0 B23R3.1974194 c1ccc(cc1)C(COC2CCCCC2)c3ccccc3 34a_100011215272_100000210327 [0,0,0,0,0,0|2,0,0]=2 1 B23R3.1974194 c1ccc(cc1)C(COC2CCCCC2)c3ccccc3 7a_100011215272_100000210327 [0,0,0,0,0,0|2,0,0]=2 2 B23R3.1974194 c1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 34a_100000211180_100000211423 [0,0,0,0,0,0|2,0,0]=2 3 B23R3.1974194 c1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 7a_100000211180_100000211423 [0,0,0,0,0,0|2,0,0]=2 4 B23R3.1974194 c1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 7a_100000212181_100011216954 [0,0,0,0,0,0|2,0,0]=2 5 B23R3.1974194 c1ccc(cc1)C(SCC2CCCCO2)c3ccccc3 62a_100000211543_100011216954 [0,0,0,0,0,0|3,0,0]=3 6 B23R3.1974194 c1ccc(cc1)C(SCC2CCCCO2)c3ccccc3 62a_100000211591_100000211543 [0,0,0,0,0,0|3,0,0]=3 7 B24R3.6559 CC(NC(c1ccccc1)c2ccccc2)C3=CCCCC3 2230a_200015185932_100000211591 [0,1,0,0,0,0|2,0,1]=4 8 B24R3.6559 CC(NC(c1ccccc1)c2ccccc2)C3=CCCCC3 270004a_200015185932_100000210122 [0,1,0,0,0,0|2,0,1]=4 9 B24R3.6559 CC(NC(c1ccccc1)c2ccccc2)C3CCCCC3 269862a_100000162943_100000210989 [0,1,0,0,0,0|2,0,0]=3 10 B24R3.6559 CC(OC(c1ccccc1)c2ccccc2)C3CCCCC3 7a_100011216961_100011216954 [0,1,0,0,0,0|2,0,0]=3 11 B24R3.6559 C[C@@H](NC(c1ccccc1)c2ccccc2)C3CCCCC3 2230a_100025707633_100000211591 [0,1,0,0,0,0|2,0,0]=3 12 B24R3.6559 C[C@@H](NC(c1ccccc1)c2ccccc2)C3CCCCC3 270004a_100025707633_100000210122 [0,1,0,0,0,0|2,0,0]=3 13 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)C3CCCCC3 1458a_100000499737_100000210327 [0,1,0,0,0,0|1,0,1]=3 14 B24R3.21177 Brc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 2230a_100011212009_100000211423 [0,1,0,0,0,0|2,0,0]=3 15 B24R3.21177 Brc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 269862a_100011212009_100000211278 [0,1,0,0,0,0|2,0,0]=3 16 B24R3.21177 Brc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011267660 [0,1,0,0,0,0|2,0,0]=3 17 B24R3.21177 Brc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 34a_100011212009_100000211423 [0,1,0,0,0,0|2,0,0]=3 18 B24R3.21177 Brc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 269862a_100011212009_100000067145 [0,1,0,0,0,0|3,0,0]=4 19 B24R3.21177 Brc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 270004a_100011212009_100000067145 [0,1,0,0,0,0|3,0,0]=4 20 B24R3.21177 Brc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100011267660 [0,1,0,0,0,0|3,0,0]=4 21 B24R3.21177 Brc1cncc(c1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011267668 [0,1,0,0,0,0|3,0,0]=4 22 B24R3.21177 Cc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011217825 [0,1,0,0,0,0|2,0,0]=3 23 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 2230a_100000741085_100000211423 [0,1,0,0,0,0|2,0,0]=3 24 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 269862a_100000741085_100000211278 [0,1,0,0,0,0|2,0,0]=3 25 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011215489 [0,1,0,0,0,0|2,0,0]=3 26 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 34a_100000741085_100000211423 [0,1,0,0,0,0|2,0,0]=3 27 B24R3.21177 Clc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 269862a_100000741085_100000067145 [0,1,0,0,0,0|3,0,0]=4 28 B24R3.21177 Clc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 270004a_100000741085_100000067145 [0,1,0,0,0,0|3,0,0]=4 29 B24R3.21177 Clc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100011215489 [0,1,0,0,0,0|3,0,0]=4 30 B24R3.21177 Clc1cccc(c1)C(OCC2CCCCO2)c3ccccc3 34a_100000733576_100000211543 [0,1,0,0,0,0|3,0,0]=4 31 B24R3.21177 Clc1cccc(c1)C(OCC2CCCCO2)c3ccccc3 7a_100000733576_100000211543 [0,1,0,0,0,0|3,0,0]=4 