 B14R2.6400 CC=Cc1ccc2c(c1)NC(=O)C2 271570a_100016259895_100000760487 [1,0,0,1,0,0|1,0,1]=4 1892 B14R2.6400 CCSc1ccc2c(c1)NC(=O)C2 62a_100000210202_100000760487 [1,0,0,1,0,0|2,0,0]=4 1893 B14R2.6400 CNCc1ccc2[nH]c(=O)[nH]c2c1 207a_100102657272_100000709728 [1,0,0,1,0,0|2,0,0]=4 1894 B14R2.6400 CNCc1ccc2[nH]c(=O)[nH]c2c1 2230a_100000697230_200000210301 [1,0,0,1,0,0|2,0,0]=4 1895 B14R2.6400 CNCc1ccc2[nH]c(=O)[nH]c2c1 270004a_106832991635_100000709728 [1,0,0,1,0,0|2,0,0]=4 1896 B14R2.6400 COCc1ccc2nc(oc2c1)C 34a_100010326561_200000210301 [1,0,0,1,0,0|2,0,0]=4 1897 B14R2.6400 COCc1ccc2nc(oc2c1)C 7a_100010326561_200000210301 [1,0,0,1,0,0|2,0,0]=4 1898 B14R2.6400 COCc1ccc2oc(nc2c1)C 34a_200009878806_200000210301 [1,0,0,1,0,0|0,0,2]=4 1899 B14R2.6400 COCc1ccc2oc(nc2c1)C 7a_200009878806_200000210301 [1,0,0,1,0,0|0,0,2]=4 1900 B14R2.6400 Cc1nc2cc(ccc2o1)CO[13CH3] 34a_200009878806_200025704644 [1,0,0,1,0,0|0,0,2]=4 1901 B14R2.6400 Cc1nc2cc(ccc2o1)CO[13CH3] 7a_200009878806_200025704644 [1,0,0,1,0,0|0,0,2]=4 1902 B14R2.6400 Cc1nc2ccc(cc2o1)CO[13CH3] 34a_100010326561_200025704644 [1,0,0,1,0,0|2,0,0]=4 1903 B14R2.6400 Cc1nc2ccc(cc2o1)CO[13CH3] 7a_100010326561_200025704644 [1,0,0,1,0,0|2,0,0]=4 1904 B14R2.6400 [13CH3]NCc1ccc2[nH]c(=O)[nH]c2c1 2230a_100000697230_200025704644 [1,0,0,1,0,0|2,0,0]=4 1905 B14R2.9440 CC(=Cc1cccc2c1COC2)C 271570a_100102525489_100010384907 [1,0,0,1,0,0|2,0,0]=4 1906 B14R2.9440 CC(=O)Nc1cccc2c1CCC2 11a_100000043548_100015343762 [1,0,0,1,0,0|1,0,0]=3 1907 B14R2.9440 CC(=O)Nc1cccc2c1CCC2 1626a_100000043548_100015343762 [1,0,0,1,0,0|1,0,0]=3 1908 B14R2.9440 CC(=O)Nc1cccc2c1CCC2 22a_100000043548_100000070787 [1,0,0,1,0,0|1,0,0]=3 1909 B14R2.9440 CC(=O)Nc1cccc2c1CCC2 527a_100000043548_100103153847 [1,0,0,1,0,0|1,0,0]=3 1910 B14R2.9440 CC(=O)Nc1cccc2c1CCO2 11a_100000084147_100015343762 [1,0,0,1,0,0|2,0,0]=4 1911 B14R2.9440 CC(=O)Nc1cccc2c1CCO2 1626a_100000084147_100015343762 [1,0,0,1,0,0|2,0,0]=4 1912 B14R2.9440 CC(=O)Nc1cccc2c1CCO2 22a_100000084147_100000070787 [1,0,0,1,0,0|2,0,0]=4 1913 B14R2.9440 CC(=O)Nc1cccc2c1CCO2 527a_100000084147_100103153847 [1,0,0,1,0,0|2,0,0]=4 1914 B14R2.9440 CC(=O)Nc1cccc2c1COC2 11a_100000125316_100015343762 [1,0,0,1,0,0|0,0,0]=2 1915 B14R2.9440 CC(=O)Nc1cccc2c1COC2 1626a_100000125316_100015343762 [1,0,0,1,0,0|0,0,0]=2 1916 B14R2.9440 CC(=O)Nc1cccc2c1COC2 22a_100000125316_100000070787 [1,0,0,1,0,0|0,0,0]=2 1917 B14R2.9440 CC(=O)Nc1cccc2c1COC2 527a_100000125316_100103153847 [1,0,0,1,0,0|0,0,0]=2 1918 B14R2.9440 CC(=O)Nc1cccc2c1OCC2 11a_100000102157_100015343762 [1,0,0,1,0,0|2,0,0]=4 1919 B14R2.9440 CC(=O)Nc1cccc2c1OCC2 1626a_100000102157_100015343762 [1,0,0,1,0,0|2,0,0]=4 1920 B14R2.9440 CC(=O)Nc1cccc2c1OCC2 22a_100000102157_100000070787 [1,0,0,1,0,0|2,0,0]=4 1921 B14R2.9440 CC(=O)Nc1cccc2c1OCC2 527a_100000102157_100103153847 [1,0,0,1,0,0|2,0,0]=4 1922 B14R2.9440 CC(=O)Nc1cccc2c1non2 11a_100000028140_100015343762 [1,0,0,1,0,0|2,0,0]=4 1923 B14R2.9440 CC(=O)Nc1cccc2c1non2 1626a_100000028140_100015343762 [1,0,0,1,0,0|2,0,0]=4 1924 B14R2.9440 CC(C)Nc1cccc2c1COC2 2230a_100000125316_100000210206 [1,0,0,1,0,0|1,0,1]=4 1925 B14R2.9440 CC(C)Nc1cccc2c1COC2 34a_100000125316_100000210206 [1,0,0,1,0,0|1,0,1]=4 1926 B14R2.9671 COCc1cccc(c1)NC2CC2 34a_100000737370_100000211595 [1,0,0,1,0,0|1,0,1]=4 1927 B14R2.112 COCc1ccc2c(c1)OCCO2 34a_100000745213_200000210301 [1,0,0,1,0,0|1,0,1]=4 1928 B14R2.112 [13CH3]OCc1ccc2c(c1)OCCO2 34a_100000745213_200025704644 [1,0,0,1,0,0|1,0,1]=4 1929 B14R2.583 CC=Cc1cc2c(cc1O)CCC2 271570a_100016259895_200010659162 [1,0,0,1,0,0|2,0,0]=4 1930 B14R2.9645 CC=Cc1cc(ccc1O)C2CC2 271570a_100016259895_100135415898 [1,0,0,1,0,0|2,0,0]=4 1931 B14R2.475 CC=Cc1ccc2c(c1)C(=O)CO2 271570a_100016259895_100000752586 [0,0,0,1,1,0|1,0,1]=4 1932 B14R2.475 CCSc1ccc2c(c1)C(=O)CO2 62a_100000210202_100000752586 [0,0,0,1,1,0|2,0,0]=4 1933 B14R2.624 C=C(C)c1cc2c(cc1O)CCC2 271570a_100000694244_200010659162 [0,0,0,1,1,0|2,0,0]=4 1934 B14R2.945 C=C(C)c1cc(ccc1O)C2CC2 271570a_100000694244_100135415898 [0,0,0,1,1,0|2,0,0]=4 1935 B14R2.945 CC(=O)c1cc(ccc1C)C2CC2 271570a_100011220607_100012706819 [0,0,0,1,1,0|2,0,0]=4 1936 B14R2.945 CC(=O)c1cc(ccc1Cl)C2CC2 271570a_100011220607_100010712560 [0,0,0,1,1,0|2,0,0]=4 1937 B14R2.945 CC(=O)c1cc(ccc1F)C2CC2 271570a_100011220607_100000689017 [0,0,0,1,1,0|2,0,0]=4 1938 B14R2.945 CC(=O)c1cc(ccc1N)C2CC2 271570a_100011220607_100000695420 [0,0,0,1,1,0|2,0,0]=4 1939 B14R2.945 CC(=O)c1cc(ccc1O)C2CC2 271570a_100011220607_100000212127 [0,0,0,1,1,0|1,0,0]=3 1940 B14R2.945 NC(=O)c1cc(ccc1O)C2CC2 271570a_100011220607_100000192807 [0,0,0,1,1,0|2,0,0]=4 1941 B16R2.11975 CC(=Cc1ccc2c(c1)NC(=O)CO2)C 271570a_100102525489_100000244627 [0,1,0,1,0,0|1,0,1]=4 1942 B16R2.11975 CC(=O)Nc1ccc2c(c1)NC(=O)CO2 11a_100000230169_100015343762 [0,1,0,1,0,0|2,0,0]=4 1943 B16R2.11975 CC(=O)Nc1ccc2c(c1)NC(=O)CO2 