32 B24R3.21177 Fc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 2230a_100000686443_100000211423 [0,1,0,0,0,0|2,0,0]=3 33 B24R3.21177 Fc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 269862a_100000686443_100000211278 [0,1,0,0,0,0|2,0,0]=3 34 B24R3.21177 Fc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_200011219850 [0,1,0,0,0,0|2,0,0]=3 35 B24R3.21177 Fc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 34a_100000686443_100000211423 [0,1,0,0,0,0|2,0,0]=3 36 B24R3.21177 Fc1cccc(c1)C(OCC2CCCCC2)c3ccccc3 34a_100000749007_100000211423 [0,1,0,0,0,0|2,0,0]=3 37 B24R3.21177 Fc1cccc(c1)C(OCC2CCCCC2)c3ccccc3 7a_100000749007_100000211423 [0,1,0,0,0,0|2,0,0]=3 38 B24R3.21837 Brc1ccccc1C(NCC2CCCCC2)c3ccccc3 2230a_100011211563_100000211423 [0,1,0,0,0,0|2,0,0]=3 39 B24R3.21837 Brc1ccccc1C(NCC2CCCCC2)c3ccccc3 269862a_100011211563_100000211278 [0,1,0,0,0,0|2,0,0]=3 40 B24R3.21837 Brc1ccccc1C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000198044 [0,1,0,0,0,0|2,0,0]=3 41 B24R3.21837 Brc1ccccc1C(NCC2CCCCC2)c3ccccc3 34a_100011211563_100000211423 [0,1,0,0,0,0|2,0,0]=3 42 B24R3.21837 Brc1ccccc1C(NCC2CCCCC2)c3cccnc3 270004a_100000210473_100011532686 [0,1,0,0,0,0|3,0,0]=4 43 B24R3.21837 Brc1ccccc1C(NCC2CCSCC2)c3ccccc3 269862a_100011211563_100000067145 [0,1,0,0,0,0|3,0,0]=4 44 B24R3.21837 Brc1ccccc1C(NCC2CCSCC2)c3ccccc3 270004a_100011211563_100000067145 [0,1,0,0,0,0|3,0,0]=4 45 B24R3.21837 Brc1ccccc1C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100000198044 [0,1,0,0,0,0|3,0,0]=4 46 B24R3.21837 Cc1ccccc1C(NCC2CCCCC2)c3ccccc3 2230a_100000210473_100000230135 [0,1,0,0,0,0|2,0,0]=3 47 B24R3.21837 Cc1ccccc1C(NCC2CCCCC2)c3ccccc3 2230a_100000222801_100000211423 [0,1,0,0,0,0|2,0,0]=3 48 B24R3.21837 Cc1ccccc1C(NCC2CCCCC2)c3ccccc3 269862a_100000222801_100000211278 [0,1,0,0,0,0|2,0,0]=3 49 B24R3.21837 Cc1ccccc1C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000735561 [0,1,0,0,0,0|2,0,0]=3 50 B24R3.21837 Cc1ccccc1C(NCC2CCCCC2)c3ccccc3 34a_100000222801_100000211423 [0,1,0,0,0,0|2,0,0]=3 51 B24R3.21837 Cc1ccccc1C(OCC2CCCCC2)c3ccccc3 34a_100000212071_100000211423 [0,1,0,0,0,0|2,0,0]=3 52 B24R3.21837 Cc1ccccc1C(OCC2CCCCC2)c3ccccc3 7a_100000212071_100000211423 [0,1,0,0,0,0|2,0,0]=3 53 B24R3.21837 Cc1ccccc1C(OCC2CCCCC2)c3ccccc3 7a_100000212181_100000230135 [0,1,0,0,0,0|2,0,0]=3 54 B24R3.21837 Cc1ccccc1C(OCC2CCSCC2)c3ccccc3 7a_100000070558_100000230135 [0,1,0,0,0,0|3,0,0]=4 55 B24R3.21837 Cc1ccccc1C(SCC2CCCCO2)c3ccccc3 62a_100000211543_100000230135 [0,1,0,0,0,0|3,0,0]=4 56 B24R3.21837 Cc1ccccc1C(SCC2CCCCO2)c3ccccc3 62a_100000230135_100000211543 [0,1,0,0,0,0|3,0,0]=4 57 B24R3.21837 Cc1ccccc1C(SCC2CCCOC2)c3ccccc3 62a_100000230135_100000741521 [0,1,0,0,0,0|3,0,0]=4 58 B24R3.21837 Cc1ccccc1C(SCC2CCCOC2)c3ccccc3 62a_100000741521_100000230135 [0,1,0,0,0,0|3,0,0]=4 59 B24R3.21837 Cc1ccccc1C(SCC2CCOCC2)c3ccccc3 62a_100000230135_100000749018 [0,1,0,0,0,0|3,0,0]=4 60 B24R3.21837 Cc1ccccc1C(SCC2CCOCC2)c3ccccc3 62a_100000754603_100000230135 [0,1,0,0,0,0|3,0,0]=4 61 B24R3.21837 Clc1ccccc1C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011215288 [0,1,0,0,0,0|2,0,0]=3 62 B24R3.21837 Clc1ccccc1C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100011215288 [0,1,0,0,0,0|3,0,0]=4 63 B24R3.21837 Clc1ccccc1C(OCC2CCCCO2)c3ccccc3 34a_200011400577_100000211543 [0,1,0,0,0,0|3,0,0]=4 64 B24R3.21837 Clc1ccccc1C(OCC2CCCCO2)c3ccccc3 7a_200011400577_100000211543 [0,1,0,0,0,0|3,0,0]=4 65 B24R3.21837 Fc1ccccc1C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011217773 [0,1,0,0,0,0|2,0,0]=3 66 B24R3.35684 