1626a_100000230169_100015343762 [0,1,0,1,0,0|2,0,0]=4 1944 B16R2.11975 CC(=O)Nc1ccc2c(c1)NC(=O)CO2 22a_100000230169_100000070787 [0,1,0,1,0,0|2,0,0]=4 1945 B16R2.11975 CC(=O)Nc1ccc2c(c1)NC(=O)CO2 527a_100000230169_100103153847 [0,1,0,1,0,0|2,0,0]=4 1946 B16R2.11975 CC(C)Nc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_100000210206 [0,1,0,1,0,0|2,0,0]=4 1947 B16R2.11975 CC(C)Oc1ccc2c(c1)NC(=O)CO2 34a_100009876821_100000210206 [0,1,0,1,0,0|2,0,0]=4 1948 B16R2.11975 CN(C)Cc1ccc2c(c1)NC(=O)CO2 270004a_100102631434_100000766376 [0,1,0,1,0,0|1,0,0]=3 1949 B16R2.33275 CC(=O)Cc1cc(ccc1O)SC2CC2 62a_200010006938_100000211595 [0,1,0,1,0,0|2,0,0]=4 1950 B16R2.33275 CC(=O)Nc1cc(ccc1C)NC2CC2 34a_100000740626_100000211595 [0,1,0,1,0,0|2,0,0]=4 1951 B16R2.33275 CC(=O)Nc1cc(ccc1Cl)NC2CC2 34a_100000745429_100000211595 [0,1,0,1,0,0|2,0,0]=4 1952 B16R2.33275 CC(=O)Nc1cc(ccc1F)NC2CC2 34a_100000736141_100000211595 [0,1,0,1,0,0|2,0,0]=4 1953 B16R2.33275 CC(=O)Nc1cc(ccc1O)NC2CC2 34a_100000070259_100000211595 [0,1,0,1,0,0|1,0,0]=3 1954 B16R2.1205 CCC(=O)c1ccc2c(c1)NC(=O)CO2 1458a_100000187493_100000210202 [0,1,0,1,0,0|1,0,1]=4 1955 B16R2.1205 CNC(=O)c1ccc2c(c1)NC(=O)CO2 11a_106832991635_100000187493 [0,1,0,1,0,0|1,0,1]=4 1956 B16R2.1205 CNC(=O)c1ccc2c(c1)NC(=O)CO2 1626a_100102657272_100000187493 [0,1,0,1,0,0|1,0,1]=4 1957 B16R2.1205 CNC(=O)c1ccc2c(c1)NC(=O)CO2 240690a_100102657272_100000187493 [0,1,0,1,0,0|1,0,1]=4 1958 B16R2.1205 CNC(=O)c1ccc2c(c1)NC(=O)CO2 527a_100102657272_100000187493 [0,1,0,1,0,0|1,0,1]=4 1959 B16R2.1285 C#CCNc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_100000038162 [0,1,0,1,0,0|1,0,1]=4 1960 B16R2.1285 C#CCOc1ccc2c(c1)NC(=O)CO2 34a_100009876821_100000184674 [0,1,0,1,0,0|1,0,1]=4 1961 B16R2.1285 C=CCNc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_100000210623 [0,1,0,1,0,0|1,0,1]=4 1962 B16R2.1285 C=CCOc1ccc2c(c1)NC(=O)CO2 34a_100009876821_100015514636 [0,1,0,1,0,0|1,0,1]=4 1963 B16R2.1285 CCCCc1ccc2c(c1)NC(=O)CC2 271570a_100020621405_100000763451 [0,1,0,1,0,0|2,0,0]=4 1964 B16R2.1285 CCCCc1ccc2c(c1)NC(=O)CO2 271570a_100020621405_100000244627 [0,1,0,1,0,0|1,0,0]=3 1965 B16R2.1285 CCCCc1ccc2c(c1)NC(=O)CS2 271570a_100020621405_100012361575 [0,1,0,1,0,0|1,1,0]=4 1966 B16R2.1285 CCCCc1ccc2c(n1)NC(=O)CO2 271570a_100020621405_100010235088 [0,1,0,1,0,0|2,0,0]=4 1967 B16R2.1285 CCCCc1cnc2c(c1)NC(=O)CO2 271570a_100020621405_100000699640 [0,1,0,1,0,0|2,0,0]=4 1968 B16R2.1285 CCCNc1ccc2c(c1)NC(=O)CC2 2230a_100000055022_100000210303 [0,1,0,1,0,0|2,0,0]=4 1969 B16R2.1285 CCCNc1ccc2c(c1)NC(=O)CC2 34a_100000055022_100000210303 [0,1,0,1,0,0|2,0,0]=4 1970 B16R2.1285 CCCNc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_100000210303 [0,1,0,1,0,0|1,0,0]=3 1971 B16R2.1285 CCCOc1ccc2c(c1)NC(=O)CC2 34a_100000708604_100000210303 [0,1,0,1,0,0|2,0,0]=4 1972 B16R2.1285 CCCOc1ccc2c(c1)NC(=O)CO2 34a_100009876821_100000210303 [0,1,0,1,0,0|1,0,0]=3 1973 B16R2.1285 CCCSc1ccc2c(c1)NC(=O)CC2 62a_100000210303_100000763451 [0,1,0,1,0,0|2,0,0]=4 1974 B16R2.1285 CCCSc1ccc2c(c1)NC(=O)CC2 62a_100000763451_100000210303 [0,1,0,1,0,0|2,0,0]=4 1975 B16R2.1285 CCCSc1cnc2c(c1)NC(=O)CO2 62a_100000210303_100000699640 [0,1,0,1,0,0|2,0,0]=4 1976 B16R2.1285 CCNCc1ccc2c(c1)NC(=O)CO2 270004a_100015525214_100000766376 [0,1,0,1,0,0|1,0,0]=3 1977 B16R2.1285 COCNc1ccc2c(c1)NC(=O)CC2 2230a_100000055022_100000766300 [0,1,0,1,0,0|1,0,0]=3 1978 B16R2.1285 COCNc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_100000766300 [0,1,0,1,0,0|0,0,0]=2 1979 B16R2.1285 COCSc1ccc2c(c1)CC(=O)CC2 62a_100000766300_100010138410 [0,1,0,1,0,0|2,0,0]=4 1980 B16R2.1285 COCSc1ccc2c(c1)CC(=O)CC2 62a_100010138410_100000766300 [0,1,0,1,0,0|2,0,0]=4 1981 B16R2.1285 COCSc1ccc2c(c1)NC(=O)CC2 62a_100000763451_100000766300 [0,1,0,1,0,0|1,0,0]=3 1982 B16R2.1285 COCSc1ccc2c(c1)NC(=O)CC2 62a_100000766300_100000763451 [0,1,0,1,0,0|1,0,0]=3 1983 B16R2.1285 COCSc1ccc2c(c1)NC(=O)NC2 62a_100000766300_100010161048 [0,1,0,1,0,0|2,0,0]=4 1984 B16R2.1285 COCSc1ccc2c(c1)NC(=O)NC2 62a_100010161048_100000766300 [0,1,0,1,0,0|2,0,0]=4 1985 B16R2.1285 COCSc1cnc2c(c1)NC(=O)CO2 62a_100000766300_100000699640 [0,1,0,1,0,0|1,0,0]=3 1986 B16R2.1285 CSCNc1ccc2c(c1)NC(=O)CC2 2230a_100000055022_100011218213 [0,1,0,1,0,0|1,1,0]=4 1987 B16R2.1285 CSCNc1ccc2c(c1)NC(=O)CC2 34a_100000055022_100011218213 [0,1,0,1,0,0|1,1,0]=4 1988 B16R2.1285 CSCNc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_100011218213 [0,1,0,1,0,0|0,1,0]=3 1989 B16R2.1285 CSCOc1ccc2c(c1)NC(=O)CC2 34a_100000708604_100011218213 [0,1,0,1,0,0|1,1,0]=4 1990 B16R2.1285 CSCOc1ccc2c(c1)NC(=O)CO2 34a_100009876821_100011218213 [0,1,0,1,0,0|0,1,0]=3 1991 B16R2.1285 CSCSc1ccc2c(c1)NC(=O)CC2 62a_100000763451_100011218213 [0,1,0,1,0,0|1,1,0]=4 1992 B16R2.1285 CSCSc1ccc2c(c1)NC(=O)CC2 62a_100011218213_100000763451 [0,1,0,1,0,0|1,1,0]=4 1993 