CC1CCCCN1CCC(c2ccccc2)c3ccccc3 2230a_100000211376_100009813428 [0,1,0,0,0,0|0,0,0]=1 67 B24R3.35684 CC1CCCCN1CCC(c2ccccc2)c3ccccc3 269982a_100000211376_100009813428 [0,1,0,0,0,0|0,0,0]=1 68 B24R3.35684 CC1CCCCN1CCC(c2ccccc2)c3ccccc3 34a_100000211376_100009813428 [0,1,0,0,0,0|0,0,0]=1 69 B24R3.35684 FC1CCCCC1OCC(c2ccccc2)c3ccccc3 34a_100011215272_100015423560 [0,1,0,0,0,0|2,0,0]=3 70 B24R3.67298 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3 2230a_100000736448_100000211591 [0,1,0,0,0,0|2,0,0]=3 71 B24R3.67298 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_100000211423 [0,1,0,0,0,0|2,0,0]=3 72 B24R3.67298 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3 269982a_100000736448_100000211591 [0,1,0,0,0,0|2,0,0]=3 73 B24R3.67298 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100000211423 [0,1,0,0,0,0|2,0,0]=3 74 B24R3.67298 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3 270004a_100000736448_100000210122 [0,1,0,0,0,0|2,0,0]=3 75 B24R3.67298 O=C(C=C1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000743792_100011216954 [0,1,0,0,0,0|1,0,2]=4 76 B24R3.67298 O=C(CC1=CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000039269_100011216954 [0,1,0,0,0,0|1,0,2]=4 77 B24R3.67298 O=C(CC1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100000211423 [0,1,0,0,0,0|1,0,1]=3 78 B24R3.67298 O=C(CC1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000211666_100011216954 [0,1,0,0,0,0|1,0,1]=3 79 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 2230a_100000745999_100000211423 [0,1,0,0,0,0|2,0,0]=3 80 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 269862a_100000745999_100000211278 [0,1,0,0,0,0|2,0,0]=3 81 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000718703 [0,1,0,0,0,0|2,0,0]=3 82 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 34a_100000745999_100000211423 [0,1,0,0,0,0|2,0,0]=3 83 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCC2)c3ccccn3 270004a_100000210473_200010179208 [0,1,0,0,0,0|3,0,0]=4 84 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCC2)c3cccnc3 270004a_100000210473_100000753996 [0,1,0,0,0,0|3,0,0]=4 85 B24R3.89641 Brc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 269862a_100000745999_100000067145 [0,1,0,0,0,0|3,0,0]=4 86 B24R3.89641 Brc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100000745999_100000067145 [0,1,0,0,0,0|3,0,0]=4 87 B24R3.89641 Brc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100000718703 [0,1,0,0,0,0|3,0,0]=4 88 B24R3.89641 Brc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 34a_100011217567_100000211543 [0,1,0,0,0,0|3,0,0]=4 89 B24R3.89641 Brc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 7a_100011217567_100000211543 [0,1,0,0,0,0|3,0,0]=4 90 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 2230a_100000736602_100000211423 [0,1,0,0,0,0|2,0,0]=3 91 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 269862a_100000736602_100000211278 [0,1,0,0,0,0|2,0,0]=3 92 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000210966 [0,1,0,0,0,0|2,0,0]=3 93 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 34a_100000736602_100000211423 [0,1,0,0,0,0|2,0,0]=3 94 B24R3.89641 Cc1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 34a_100000212064_100000211423 [0,1,0,0,0,0|2,0,0]=3 95 B24R3.89641 Cc1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 7a_100000212064_100000211423 [0,1,0,0,0,0|2,0,0]=3 96 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 2230a_100000210473_100000211669 [0,1,0,0,0,0|2,0,0]=3 97 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 2230a_100000737946_100000211423 [0,1,0,0,0,0|2,0,0]=3 98 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 269862a_100000737946_100000211278 [0,1,0,0,0,0|2,0,0]=3 99 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000211064 [0,1,0,0,0,0|2,0,0]=3 100 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 34a_100000737946_100000211423 [0,1,0,0,0,0|2,0,0]=3 101 B24R3.89641 Clc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 2230a_100015188806_100000211669 [0,1,0,0,0,0|3,0,0]=4 102 B24R3.89641 Clc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 269862a_100000737946_100000067145 [0,1,0,0,0,0|3,0,0]=4 103 B24R3.89641 Clc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100000737946_100000067145 [0,1,0,0,0,0|3,0,0]=4 104 B24R3.89641 Clc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100000211064 [0,1,0,0,0,0|3,0,0]=4 105 B24R3.89641 Clc1ccc(cc1)C(OCC2CCCCC2)c3ccccn3 34a_100000242608_100000211423 [0,1,0,0,0,0|3,0,0]=4 106 B24R3.89641 Clc1ccc(cc1)C(OCC2CCCCC2)c3ccccn3 7a_100000212181_200010188304 [0,1,0,0,0,0|3,0,0]=4 107 B24R3.89641 Clc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 34a_100000211768_100000211543 [0,1,0,0,0,0|3,0,0]=4 108 B24R3.89641 Clc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 7a_100000211370_100000211669 [0,1,0,0,0,0|3,0,0]=4 109 B24R3.89641 Clc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 7a_100000211768_100000211543 [0,1,0,0,0,0|3,0,0]=4 110 B24R3.89641 Clc1ccc(cc1)C(OCC2CCSCC2)c3ccccc3 7a_100000070558_100000211669 [0,1,0,0,0,0|3,0,0]=4 111 B24R3.89641 Clc1ccc(cc1)C(SCC2CCCCO2)c3ccccc3 62a_100000211543_100000211669 [0,1,0,0,0,0|3,0,0]=4 112 B24R3.89641 Clc1ccc(cc1)C(SCC2CCCCO2)c3ccccc3 62a_100000211669_100000211543 [0,1,0,0,0,0|3,0,0]=4 113 B24R3.89641 Clc1ccc(cc1)C(SCC2CCCOC2)c3ccccc3 62a_100000211669_100000741521 [0,1,0,0,0,0|3,0,0]=4 114 B24R3.89641 Clc1ccc(cc1)C(SCC2CCCOC2)c3ccccc3 62a_100000741521_100000211669 [0,1,0,0,0,0|3,0,0]=4 115 B24R3.89641 Clc1ccc(cc1)C(SCC2CCOCC2)c3ccccc3 62a_100000211669_100000749018 [0,1,0,0,0,0|3,0,0]=4 116 B24R3.89641 Clc1ccc(cc1)C(SCC2CCOCC2)c3ccccc3 62a_100000754603_100000211669 [0,1,0,0,0,0|3,0,0]=4 117 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 2230a_100000737529_100000211423 [0,1,0,0,0,0|2,0,0]=3 118 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 269862a_100000737529_100000211278 [0,1,0,0,0,0|2,0,0]=3 119 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000210425 [0,1,0,0,0,0|2,0,0]=3 120 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 34a_100000737529_100000211423 [0,1,0,0,0,0|2,0,0]=3 121 B24R3.89641 Fc1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 34a_200000246460_100000211423 [0,1,0,0,0,0|2,0,0]=3 122 B24R3.89641 Fc1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 7a_200000246460_100000211423 [0,1,0,0,0,0|2,0,0]=3 123 B24R3.89720 CC1CCC(CC1)CNC(c2ccccc2)c3ccccc3 2230a_103436935547_100000211591 [0,1,0,0,0,0|2,0,0]=3 124 B24R3.89720 CC1CCC(CC1)CNC(c2ccccc2)c3ccccc3 270004a_103436935547_100000210122 [0,1,0,0,0,0|2,0,0]=3 125 B24R3.89720 CC1CCC(CC1)OCC(c2ccccc2)c3ccccc3 34a_100011215272_200011216234 [0,1,0,0,0,0|2,0,0]=3 126 B24R3.1994292 CC(OCC1CCCCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100000211423 [0,1,0,0,0,0|2,0,0]=3 127 B24R3.14922733 CC1(CCCCC1)CNC(c2ccccc2)c3ccccc3 2230a_100000706052_100000211591 [0,1,0,0,0,0|2,0,0]=3 128 B24R3.14922733 CC1(CCCCC1)CNC(c2ccccc2)c3ccccc3 269862a_100000162943_100011935227 [0,1,0,0,0,0|2,0,0]=3 129 B24R3.14922733 CC1(CCCCC1)CNC(c2ccccc2)c3ccccc3 270004a_100000706052_100000210122 [0,1,0,0,0,0|2,0,0]=3 130 B24R3.14922733 CC1(CCCCC1)COC(c2ccccc2)c3ccccc3 7a_100000688186_100011216954 [0,1,0,0,0,0|2,0,0]=3 131 B24R3.14922733 FC1(CCCCC1)COC(c2ccccc2)c3ccccc3 7a_100000090305_100011216954 [0,1,0,0,0,0|2,0,0]=3 132 B22R2.15786 BrCCCCCCOC(c1ccccc1)c2ccccc2 7a_100011215345_100011216954 [0,0,1,0,0,0|3,0,0]=4 133 B22R2.15786 BrCCCCOCCC(c1ccccc1)c2ccccc2 34a_100011216708_100009813428 [0,0,1,0,0,0|2,0,0]=3 134 B22R2.15786 C#CCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011215417 [0,0,1,0,0,0|1,0,2]=4 135 B22R2.15786 C#CCCCSCCC(c1ccccc1)c2ccccc2 62a_100011215417_100009813428 [0,0,1,0,0,0|1,0,2]=4 136 B22R2.15786 C/C=C/CCOCCC(c1ccccc1)c2ccccc2 34a_100016278192_100009813428 [0,0,1,0,0,0|1,0,2]=4 137 B22R2.15786 C=CCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000757094 [0,0,1,0,0,0|1,0,2]=4 138 B22R2.15786 C=CCCCOCCC(c1ccccc1)c2ccccc2 34a_100000758997_100009813428 [0,0,1,0,0,0|1,0,2]=4 139 B22R2.15786 C=CCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000757094 [0,0,1,0,0,0|1,0,2]=4 140 B22R2.15786 C=CCCCOCCC(c1ccccc1)c2ccccc2 7a_100000758997_100009813428 [0,0,1,0,0,0|1,0,2]=4 141 B22R2.15786 C=CCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000757094 [0,0,1,0,0,0|1,0,2]=4 142 B22R2.15786 C=CCCCSCCC(c1ccccc1)c2ccccc2 62a_100011713584_100009813428 [0,0,1,0,0,0|1,0,2]=4 143 B22R2.15786 CC/C=C\COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100103147603 [0,0,1,0,0,0|1,0,2]=4 144 B22R2.15786 CC/C=C\COCCC(c1ccccc1)c2ccccc2 34a_100016268518_100009813428 [0,0,1,0,0,0|1,0,2]=4 145 B22R2.15786 CC/C=C\COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100103147603 [0,0,1,0,0,0|1,0,2]=4 146 B22R2.15786 CC/C=C\CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100103147603 [0,0,1,0,0,0|1,0,2]=4 147 B22R2.15786 CC/C=C\CSCCC(c1ccccc1)c2ccccc2 62a_100103147603_100009813428 [0,0,1,0,0,0|1,0,2]=4 148 B22R2.15786 CCC#CCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100009813939 [0,0,1,0,0,0|1,0,2]=4 149 B22R2.15786 CCC#CCSCCC(c1ccccc1)c2ccccc2 62a_100009813939_100009813428 [0,0,1,0,0,0|1,0,2]=4 150 B22R2.15786 CCCC/C=C/COC(c1ccccc1)c2ccccc2 7a_200016272032_100011216954 [0,0,1,0,0,0|2,0,1]=4 151 B22R2.15786 CCCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210681 [0,0,1,0,0,0|2,0,0]=3 152 B22R2.15786 CCCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000229938_100000211591 [0,0,1,0,0,0|2,0,0]=3 153 B22R2.15786 CCCCCCCNC(c1ccccc1)c2ccccc2 270004a_100000229938_100000210122 [0,0,1,0,0,0|2,0,0]=3 154 B22R2.15786 CCCCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210614 [0,0,1,0,0,0|2,0,0]=3 155 B22R2.15786 CCCCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000210614 [0,0,1,0,0,0|2,0,0]=3 156 B22R2.15786 CCCCCCCOC(c1ccccc1)c2ccccc2 7a_100000210272_100011216954 [0,0,1,0,0,0|2,0,0]=3 157 B22R2.15786 CCCCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000210614 [0,0,1,0,0,0|2,0,0]=3 158 B22R2.15786 CCCCCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000210614 [0,0,1,0,0,0|3,0,0]=4 159 B22R2.15786 CCCCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000210314 [0,0,1,0,0,0|2,0,0]=3 160 B22R2.15786 CCCCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210314 [0,0,1,0,0,0|2,0,0]=3 161 B22R2.15786 CCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000718602 [0,0,1,0,0,0|1,0,0]=2 162 B22R2.15786 CCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000210253_100009813428 [0,0,1,0,0,0|1,0,0]=2 163 B22R2.15786 CCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000210326 [0,0,1,0,0,0|1,0,0]=2 164 B22R2.15786 CCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000210253_100009813428 [0,0,1,0,0,0|1,0,0]=2 165 B22R2.15786 CCCCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000718602 [0,0,1,0,0,0|2,0,0]=3 166 B22R2.15786 CCCCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000210326 [0,0,1,0,0,0|2,0,0]=3 167 B22R2.15786 CCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000210326_100010140906 [0,0,1,0,0,0|2,0,0]=3 168 B22R2.15786 CCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000210326 [0,0,1,0,0,0|2,0,0]=3 169 B22R2.15786 CCCCOCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000743108 [0,0,1,0,0,0|3,0,0]=4 170 B22R2.15786 CCCCOCCSC(c1ccccc1)c2ccccc2 62a_100000743108_100011216954 [0,0,1,0,0,0|3,0,0]=4 171 B22R2.15786 CCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000210211_100000734929 [0,0,1,0,0,0|3,0,0]=4 172 B22R2.15786 CCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000210210 [0,0,1,0,0,0|3,0,0]=4 173 B22R2.15786 CCCCSCCOC(c1ccccc1)c2ccccc2 7a_200000230436_100011216954 [0,0,1,0,0,0|3,0,0]=4 174 B22R2.15786 CCSCCSCCC(c1ccccc1)c2ccccc2 62a_100000757381_100009813428 [0,0,1,0,0,0|2,0,0]=3 175 B22R2.15786 CCSCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000757381 [0,0,1,0,0,0|2,0,0]=3 176 B22R2.15786 CCSCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000757381_100010140906 [0,0,1,0,0,0|3,0,0]=4 177 B22R2.15786 CCSCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000757381 [0,0,1,0,0,0|3,0,0]=4 178 B22R2.15786 ClCCCCCCOC(c1ccccc1)c2ccccc2 7a_100000766143_100011216954 [0,0,1,0,0,0|3,0,0]=4 179 B22R2.15786 ClCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000210776_100009813428 [0,0,1,0,0,0|2,0,0]=3 180 B22R2.15786 ClCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000210776_100009813428 [0,0,1,0,0,0|2,0,0]=3 181 B22R2.15786 FCCCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100015922095 [0,0,1,0,0,0|3,0,0]=4 182 B22R2.15786 FCCCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100015922095 [0,0,1,0,0,0|3,0,0]=4 183 B22R2.15786 FCCCCCCOC(c1ccccc1)c2ccccc2 7a_100000732779_100011216954 [0,0,1,0,0,0|3,0,0]=4 184 B22R2.15786 FCCCCSCCC(c1ccccc1)c2ccccc2 62a_100000729493_100009813428 [0,0,1,0,0,0|2,0,0]=3 185 B22R2.15786 FCCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000729493 [0,0,1,0,0,0|2,0,0]=3 186 B22R2.15786 FCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000729493_100010140906 [0,0,1,0,0,0|3,0,0]=4 187 B22R2.15786 FCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000729493 [0,0,1,0,0,0|3,0,0]=4 188 B22R2.15786 ICCCCOCCC(c1ccccc1)c2ccccc2 34a_200012148704_100009813428 [0,0,1,0,0,0|2,0,0]=3 189 B22R2.15786 N#CCCCSCCC(c1ccccc1)c2ccccc2 62a_100000687738_100009813428 [0,0,1,0,0,0|2,0,1]=4 190 B22R2.15786 N#CCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000687738 [0,0,1,0,0,0|2,0,1]=4 191 B22R2.15786 OCCCCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000766143 [0,0,1,0,0,0|3,0,0]=4 192 B22R2.15786 OCCCCCCSC(c1ccccc1)c2ccccc2 62a_100000766143_100011216954 [0,0,1,0,0,0|3,0,0]=4 193 B22R2.150464 CCCCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000210183_100009813428 [0,0,1,0,0,0|2,0,0]=3 194 B22R2.150464 CCCCC(=O)CSC(c1ccccc1)c2ccccc2 1458a_100000683935_100000210211 [0,0,1,0,0,0|3,0,0]=4 195 B22R2.150464 CCCCC(C)COC(c1ccccc1)c2ccccc2 7a_100011995851_100011216954 [0,0,1,0,0,0|2,0,0]=3 196 B22R2.150464 CCCCC(C)OCC(c1ccccc1)c2ccccc2 34a_100011215272_200011215066 [0,0,1,0,0,0|2,0,0]=3 197 B22R2.150464 CCCCC(C)OCC(c1ccccc1)c2ccccc2 7a_100011215272_200011215066 [0,0,1,0,0,0|2,0,0]=3 198 B22R2.718999 