B16R2.1285 CSCSc1cnc2c(c1)NC(=O)CO2 62a_100011218213_100000699640 [0,1,0,1,0,0|1,1,0]=4 1994 B16R2.1285 N#CCNc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_100011215382 [0,1,0,1,0,0|2,0,0]=4 1995 B16R2.1285 O=C1COc2ccc(cc2N1)NCCF 2230a_100000230169_100011217306 [0,1,0,1,0,0|2,0,0]=4 1996 B16R2.1285 O=C1COc2ccc(cc2N1)NCCO 2230a_100000230169_100000211926 [0,1,0,1,0,0|2,0,0]=4 1997 B16R2.1285 O=C1COc2ccc(cc2N1)OCCF 34a_100009876821_100011217306 [0,1,0,1,0,0|2,0,0]=4 1998 B16R2.1285 O=C1COc2ccc(cc2N1)OCCO 34a_100009876821_100000211926 [0,1,0,1,0,0|2,0,0]=4 1999 B16R2.1285 O=CCNc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_200015260668 [0,1,0,1,0,0|2,0,0]=4 2000 B16R2.1285 O=CCOc1ccc2c(c1)NC(=O)CO2 34a_100009876821_200009817547 [0,1,0,1,0,0|2,0,0]=4 2001 B16R2.33047 CCCCc1ccc(c2c1CC(=O)N2)F 271570a_100020621405_100012355367 [0,1,0,1,0,0|2,0,0]=4 2002 B16R2.33047 CCCSc1ccc(c2c1CC(=O)N2)F 62a_100000210303_100012355367 [0,1,0,1,0,0|2,0,0]=4 2003 B16R2.33047 COCSc1ccc(c2c1CC(=O)N2)F 62a_100000766300_100012355367 [0,1,0,1,0,0|1,0,0]=3 2004 B16R2.33047 CSCSc1ccc(c2c1CC(=O)N2)F 62a_100011218213_100012355367 [0,1,0,1,0,0|1,1,0]=4 2005 B16R2.21673 CC=Cc1cc(c2c(c1)NC(=O)CO2)C 271570a_100016259895_100012356449 [0,1,0,1,0,0|1,0,1]=4 2006 B16R2.21673 CC=Cc1cc(c2c(c1)NC(=O)CO2)F 271570a_100016259895_100012356450 [0,1,0,1,0,0|1,0,1]=4 2007 B16R2.21673 CCSc1cc(c2c(c1)NC(=O)CO2)C 62a_100000210202_100012356449 [0,1,0,1,0,0|2,0,0]=4 2008 B16R2.21673 CCSc1cc(c2c(c1)NC(=O)CO2)F 62a_100012356450_100000210202 [0,1,0,1,0,0|2,0,0]=4 2009 B16R2.137727 CC(=O)Nc1cc(c(cc1F)F)C2CC2 271570a_100011220607_200013902858 [0,1,0,1,0,0|2,0,0]=4 2010 B16R2.28261 CC=Cc1ccc2c(c1)N(C(=O)CO2)C 271570a_100016259895_100010196913 [0,1,0,1,0,0|1,0,1]=4 2011 B16R2.28261 CCNc1ccc2c(c1)N(C(=O)CO2)C 2230a_100000765360_100000210202 [0,1,0,1,0,0|2,0,0]=4 2012 B16R2.28261 CCNc1ccc2c(c1)N(C(=O)CO2)C 34a_100000765360_100000210202 [0,1,0,1,0,0|2,0,0]=4 2013 B16R2.28261 CCSc1ccc2c(c1)N(C(=O)CO2)C 62a_100010196913_100000210202 [0,1,0,1,0,0|2,0,0]=4 2014 B16R2.1579 C=Cc1cc2c(cc1NC(=O)C)CCC2 271570a_100011290941_100010204489 [0,1,0,1,0,0|2,0,0]=4 2015 B16R2.1579 CC(=O)Nc1cc2c(cc1S[13CH3])CCC2 62a_100010204489_200025704644 [0,1,0,1,0,0|1,1,0]=4 2016 B16R2.1579 CC(=O)Nc1cc2c(cc1S[13CH3])CCC2 62a_200025704644_100010204489 [0,1,0,1,0,0|1,1,0]=4 2017 B16R2.1579 CSc1cc2c(cc1NC(=O)C)CCC2 62a_100010204489_200000210301 [0,1,0,1,0,0|1,1,0]=4 2018 B16R2.1579 CSc1cc2c(cc1NC(=O)C)CCC2 62a_200000210301_100010204489 [0,1,0,1,0,0|1,1,0]=4 2019 B16R2.58748 COc1ccc(cc1CC(=O)C)C2CC2 271570a_100011220607_200011493461 [0,1,0,1,0,0|2,0,0]=4 2020 B16R2.58748 COc1ccc(cc1NC(=O)C)C2CC2 271570a_100011220607_200011407902 [0,1,0,1,0,0|1,0,0]=3 2021 B16R2.58748 COc1ccc(cc1OC(=O)C)C2CC2 271570a_100011220607_200011016479 [0,1,0,1,0,0|2,0,0]=4 2022 B16R2.50655 CCC(=O)Nc1cc(ccc1F)C2CC2 11a_102516457221_100000210414 [0,1,0,1,0,0|2,0,0]=4 2023 B16R2.50655 CCC(=O)Nc1cc(ccc1F)C2CC2 1626a_102516457221_100000210414 [0,1,0,1,0,0|2,0,0]=4 2024 B16R2.50655 CCC(=O)Nc1cc(ccc1F)C2CC2 22a_102516457221_100000210414 [0,1,0,1,0,0|2,0,0]=4 2025 B16R2.50655 CCC(=O)Nc1cc(ccc1F)C2CC2 527a_102516457221_100000210414 [0,1,0,1,0,0|2,0,0]=4 2026 B16R2.50655 CNC(=O)Nc1cc(ccc1F)C2CC2 2430a_102516457221_100102657272 [0,1,0,1,0,0|2,0,0]=4 2027 B16R2.50655 COC(=O)Cc1cc(ccc1O)C2CC2 271570a_100011220607_100010185610 [0,1,0,1,0,0|2,0,0]=4 2028 B16R2.50655 O=C(CO)Nc1cc(ccc1F)C2CC2 22a_102516457221_100000210174 [0,1,0,1,0,0|2,0,0]=4 2029 B16R2.50655 O=C(CO)Nc1cc(ccc1F)C2CC2 527a_102516457221_100000210174 [0,1,0,1,0,0|2,0,0]=4 2030 B16R2.50969 CC=Cc1ccc2c(c1)NC(=O)C(O2)C 271570a_100016259895_100000745501 [0,1,0,1,0,0|1,0,1]=4 2031 B16R2.50969 CCSc1ccc2c(c1)NC(=O)C(O2)C 62a_100000210202_100000745501 [0,1,0,1,0,0|2,0,0]=4 2032 B16R2.169905 CCC(=O)Nc1c(ccc2c1CCC2)Br 11a_202495424074_100000210414 [0,1,0,1,0,0|2,0,0]=4 2033 B16R2.169905 CCC(=O)Nc1c(ccc2c1CCC2)Br 1626a_202495424074_100000210414 [0,1,0,1,0,0|2,0,0]=4 2034 B16R2.169905 CCC(=O)Nc1c(ccc2c1CCC2)C 11a_202495413831_100000210414 [0,1,0,1,0,0|2,0,0]=4 2035 B16R2.169905 CCC(=O)Nc1c(ccc2c1CCC2)C 1626a_202495413831_100000210414 [0,1,0,1,0,0|2,0,0]=4 2036 B16R2.169905 CCC(=O)Nc1c(ccc2c1CCC2)C 22a_202495413831_100000210414 [0,1,0,1,0,0|2,0,0]=4 2037 B16R2.169905 CNC(=O)Nc1c(ccc2c1CCC2)C 2430a_202495413831_100102657272 [0,1,0,1,0,0|2,0,0]=4 2038 B16R2.169905 Cc1ccc2c(c1NC(=O)CO)CCC2 22a_202495413831_100000210174 [0,1,0,1,0,0|2,0,0]=4 2039 B16R2.28224 CC=Cc1ccc2c(c1C)NC(=O)CO2 271570a_100016259895_100010272156 [0,1,0,1,0,0|1,0,1]=4 2040 B16R3.10767 O=C1CCc2ccc(cc2N1)C3CC3 271570a_100011220607_100000763451 [0,0,0,2,0,0|2,0,0]=4 2041 B16R3.10767 O=C1COc2ccc(cc2N1)C3CC3 271570a_100011220607_100000244627 [0,0,0,2,0,0|1,0,0]=3 2042 B16R3.10767 O=C1COc2ccc(nc2N1)C3CC3 271570a_100011220607_100010235088 [0,0,0,2,0,0|2,0,0]=4 2043 B16R3.10767 O=C1COc2ncc(cc2N1)C3CC3 271570a_100011220607_100000699640 [0,0,0,2,0,0|2,0,0]=4 2044 B16R3.10767 O=C1CSc2ccc(cc2N1)C3CC3 271570a_100011220607_100012361575 [0,0,0,2,0,0|1,1,0]=4 2045 B16R3.197660 O=C1Cc2c(ccc(c2N1)F)C3CC3 271570a_100011220607_100012355367 [0,0,0,2,0,0|2,0,0]=4 2046 B12R1.453 C=C(C)c1cc(ccc1Br)OC 271570a_100000694244_100009992028 [1,0,0,0,1,0|2,0,0]=4 2047 B12R1.453 C=C(C)c1cc(ccc1C)CO 271570a_100000694244_100000050133 [1,0,0,0,1,0|2,0,0]=4 2048 B12R1.453 C=C(C)c1cc(ccc1C)OC 271570a_100000694244_100012349166 [1,0,0,0,1,0|2,0,0]=4 2049 B12R1.453 C=C(C)c1cc(ccc1Cl)OC 271570a_100000694244_100011356938 [1,0,0,0,1,0|2,0,0]=4 2050 B12R1.453 C=C(C)c1cc(ccc1F)CC 271570a_100000694244_200010244628 [1,0,0,0,1,0|2,0,0]=4 2051 B12R1.453 C=C(C)c1cc(ccc1F)CO 271570a_100000694244_100000246287 [1,0,0,0,1,0|2,0,0]=4 2052 B12R1.453 C=C(C)c1cc(ccc1F)OC 271570a_100000694244_100000699733 [1,0,0,0,1,0|2,0,0]=4 2053 B12R1.453 C=C(C)c1cc(ccc1N)CC 271570a_100000694244_100012339725 [1,0,0,0,1,0|2,0,0]=4 2054 B12R1.453 C=C(C)c1cc(ccc1N)OC 271570a_100000694244_100015195136 [1,0,0,0,1,0|2,0,0]=4 2055 B12R1.453 C=C(C)c1cc(ccc1O)CC 271570a_100000694244_100012339963 [1,0,0,0,1,0|1,0,0]=3 2056 B12R1.453 C=C(C)c1cc(ccc1O)CO 271570a_100000694244_100011191544 [1,0,0,0,1,0|1,0,0]=3 2057 B12R1.453 C=C(C)c1cc(ccc1O)OC 271570a_100000694244_100000685887 [1,0,0,0,1,0|1,0,0]=3 2058 B12R1.453 C=C(C)c1nc(ccc1O)CO 271570a_100000694244_200000118097 [1,0,0,0,1,0|2,0,0]=4 2059 B12R1.453 C=Cc1ccc(c(c1)C(=O)C)O 271570a_100011290941_100000212127 [1,0,0,0,1,0|0,0,2]=4 2060 B12R1.453 CC(=O)c1cc(ccc1Br)CO 1458a_100010259715_200000210301 [1,0,0,0,1,0|1,0,0]=3 2061 B12R1.453 CC(=O)c1cc(ccc1C)S[13CH3] 62a_100012706819_200025704644 [1,0,0,0,1,0|1,1,0]=4 2062 B12R1.453 CC(=O)c1cc(ccc1Cl)O[13CH3] 34a_100009867868_200025704644 [1,0,0,0,1,0|1,0,0]=3 2063 B12R1.453 CC(=O)c1cc(ccc1Cl)O[13CH3] 7a_100009867868_200025704644 [1,0,0,0,1,0|1,0,0]=3 2064 B12R1.453 CC(=O)c1cc(ccc1Cl)S[13CH3] 62a_100010712560_200025704644 [1,0,0,0,1,0|1,1,0]=4 2065 B12R1.453 CC(=O)c1cc(ccc1F)O[13CH3] 34a_100000091700_200025704644 [1,0,0,0,1,0|1,0,0]=3 2066 B12R1.453 CC(=O)c1cc(ccc1F)O[13CH3] 7a_100000091700_200025704644 [1,0,0,0,1,0|1,0,0]=3 2067 B12R1.453 CC(=O)c1cc(ccc1F)S[13CH3] 62a_100000689017_200025704644 [1,0,0,0,1,0|1,1,0]=4 2068 B12R1.453 CC(=O)c1cc(ccc1F)S[13CH3] 62a_200025704644_100010254839 [1,0,0,0,1,0|1,1,0]=4 2069 B12R1.453 CC(=O)c1cc(ccc1N)S[13CH3] 62a_100000695420_200025704644 [1,0,0,0,1,0|1,1,0]=4 2070 B12R1.453 CC(=O)c1cc(ccc1O)C#N 1458a_100000719980_200000210301 [1,0,0,0,1,0|1,0,1]=4 2071 B12R1.453 CC(=O)c1cc(ccc1O)CO 1458a_200000045694_200000210301 [1,0,0,0,1,0|0,0,0]=2 2072 B12R1.453 CCc1ccc(c(c1)C(=O)C)O 1458a_200000748397_200000210301 [1,0,0,0,1,0|0,0,0]=2 2073 B12R1.453 CCc1ccc(c(c1)C(=O)[13CH3])O 1458a_200000748397_200025704644 [1,0,0,0,1,0|0,0,0]=2 2074 B12R1.453 COc1ccc(c(c1)C(=O)C)Br 1458a_100000211723_200000210301 [1,0,0,0,1,0|1,0,0]=3 2075 B12R1.453 COc1ccc(c(c1)C(=O)C)C 1458a_100011399813_200000210301 [1,0,0,0,1,0|1,0,0]=3 2076 B12R1.453 COc1ccc(c(c1)C(=O)C)Cl 1458a_100000763818_200000210301 [1,0,0,0,1,0|1,0,0]=3 2077 B12R1.453 COc1ccc(c(c1)C(=O)C)Cl 34a_100009867868_200000210301 [1,0,0,0,1,0|1,0,0]=3 2078 B12R1.453 COc1ccc(c(c1)C(=O)C)Cl 7a_100009867868_200000210301 [1,0,0,0,1,0|1,0,0]=3 2079 B12R1.453 COc1ccc(c(c1)C(=O)C)F 1458a_100011217016_200000210301 [1,0,0,0,1,0|1,0,0]=3 2080 B12R1.453 COc1ccc(c(c1)C(=O)C)F 34a_100000091700_200000210301 [1,0,0,0,1,0|1,0,0]=3 2081 B12R1.453 COc1ccc(c(c1)C(=O)C)F 7a_100000091700_200000210301 [1,0,0,0,1,0|1,0,0]=3 2082 B12R1.453 COc1ccc(c(c1)C(=O)C)I 1458a_100012339533_200000210301 [1,0,0,0,1,0|1,0,0]=3 2083 B12R1.453 COc1ccc(c(c1)C(=O)C)O 1458a_100000211986_200000210301 [1,0,0,0,1,0|0,0,0]=2 2084 B12R1.453 COc1ccc(c(c1)C(=O)C)O 271570a_203496583355_100011360761 [1,0,0,0,1,0|0,0,0]=2 2085 B12R1.453 COc1ccc(c(c1)C(=O)N)O 271570a_203496583355_100000162014 [1,0,0,0,1,0|1,0,0]=3 2086 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])Br 1458a_100000211723_200025704644 [1,0,0,0,1,0|1,0,0]=3 2087 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])C 1458a_100011399813_200025704644 [1,0,0,0,1,0|1,0,0]=3 2088 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100000763818_200025704644 [1,0,0,0,1,0|1,0,0]=3 2089 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])F 1458a_100011217016_200025704644 [1,0,0,0,1,0|1,0,0]=3 2090 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])I 1458a_100012339533_200025704644 [1,0,0,0,1,0|1,0,0]=3 2091 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000211986_200025704644 [1,0,0,0,1,0|0,0,0]=2 2092 B12R1.453 COc1ccc(c(c1)[C@H](C)N)O 271570a_203496583355_200015425320 [1,0,0,0,1,0|1,0,1]=4 2093 B12R1.453 CSc1ccc(c(c1)C(=O)C)C 62a_100012706819_200000210301 [1,0,0,0,1,0|1,1,0]=4 2094 B12R1.453 CSc1ccc(c(c1)C(=O)C)Cl 1458a_100000212015_200000210301 [1,0,0,0,1,0|1,1,0]=4 2095 B12R1.453 CSc1ccc(c(c1)C(=O)C)Cl 62a_100010712560_200000210301 [1,0,0,0,1,0|1,1,0]=4 2096 B12R1.453 CSc1ccc(c(c1)C(=O)C)F 1458a_200012183283_200000210301 [1,0,0,0,1,0|1,1,0]=4 2097 B12R1.453 CSc1ccc(c(c1)C(=O)C)F 62a_100000689017_200000210301 [1,0,0,0,1,0|1,1,0]=4 2098 B12R1.453 CSc1ccc(c(c1)C(=O)C)F 62a_200000210301_100010254839 [1,0,0,0,1,0|1,1,0]=4 2099 B12R1.453 CSc1ccc(c(c1)C(=O)C)N 62a_100000695420_200000210301 [1,0,0,0,1,0|1,1,0]=4 2100 B12R1.453 CSc1ccc(c(c1)C(=O)N)O 62a_100000192807_200000210301 [1,0,0,0,1,0|1,1,0]=4 2101 B12R1.453 CSc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100000212015_200025704644 [1,0,0,0,1,0|1,1,0]=4 2102 B12R1.453 CSc1ccc(c(c1)C(=O)[13CH3])F 1458a_200012183283_200025704644 [1,0,0,0,1,0|1,1,0]=4 2103 B12R1.453 [13CH3]C(=O)c1cc(ccc1Br)CO 1458a_100010259715_200025704644 [1,0,0,0,1,0|1,0,0]=3 2104 B12R1.453 [13CH3]C(=O)c1cc(ccc1O)C#N 1458a_100000719980_200025704644 [1,0,0,0,1,0|1,0,1]=4 2105 B12R1.453 [13CH3]C(=O)c1cc(ccc1O)CO 1458a_200000045694_200025704644 [1,0,0,0,1,0|0,0,0]=2 2106 B12R1.453 [13CH3]Sc1ccc(c(c1)C(=O)N)O 62a_100000192807_200025704644 [1,0,0,0,1,0|1,1,0]=4 2107 B12R1.279 C=C(C)c1cccc(c1)CCC 271570a_100000694244_100000694964 [1,0,0,0,1,0|2,0,0]=4 2108 B12R1.279 C=C(C)c1cccc(c1)CNC 271570a_100000694244_100000187585 [1,0,0,0,1,0|2,0,0]=4 2109 B12R1.279 C=C(C)c1cccc(c1)COC 271570a_100000694244_100011493687 [1,0,0,0,1,0|1,0,0]=3 2110 B12R1.279 CC(=O)c1cccc(c1)CC#N 1458a_100000027370_200000210301 [1,0,0,0,1,0|2,0,0]=4 2111 B12R1.279 CC(=O)c1cccc(c1)CCO 1458a_100009869812_200000210301 [1,0,0,0,1,0|2,0,0]=4 2112 B12R1.279 CC(=O)c1cccc(c1)CS[13CH3] 62a_100000084091_200025704644 [1,0,0,0,1,0|0,1,0]=3 2113 B12R1.279 CC(=O)c1cccc(c1)CS[13CH3] 62a_200025704644_100000084091 [1,0,0,0,1,0|0,1,0]=3 2114 B12R1.279 CC=Cc1cccc(c1)C(=O)C 271570a_100016259895_100000210093 [1,0,0,0,1,0|1,0,1]=4 2115 B12R1.279 CCOc1cccc(c1)C(=O)C 1458a_100000216331_200000210301 [1,0,0,0,1,0|2,0,0]=4 2116 B12R1.279 CCOc1cccc(c1)C(=O)C 34a_100000211620_100000210202 [1,0,0,0,1,0|2,0,0]=4 2117 B12R1.279 CCOc1cccc(c1)C(=O)C 7a_100000211620_100000210202 [1,0,0,0,1,0|2,0,0]=4 2118 B12R1.279 CCOc1cccc(c1)C(=O)[13CH3] 1458a_100000216331_200025704644 [1,0,0,0,1,0|2,0,0]=4 2119 B12R1.279 CCSc1cccc(c1)C(=O)C 62a_100000210093_100000210202 [1,0,0,0,1,0|2,0,0]=4 2120 B12R1.279 CCSc1cccc(c1)C(=O)C 62a_100000210202_100000210093 [1,0,0,0,1,0|2,0,0]=4 2121 B12R1.279 CN(C)c1cccc(c1)CO[13CH3] 34a_100000759682_200025704644 [1,0,0,0,1,0|2,0,0]=4 2122 B12R1.279 CNCc1cccc(c1)C(=O)C 2230a_106832991635_100000084091 [1,0,0,0,1,0|1,0,0]=3 2123 B12R1.279 CNCc1cccc(c1)C(=O)C 26a_100102657272_100000211620 [1,0,0,0,1,0|1,0,0]=3 2124 B12R1.279 CNCc1cccc(c1)C(=O)C 34a_100102657272_100000084091 [1,0,0,0,1,0|1,0,0]=3 2125 B12R1.279 CNCc1cccc(c1)C(=O)C 7a_106832991635_100000084091 [1,0,0,0,1,0|1,0,0]=3 2126 B12R1.279 CNCc1cccc(c1)C(=O)N 207a_100102657272_100000059704 [1,0,0,0,1,0|2,0,0]=4 2127 B12R1.279 CNCc1cccc(c1)C(=O)N 2230a_100000746036_200000210301 [1,0,0,0,1,0|2,0,0]=4 2128 B12R1.279 CNCc1cccc(c1)C(=O)N 2230a_106832991635_100000738444 [1,0,0,0,1,0|2,0,0]=4 2129 B12R1.279 CNCc1cccc(c1)C(=O)N 270004a_106832991635_100000059704 [1,0,0,0,1,0|2,0,0]=4 2130 B12R1.279 CNCc1cccc(c1)C(=O)N 34a_100102657272_100000738444 [1,0,0,0,1,0|2,0,0]=4 2131 B12R1.279 CNCc1cccc(c1)C(=O)N 7a_106832991635_100000738444 [1,0,0,0,1,0|2,0,0]=4 2132 B12R1.279 CNCc1cccc(c1)C(=O)O 269956a_100000752609_200000210301 [1,0,0,0,1,0|2,0,0]=4 2133 B12R1.279 CNCc1cccc(c1)C(=O)[O-] 26a_100102657272_200020627138 [1,0,0,0,1,0|2,0,0]=4 2134 B12R1.279 COCc1cccc(c1)C(=O)C 1458a_100000199024_200000210301 [1,0,0,0,1,0|0,0,0]=2 2135 B12R1.279 COCc1cccc(c1)C(=O)C 34a_100138415774_100000084091 [1,0,0,0,1,0|0,0,0]=2 2136 B12R1.279 COCc1cccc(c1)C(=O)N 34a_100138415774_100000738444 [1,0,0,0,1,0|1,0,0]=3 2137 B12R1.279 COCc1cccc(c1)C(=O)[13CH3] 1458a_100000199024_200025704644 [1,0,0,0,1,0|0,0,0]=2 2138 B12R1.279 COCc1cccc(c1)N(C)C 34a_100000759682_200000210301 [1,0,0,0,1,0|2,0,0]=4 2139 B12R1.279 COCc1cccc(c1)[N+](=O)[O-] 34a_100000238370_200000210301 [1,0,0,0,1,0|2,0,0]=4 2140 B12R1.279 COCc1cccc(c1)[N+](=O)[O-] 34a_100138415774_100000737091 [1,0,0,0,1,0|2,0,0]=4 2141 B12R1.279 COCc1cccc(c1)[N+](=O)[O-] 7a_100000238370_200000210301 [1,0,0,0,1,0|2,0,0]=4 2142 B12R1.279 COCc1cncc(c1)C(=O)N 34a_100138415774_200010162415 [1,0,0,0,1,0|2,0,0]=4 2143 B12R1.279 CSCc1cccc(c1)C(=O)C 62a_100000084091_200000210301 [1,0,0,0,1,0|0,1,0]=3 2144 B12R1.279 CSCc1cccc(c1)C(=O)C 62a_200000210301_100000084091 [1,0,0,0,1,0|0,1,0]=3 2145 B12R1.279 CSCc1cccc(c1)C(=O)N 62a_100000738444_200000210301 [1,0,0,0,1,0|1,1,0]=4 2146 B12R1.279 CSCc1cccc(c1)C(=O)N 62a_200000210301_100000738444 [1,0,0,0,1,0|1,1,0]=4 2147 B12R1.279 [13CH3]C(=O)c1cccc(c1)CC#N 1458a_100000027370_200025704644 [1,0,0,0,1,0|2,0,0]=4 2148 B12R1.279 [13CH3]C(=O)c1cccc(c1)CCO 1458a_100009869812_200025704644 [1,0,0,0,1,0|2,0,0]=4 2149 B12R1.279 [13CH3]NCc1cccc(c1)C(=O)N 2230a_100000746036_200025704644 [1,0,0,0,1,0|2,0,0]=4 2150 B12R1.279 [13CH3]NCc1cccc(c1)C(=O)O 269956a_100000752609_200025704644 [1,0,0,0,1,0|2,0,0]=4 2151 B12R1.279 [13CH3]OCc1cccc(c1)[N+](=O)[O-] 34a_100000238370_200025704644 [1,0,0,0,1,0|2,0,0]=4 2152 B12R1.279 [13CH3]OCc1cccc(c1)[N+](=O)[O-] 7a_100000238370_200025704644 [1,0,0,0,1,0|2,0,0]=4 2153 B12R1.279 [13CH3]SCc1cccc(c1)C(=O)N 62a_100000738444_200025704644 [1,0,0,0,1,0|1,1,0]=4 2154 B12R1.279 [13CH3]SCc1cccc(c1)C(=O)N 62a_200025704644_100000738444 [1,0,0,0,1,0|1,1,0]=4 2155 B14R1.2335 C=C(C)CNc1cc(ccc1Br)CO 34a_100012347568_100000748629 [1,0,0,0,0,1|2,0,0]=4 2156 B14R1.2335 C=C(C)CNc1cc(ccc1Br)OC 34a_100000748603_100000748629 [1,0,0,0,0,1|2,0,0]=4 2157 B14R1.2335 C=C(C)CNc1cc(ccc1C)CC 2230a_200012022522_100000748629 [1,0,0,0,0,1|2,0,0]=4 2158 B14R1.2335 C=C(C)CNc1cc(ccc1C)CC 34a_200012022522_100000748629 [1,0,0,0,0,1|2,0,0]=4 2159 B14R1.2335 C=C(C)CNc1cc(ccc1C)CC 7a_200012022522_100000748629 [1,0,0,0,0,1|2,0,0]=4 2160 B14R1.2335 C=C(C)CNc1cc(ccc1C)CO 2230a_100000758420_100000748629 [1,0,0,0,0,1|2,0,0]=4 2161 B14R1.2335 C=C(C)CNc1cc(ccc1C)CO 34a_100000758420_100000748629 [1,0,0,0,0,1|2,0,0]=4 2162 B14R1.2335 C=C(C)CNc1cc(ccc1C)OC 2230a_100000760359_100000748629 [1,0,0,0,0,1|2,0,0]=4 2163 B14R1.2335 C=C(C)CNc1cc(ccc1C)OC 34a_100000760359_100000748629 [1,0,0,0,0,1|2,0,0]=4 2164 B14R1.2335 C=C(C)CNc1cc(ccc1Cl)CO 34a_106256033963_100000748629 [1,0,0,0,0,1|2,0,0]=4 2165 B14R1.2335 C=C(C)CNc1cc(ccc1Cl)OC 34a_100000745576_100000748629 [1,0,0,0,0,1|2,0,0]=4 2166 B14R1.2335 C=C(C)CNc1cc(ccc1F)CO 2230a_102125399562_100000748629 [1,0,0,0,0,1|2,0,0]=4 2167 B14R1.2335 C=C(C)CNc1cc(ccc1F)CO 34a_102125399562_100000748629 [1,0,0,0,0,1|2,0,0]=4 2168 B14R1.2335 C=C(C)CNc1cc(ccc1F)OC 34a_100000764331_100000748629 [1,0,0,0,0,1|2,0,0]=4 2169 B14R1.2335 C=C(C)CNc1cc(ccc1I)OC 34a_100000748021_100000748629 [1,0,0,0,0,1|2,0,0]=4 2170 B14R1.2335 C=C(C)CNc1cc(ccc1O)CC 34a_100000765835_100000748629 [1,0,0,0,0,1|1,0,0]=3 2171 B14R1.2335 C=C(C)CNc1cc(ccc1O)CO 34a_100000123545_100000748629 [1,0,0,0,0,1|1,0,0]=3 2172 B14R1.2335 C=C(C)CNc1cc(ccc1O)OC 34a_100000188146_100000748629 [1,0,0,0,0,1|1,0,0]=3 2173 B14R1.2335 C=C(C)CSc1cc(ccc1O)CC 62a_100000748629_100012339963 [1,0,0,0,0,1|2,0,0]=4 2174 B14R1.2335 C=C(C)CSc1cc(ccc1O)CC 62a_100012339963_100000211660 [1,0,0,0,0,1|2,0,0]=4 2175 B14R1.2335 C=C(C)CSc1cc(ccc1O)CO 62a_100000748629_100011191544 [1,0,0,0,0,1|2,0,0]=4 2176 B14R1.2335 C=C(C)CSc1cc(ccc1O)CO 62a_100011191544_100000211660 [1,0,0,0,0,1|2,0,0]=4 2177 B14R1.2335 C=C(C)CSc1cc(ccc1O)OC 62a_100000748629_100000685887 [1,0,0,0,0,1|2,0,0]=4 2178 B14R1.2335 C=C(F)CNc1cc(ccc1O)CC 34a_100000765835_100009893438 [1,0,0,0,0,1|1,0,1]=4 2179 B14R1.2335 C=C(F)CNc1cc(ccc1O)CO 34a_100000123545_100009893438 [1,0,0,0,0,1|1,0,1]=4 2180 B14R1.2335 C=C(F)CNc1cc(ccc1O)OC 34a_100000188146_100009893438 [1,0,0,0,0,1|1,0,1]=4 2181 B14R1.2335 CC(C)CNc1cc(ccc1O)CO 34a_100000123545_100000210624 [1,0,0,0,0,1|1,0,1]=4 2182 B14R1.2335 CC(O)CNc1cc(ccc1O)CO 34a_100000123545_100011218427 [1,0,0,0,0,1|0,0,2]=4 2183 B14R1.2335 CCc1ccc(c(c1)NCC(=O)N)C 2230a_200012022522_100000747473 [1,0,0,0,0,1|2,0,0]=4 2184 B14R1.2335 CCc1ccc(c(c1)NCC(=O)N)C 34a_200012022522_100000187820 [1,0,0,0,0,1|2,0,0]=4 2185 B14R1.2335 CCc1ccc(c(c1)NCC(=O)N)C 7a_200012022522_100000187820 [1,0,0,0,0,1|2,0,0]=4 2186 B14R1.2335 CCc1ccc(c(c1)NCC(=O)N)O 34a_100000765835_100000187820 [1,0,0,0,0,1|1,0,0]=3 2187 B14R1.2335 CCc1ccc(c(c1)NCC(=O)[O-])C 34a_200012022522_100020667443 [1,0,0,0,0,1|2,0,0]=4 2188 B14R1.2335 CCc1ccc(c(c1)NCC(=O)[O-])O 34a_100000765835_100020667443 [1,0,0,0,0,1|1,0,0]=3 2189 B14R1.2335 CCc1ccc(c(c1)NCC(C)C)O 34a_100000765835_100000210624 [1,0,0,0,0,1|1,0,1]=4 2190 B14R1.2335 CCc1ccc(c(c1)NCC(C)O)O 34a_100000765835_100011218427 [1,0,0,0,0,1|0,0,2]=4 2191 B14R1.2335 CCc1ccc(c(c1)NC[C@@H](C)O)O 34a_100000765835_100009817552 [1,0,0,0,0,1|0,0,2]=4 2192 B14R1.2335 CCc1ccc(c(c1)NC[N+](=O)[O-])O 34a_100000765835_100000761209 [1,0,0,0,0,1|2,0,0]=4 2193 B14R1.2335 CCc1ccc(c(c1)SCC(=O)N)O 62a_100000747473_100012339963 [1,0,0,0,0,1|2,0,0]=4 2194 B14R1.2335 CCc1ccc(c(c1)SCC(=O)N)O 62a_100012339963_100000747473 [1,0,0,0,0,1|2,0,0]=4 2195 B14R1.2335 CCc1ccc(c(c1)SCC(=O)[O-])O 62a_100012339963_100020667443 [1,0,0,0,0,1|2,0,0]=4 2196 B14R1.2335 CCc1ccc(c(c1)SCC(=O)[O-])O 62a_100020667443_100012339963 [1,0,0,0,0,1|2,0,0]=4 2197 B14R1.2335 COc1ccc(c(c1)CCC(=O)C)Br 1458a_200012259420_200000210301 [1,0,0,0,0,1|2,0,0]=4 2198 B14R1.2335 COc1ccc(c(c1)CCC(=O)[13CH3])Br 1458a_200012259420_200025704644 [1,0,0,0,0,1|2,0,0]=4 2199 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)Br 11a_100000741592_100015343762 [1,0,0,0,0,1|1,0,0]=3 2200 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)Br 1626a_100000741592_100015343762 [1,0,0,0,0,1|1,0,0]=3 2201 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)Br 240690a_100000741592_100015343762 [1,0,0,0,0,1|1,0,0]=3 2202 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)Br 527a_100000741592_100103153847 [1,0,0,0,0,1|1,0,0]=3 2203 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)C 11a_100012180165_100015343762 [1,0,0,0,0,1|1,0,0]=3 2204 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)C 1626a_100012180165_100015343762 [1,0,0,0,0,1|1,0,0]=3 2205 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)C 240690a_100012180165_100015343762 [1,0,0,0,0,1|1,0,0]=3 2206 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)C 527a_100012180165_100103153847 [1,0,0,0,0,1|1,0,0]=3 2207 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)F 11a_100016995475_100015343762 [1,0,0,0,0,1|1,0,0]=3 2208 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)F 1626a_100016995475_100015343762 [1,0,0,0,0,1|1,0,0]=3 2209 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)F 240690a_100016995475_100015343762 [1,0,0,0,0,1|1,0,0]=3 2210 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)F 527a_100016995475_100103153847 [1,0,0,0,0,1|1,0,0]=3 2211 B14R1.2335 COc1ccc(c(c1)NCC(=O)N)Br 34a_100000748603_100000187820 [1,0,0,0,0,1|2,0,0]=4 2212 B14R1.2335 COc1ccc(c(c1)NCC(=O)N)C 2230a_100000760359_100000747473 [1,0,0,0,0,1|2,0,0]=4 2213 B14R1.2335 COc1ccc(c(c1)NCC(=O)N)C 34a_100000760359_100000187820 [1,0,0,0,0,1|2,0,0]=4 2214 B14R1.2335 COc1ccc(c(c1)NCC(=O)N)Cl 34a_100000745576_100000187820 [1,0,0,0,0,1|2,0,0]=4 2215 B14R1.2335 COc1ccc(c(c1)NCC(=O)N)F 34a_100000764331_100000187820 [1,0,0,0,0,1|2,0,0]=4 2216 B14R1.2335 COc1ccc(c(c1)NCC(=O)N)I 34a_100000748021_100000187820 [1,0,0,0,0,1|2,0,0]=4 2217 B14R1.2335 COc1ccc(c(c1)NCC(=O)N)O 34a_100000188146_100000187820 [1,0,0,0,0,1|1,0,0]=3 2218 B14R1.2335 COc1ccc(c(c1)NCC(=O)[O-])Br 34a_100000748603_100020667443 [1,0,0,0,0,1|2,0,0]=4 2219 B14R1.2335 COc1ccc(c(c1)NCC(=O)[O-])C 34a_100000760359_100020667443 [1,0,0,0,0,1|2,0,0]=4 2220 B14R1.2335 COc1ccc(c(c1)NCC(=O)[O-])Cl 34a_100000745576_100020667443 [1,0,0,0,0,1|2,0,0]=4 2221 B14R1.2335 COc1ccc(c(c1)NCC(=O)[O-])F 34a_100000764331_100020667443 [1,0,0,0,0,1|2,0,0]=4 2222 B14R1.2335 COc1ccc(c(c1)NCC(=O)[O-])I 34a_100000748021_100020667443 [1,0,0,0,0,1|2,0,0]=4 2223 B14R1.2335 COc1ccc(c(c1)NCC(=O)[O-])O 34a_100000188146_100020667443 [1,0,0,0,0,1|1,0,0]=3 2224 B14R1.2335 COc1ccc(c(c1)NCC(C)C)O 34a_100000188146_100000210624 [1,0,0,0,0,1|1,0,1]=4 2225 B14R1.2335 COc1ccc(c(c1)NCC(C)O)O 34a_100000188146_100011218427 [1,0,0,0,0,1|0,0,2]=4 2226 B14R1.2335 COc1ccc(c(c1)NC[C@@H](C)O)O 34a_100000188146_100009817552 [1,0,0,0,0,1|0,0,2]=4 2227 B14R1.2335 COc1ccc(c(c1)NC[N+](=O)[O-])O 34a_100000188146_100000761209 [1,0,0,0,0,1|2,0,0]=4 2228 B14R1.2335 COc1ccc(c(c1)NNC(=O)C)Cl 22a_200000763216_100000070787 [1,0,0,0,0,1|1,0,0]=3 2229 B14R1.2335 COc1ccc(c(c1)SCC(=O)N)O 62a_100000747473_100000685887 [1,0,0,0,0,1|2,0,0]=4 2230 B14R1.2335 COc1ccc(c(c1)SCC(=O)[O-])O 62a_100020667443_100000685887 [1,0,0,0,0,1|2,0,0]=4 2231 B14R1.2335 COc1ccc(c(n1)CNC(=O)C)Cl 11a_100011639525_100015343762 [1,0,0,0,0,1|2,0,0]=4 2232 B14R1.2335 COc1ccc(c(n1)CNC(=O)C)Cl 1626a_100011639525_100015343762 [1,0,0,0,0,1|2,0,0]=4 2233 B14R1.2335 COc1ccc(c(n1)CNC(=O)C)Cl 240690a_100011639525_100015343762 [1,0,0,0,0,1|2,0,0]=4 2234 B14R1.2335 COc1ccc(c(n1)CNC(=O)C)Cl 527a_100011639525_100103153847 [1,0,0,0,0,1|2,0,0]=4 2235 B14R1.2335 C[C@@H](O)CNc1cc(ccc1O)CO 34a_100000123545_100009817552 [1,0,0,0,0,1|0,0,2]=4 2236 B14R1.2335 Cc1ccc(cc1NCC(=O)N)CO 2230a_100000758420_100000747473 [1,0,0,0,0,1|2,0,0]=4 2237 B14R1.2335 Cc1ccc(cc1NCC(=O)N)CO 34a_100000758420_100000187820 [1,0,0,0,0,1|2,0,0]=4 2238 B14R1.2335 Cc1ccc(cc1NCC(=O)[O-])CO 34a_100000758420_100020667443 [1,0,0,0,0,1|2,0,0]=4 2239 B14R1.2335 NC(=O)CNc1cc(ccc1Br)CO 34a_100012347568_100000187820 [1,0,0,0,0,1|2,0,0]=4 2240 B14R1.2335 NC(=O)CNc1cc(ccc1Cl)CO 34a_106256033963_100000187820 [1,0,0,0,0,1|2,0,0]=4 2241 B14R1.2335 NC(=O)CNc1cc(ccc1F)CO 2230a_102125399562_100000747473 [1,0,0,0,0,1|2,0,0]=4 2242 B14R1.2335 NC(=O)CNc1cc(ccc1F)CO 34a_102125399562_100000187820 [1,0,0,0,0,1|2,0,0]=4 2243 B14R1.2335 NC(=O)CNc1cc(ccc1O)CO 34a_100000123545_100000187820 [1,0,0,0,0,1|1,0,0]=3 2244 B14R1.2335 NC(=O)CSc1cc(ccc1O)CO 62a_100000747473_100011191544 [1,0,0,0,0,1|2,0,0]=4 2245 B14R1.2335 NC(=O)CSc1cc(ccc1O)CO 62a_100011191544_100000747473 [1,0,0,0,0,1|2,0,0]=4 2246 B14R1.2335 O=C([O-])CNc1cc(ccc1Br)CO 34a_100012347568_100020667443 [1,0,0,0,0,1|2,0,0]=4 2247 B14R1.2335 O=C([O-])CNc1cc(ccc1Cl)CO 34a_106256033963_100020667443 [1,0,0,0,0,1|2,0,0]=4 2248 B14R1.2335 O=C([O-])CNc1cc(ccc1F)CO 34a_102125399562_100020667443 [1,0,0,0,0,1|2,0,0]=4 2249 B14R1.2335 O=C([O-])CNc1cc(ccc1O)CO 34a_100000123545_100020667443 [1,0,0,0,0,1|1,0,0]=3 2250 B14R1.2335 O=C([O-])CSc1cc(ccc1O)CO 62a_100011191544_100020667443 [1,0,0,0,0,1|2,0,0]=4 2251 B14R1.2335 O=C([O-])CSc1cc(ccc1O)CO 62a_100020667443_100011191544 [1,0,0,0,0,1|2,0,0]=4 2252 B14R1.2335 O=[N+]([O-])CNc1cc(ccc1O)CO 34a_100000123545_100000761209 [1,0,0,0,0,1|2,0,0]=4 2253 B14R1.468 C=C(C)CNc1cccc(c1)COC 2230a_100000737370_100000748629 [1,0,0,0,0,1|1,0,0]=3 2254 B14R1.468 C=C(C)CNc1cccc(c1)COC 34a_100000737370_100000748629 [1,0,0,0,0,1|1,0,0]=3 2255 B14R1.468 C=C(C)COc1cccc(c1)COC 34a_200011232702_200000210301 [1,0,0,0,0,1|2,0,0]=4 2256 B14R1.468 C=C(C)COc1cccc(c1)COC 7a_200011232702_200000210301 [1,0,0,0,0,1|2,0,0]=4 2257 B14R1.468 C=C(C)COc1cccc(c1)CO[13CH3] 34a_200011232702_200025704644 [1,0,0,0,0,1|2,0,0]=4 2258 B14R1.468 C=C(C)COc1cccc(c1)CO[13CH3] 7a_200011232702_200025704644 [1,0,0,0,0,1|2,0,0]=4 2259 B14R1.468 C=C(C)CSc1cccc(c1)COC 62a_100000748629_100011493687 [1,0,0,0,0,1|2,0,0]=4 2260 B14R1.468 C=C(C)CSc1cccc(c1)COC 62a_100011493687_100000211660 [1,0,0,0,0,1|2,0,0]=4 2261 B14R1.468 C=C(F)CNc1cccc(c1)COC 2230a_100000737370_100009893438 [1,0,0,0,0,1|1,0,1]=4 2262 B14R1.468 C=C(F)CNc1cccc(c1)COC 34a_100000737370_100009893438 [1,0,0,0,0,1|1,0,1]=4 2263 B14R1.468 CC=Cc1cccc(c1)CNC(=O)C 271570a_100016259895_100000766983 [1,0,0,0,0,1|1,0,1]=4 2264 B14R1.468 CCOc1cccc(c1)CNC(=O)C 11a_106359896916_100015343762 [1,0,0,0,0,1|2,0,0]=4 2265 B14R1.468 CCOc1cccc(c1)CNC(=O)C 1626a_106359896916_100015343762 [1,0,0,0,0,1|2,0,0]=4 2266 B14R1.468 CCOc1cccc(c1)CNC(=O)C 240690a_106359896916_100015343762 [1,0,0,0,0,1|2,0,0]=4 2267 B14R1.468 CCOc1cccc(c1)CNC(=O)C 527a_106359896916_100103153847 [1,0,0,0,0,1|2,0,0]=4 2268 B14R1.468 CCSc1cccc(c1)CNC(=O)C 62a_100000210202_100000766983 [1,0,0,0,0,1|2,0,0]=4 2269 B14R1.468 CCSc1cccc(c1)CNC(=O)C 62a_100000766983_100000210202 [1,0,0,0,0,1|2,0,0]=4 2270 B14R1.468 COCc1cccc(c1)NCC(=O)N 2230a_100000737370_100000747473 [1,0,0,0,0,1|1,0,0]=3 2271 B14R1.468 COCc1cccc(c1)NCC(=O)N 34a_100000737370_100000187820 [1,0,0,0,0,1|1,0,0]=3 2272 B14R1.468 COCc1cccc(c1)NCC(=O)[O-] 34a_100000737370_100020667443 [1,0,0,0,0,1|1,0,0]=3 2273 B14R1.468 COCc1cccc(c1)NCC(C)C 2230a_100000737370_100000210760 [1,0,0,0,0,1|1,0,1]=4 2274 B14R1.468 COCc1cccc(c1)NCC(C)C 34a_100000737370_100000210624 [1,0,0,0,0,1|1,0,1]=4 2275 B14R1.468 COCc1cccc(c1)NCC(C)O 2230a_100000737370_100011218427 [1,0,0,0,0,1|0,0,2]=4 2276 B14R1.468 COCc1cccc(c1)NCC(C)O 34a_100000737370_100011218427 [1,0,0,0,0,1|0,0,2]=4 2277 B14R1.468 COCc1cccc(c1)NC[C@@H](C)O 2230a_100000737370_100009817552 [1,0,0,0,0,1|0,0,2]=4 2278 B14R1.468 COCc1cccc(c1)NC[C@@H](C)O 34a_100000737370_100009817552 [1,0,0,0,0,1|0,0,2]=4 2279 B14R1.468 COCc1cccc(c1)NC[N+](=O)[O-] 34a_100000737370_100000761209 [1,0,0,0,0,1|2,0,0]=4 2280 B14R1.468 COCc1cccc(c1)SCC(=O)N 62a_100000747473_100011493687 [1,0,0,0,0,1|2,0,0]=4 2281 B14R1.468 COCc1cccc(c1)SCC(=O)N 62a_100011493687_100000747473 [1,0,0,0,0,1|2,0,0]=4 2282 B14R1.468 COCc1cccc(c1)SCC(=O)[O-] 62a_100011493687_100020667443 [1,0,0,0,0,1|2,0,0]=4 2283 B14R1.468 COCc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100011493687 [1,0,0,0,0,1|2,0,0]=4 2284 B14R1.6721 COCc1ccc(cc1NC(=O)C)Br 11a_100013084866_100015343762 [0,0,0,0,1,1|1,0,0]=3 2285 B14R1.6721 COCc1ccc(cc1NC(=O)C)Br 1626a_100013084866_100015343762 [0,0,0,0,1,1|1,0,0]=3 2286 B14R1.6721 COCc1ccc(cc1NC(=O)C)Br 22a_100013084866_100000070787 [0,0,0,0,1,1|1,0,0]=3 2287 B14R1.6721 COCc1ccc(cc1NC(=O)C)Br 527a_100013084866_100103153847 [0,0,0,0,1,1|1,0,0]=3 2288 B16R1.13483 C=C(C)CCNc1cc(ccc1Br)COC 34a_200013033220_100000730704 [0,0,0,0,0,2|2,0,0]=4 2289 B16R1.13483 COCc1ccc(c(c1)NCC=C(C)C)Br 34a_200013033220_100000761012 [0,0,0,0,0,2|2,0,0]=4 2290 B16R1.13483 COCc1ccc(c(c1)NCCC(=O)N)Br 34a_200013033220_100000731001 [0,0,0,0,0,2|2,0,0]=4 2291 B16R1.13483 COCc1ccc(c(c1)NCOC(=O)C)Br 34a_200013033220_100009813279 [0,0,0,0,0,2|1,0,0]=3 2292 B16R1.13483 COCc1ccc(c(c1)SCCC(=O)C)C 62a_100000053229_200015395492 [0,0,0,0,0,2|2,0,0]=4 2293 B16R1.13483 COCc1ccc(c(c1)SCCC(=O)C)C 62a_200015395492_100000053229 [0,0,0,0,0,2|2,0,0]=4 2294 B16R1.13483 COCc1ccc(c(c1)SCCC(=O)C)F 62a_100000053229_200011493689 [0,0,0,0,0,2|2,0,0]=4 2295 B16R1.13483 COCc1ccc(c(c1)SCCC(=O)C)F 62a_200011493689_100000053229 [0,0,0,0,0,2|2,0,0]=4 2296 B16R1.13483 COCc1ccc(c(c1)SCOC(=O)C)C 62a_100000076356_200015395492 [0,0,0,0,0,2|2,0,0]=4 2297 B16R1.13483 COCc1ccc(c(c1)SCOC(=O)C)C 62a_200015395492_100000076356 [0,0,0,0,0,2|2,0,0]=4 2298 B16R1.13483 COCc1ccc(c(c1)SCOC(=O)C)F 62a_100000076356_200011493689 [0,0,0,0,0,2|2,0,0]=4 2299 B16R1.13483 COCc1ccc(c(c1)SCOC(=O)C)F 62a_200011493689_100000076356 [0,0,0,0,0,2|2,0,0]=4