CCCC(CC)OCC(c1ccccc1)c2ccccc2 7a_100011215272_100011219200 [0,0,1,0,0,0|2,0,0]=3 199 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2COC4CCCCC4 34a_100011215202_100000210327 [0,0,0,1,0,0|2,0,0]=3 200 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2COC4CCCCC4 7a_100011215202_100000210327 [0,0,0,1,0,0|2,0,0]=3 201 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2OCC4CCCCC4 7a_100000211495_100000211423 [0,0,0,1,0,0|2,0,0]=3 202 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2OCC4CCCCC4 7a_100000212181_100000211598 [0,0,0,1,0,0|2,0,0]=3 203 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2SCC4CCCCO4 62a_100000211598_100000211543 [0,0,0,1,0,0|3,0,0]=4 204 B24R4.1586265 c1ccc(cc1)C(SC2C3CCC2CC3)c4ccccc4 62a_100000211591_100009813300 [0,0,0,1,0,0|2,0,0]=3 205 B24R4.1586265 c1ccc(cc1)C(SC2C3CCC2CC3)c4ccccc4 62a_100009813300_100011216954 [0,0,0,1,0,0|2,0,0]=3 206 B22R3.3728 c1ccc(cc1)C(OC2CCCCC2)c3ccccc3 34a_100000211180_100000210327 [0,0,0,0,1,0|2,0,0]=3 207 B22R3.3728 c1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_100000210231_100011216954 [0,0,0,0,1,0|2,0,0]=3 208 B22R3.3728 c1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_100000211180_100000210327 [0,0,0,0,1,0|2,0,0]=3 209 B22R3.3728 c1ccc(cc1)C(SC2CCCCC2)c3ccccc3 62a_100000210327_100011216954 [0,0,0,0,1,0|2,0,0]=3 210 B22R3.3728 c1ccc(cc1)C(SC2CCCCC2)c3ccccc3 62a_100000211591_100000210327 [0,0,0,0,1,0|2,0,0]=3 211 B22R3.3728 c1ccc(cc1)C(SC2CCSCC2)c3ccccc3 62a_100000211591_100000069128 [0,0,0,0,1,0|3,0,0]=4 212 B22R3.74155 c1ccc(cc1)C(NCC2CCCCC2)c3cccs3 2230a_100025760362_100000211423 [0,0,0,0,1,0|3,0,0]=4 213 B22R3.74155 c1ccc(cc1)C(NCC2CCCCC2)c3cccs3 269862a_100025760362_100000211278 [0,0,0,0,1,0|3,0,0]=4 214 B22R3.74155 c1ccc(cc1)C(NCC2CCCCC2)c3cccs3 270004a_100000210473_100011214959 [0,0,0,0,1,0|3,0,0]=4 215 B22R3.74155 c1ccc(cc1)C(NCC2CCCCC2)c3cccs3 34a_100025760362_100000211423 [0,0,0,0,1,0|3,0,0]=4 216 B22R3.74289 c1ccc(cc1)C(SCC2CCCC2)c3ccccc3 62a_100000211591_100000740388 [0,0,0,0,1,0|2,0,0]=3 217 B22R3.74289 c1ccc(cc1)C(SCC2CCCC2)c3ccccc3 62a_100000740388_100011216954 [0,0,0,0,1,0|2,0,0]=3 218 B24R3.5775 c1ccc(cc1)CC(NCC2CCCCC2)c3ccccc3 2230a_100025772854_100000211423 [0,0,0,0,0,1|2,0,0]=3 219 B24R3.5775 c1ccc(cc1)CC(NCC2CCCCC2)c3ccccc3 269862a_100025772854_100000211278 [0,0,0,0,0,1|2,0,0]=3 220 B24R3.5775 c1ccc(cc1)CC(OCC2CCCCC2)c3ccccc3 34a_100000246494_100000211423 [0,0,0,0,0,1|2,0,0]=3 221 B24R3.5775 c1ccc(cc1)CC(OCC2CCCCC2)c3ccccc3 7a_100000246494_100000211423 [0,0,0,0,0,1|2,0,0]=3 222 B24R3.5775 c1ccc(cc1)CN(CCC2CCCCC2)c3ccccc3 2230a_100000188819_100012355289 [0,0,0,0,0,1|2,0,0]=3 223 B24R3.5775 c1ccc(cc1)CN(CCC2CCCCC2)c3ccccc3 269982a_100000188819_100011273959 [0,0,0,0,0,1|2,0,0]=3 224 B24R3.5775 c1ccc(cc1)CN(CCC2CCCCC2)c3ccccc3 34a_100000188819_100011209188 [0,0,0,0,0,1|2,0,0]=3 225 B24R3.5775 c1ccc(cc1)CN(COC2CCCCC2)c3ccccc3 2230a_100000188819_100011935260 [0,0,0,0,0,1|3,0,0]=4 226 B24R3.5775 c1ccc(cc1)CN(COC2CCCCC2)c3ccccc3 269982a_100000188819_100011935260 [0,0,0,0,0,1|3,0,0]=4 227 B24R3.5775 c1ccc(cc1)CN(COC2CCCCC2)c3ccccc3 34a_100000188819_100011935260 [0,0,0,0,0,1|3,0,0]=4 228 B24R3.5791 C(=C(c1ccccc1)c2ccccc2)CNC3CCCCC3 270004a_100000182618_100000050448 [0,0,0,0,0,1|1,0,2]=4 229 B24R3.5791 C1=C(CCCC1)CCNC(c2ccccc2)c3ccccc3 2230a_100000212019_100000211591 [0,0,0,0,0,1|1,0,1]=3 230 B24R3.5791 C1=C(CCCC1)CCNC(c2ccccc2)c3ccccc3 270004a_100000212019_100000210122 [0,0,0,0,0,1|1,0,1]=3 231 B24R3.5791 C1=CC(CCC1)OCCC(c2ccccc2)c3ccccc3 34a_100011215024_100009813428 [0,0,0,0,0,1|1,0,2]=4 232 B24R3.5791 C1=CC(CCC1)OCCC(c2ccccc2)c3ccccc3 7a_100000032380_100000751183 [0,0,0,0,0,1|1,0,2]=4 233 B24R3.5791 C1=CCC(CC1)OCCC(c2ccccc2)c3ccccc3 34a_100000073881_100009813428 [0,0,0,0,0,1|1,0,2]=4 234 B24R3.5791 c1ccc(cc1)C(CCNC2CCCCC2)c3ccccc3 2230a_100000182618_100009813428 [0,0,0,0,0,1|1,0,0]=2 235 B24R3.5791 c1ccc(cc1)C(CCNC2CCCCC2)c3ccccc3 270004a_100000272388_100000210434 [0,0,0,0,0,1|1,0,0]=2 236 B24R3.5791 c1ccc(cc1)C(CCNC2CCCCC2)c3ccccc3 34a_100000182618_100009813428 [0,0,0,0,0,1|1,0,0]=2 237 B24R3.5791 c1ccc(cc1)C(CCNC2CCCCC2)c3ccccc3 34a_100000272388_100000210327 [0,0,0,0,0,1|1,0,0]=2 238 B24R3.5791 c1ccc(cc1)C(CCOC2CCCCC2)c3ccccc3 34a_100000032380_100000210327 [0,0,0,0,0,1|1,0,0]=2 239 B24R3.5791 c1ccc(cc1)C(CCOC2CCCCC2)c3ccccc3 34a_100000210231_100009813428 [0,0,0,0,0,1|1,0,0]=2 240 B24R3.5791 c1ccc(cc1)C(CCOC2CCCCC2)c3ccccc3 7a_100000032380_100000210327 [0,0,0,0,0,1|1,0,0]=2 241 B24R3.5791 c1ccc(cc1)C(CCOC2CCCCC2)c3ccccc3 7a_100000210231_100009813428 [0,0,0,0,0,1|1,0,0]=2 242 B24R3.5791 c1ccc(cc1)C(CCOC2CCCSC2)c3ccccc3 7a_100015962668_100009813428 [0,0,0,0,0,1|2,0,0]=3 243 B24R3.5791 c1ccc(cc1)C(CCOC2CCSCC2)c3ccccc3 34a_100000032380_100000069128 [0,0,0,0,0,1|2,0,0]=3 244 B24R3.5791 c1ccc(cc1)C(CCOC2CCSCC2)c3ccccc3 34a_100000731022_100009813428 [0,0,0,0,0,1|2,0,0]=3 245 B24R3.5791 c1ccc(cc1)C(CCOC2CCSCC2)c3ccccc3 7a_100000032380_100011500858 [0,0,0,0,0,1|2,0,0]=3 246 B24R3.5791 c1ccc(cc1)C(CCOC2CCSCC2)c3ccccc3 7a_100000731022_100009813428 [0,0,0,0,0,1|2,0,0]=3 247 B24R3.5791 c1ccc(cc1)C(CCSC2CCCOC2)c3ccccc3 62a_100009813428_100000693364 [0,0,0,0,0,1|2,0,0]=3 248 B24R3.5791 c1ccc(cc1)C(CCSC2CCOCC2)c3ccccc3 62a_100009813428_100011324220 [0,0,0,0,0,1|2,0,0]=3 249 B24R3.5791 c1ccc(cc1)C(CCSC2CCSCC2)c3ccccc3 62a_100009813428_100000069128 [0,0,0,0,0,1|2,0,0]=3 250 B24R3.5791 c1ccc(cc1)C(COCC2CCCCC2)c3ccccc3 34a_100011215272_100000211423 [0,0,0,0,0,1|1,0,0]=2 251 B24R3.5791 c1ccc(cc1)C(COCC2CCCCC2)c3ccccc3 7a_100011215272_100000211423 [0,0,0,0,0,1|1,0,0]=2 252 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000162943_100012355289 [0,0,0,0,0,1|1,0,0]=2 253 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000738074_100000211591 [0,0,0,0,0,1|1,0,0]=2 254 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000162943_100011713444 [0,0,0,0,0,1|1,0,0]=2 255 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100000210122 [0,0,0,0,0,1|1,0,0]=2 256 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 34a_100000162943_100011209188 [0,0,0,0,0,1|1,0,0]=2 257 B24R3.5791 c1ccc(cc1)C(OCCC2CCCCC2)c3ccccc3 34a_100000211180_100011209188 [0,0,0,0,0,1|1,0,0]=2 258 B24R3.5791 c1ccc(cc1)C(OCCC2CCCCC2)c3ccccc3 7a_100000211180_100011273959 [0,0,0,0,0,1|1,0,0]=2 259 B24R3.5791 c1ccc(cc1)C(OCCC2CCCCC2)c3ccccc3 7a_100011217863_100011216954 [0,0,0,0,0,1|1,0,0]=2 260 B24R3.5791 c1ccc(cc1)C(OCCC2CCCCC2)c3ccccn3 7a_100000180852_100011273959 [0,0,0,0,0,1|2,0,0]=3 261 B24R3.5791 c1ccc(cc1)C(OCCC2SCCCS2)c3ccccc3 7a_200011025297_100011216954 [0,0,0,0,0,1|3,0,0]=4 262 B24R3.5791 c1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 34a_100000211180_100011935260 [0,0,0,0,0,1|2,0,0]=3 263 B24R3.5791 c1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 7a_100000211180_100011935260 [0,0,0,0,0,1|2,0,0]=3 264 B24R3.5791 c1ccc(cc1)C(SCCC2CCOCC2)c3ccccc3 62a_100000211591_100011934994 [0,0,0,0,0,1|2,0,0]=3 265 B24R3.5791 c1ccc(cc1)C(SCCC2CCOCC2)c3ccccc3 62a_100011934994_100011216954 [0,0,0,0,0,1|2,0,0]=3 266 B24R3.5791 c1ccc(cc1)C(SCCN2CCCCC2)c3ccccc3 62a_100000211591_100000739454 [0,0,0,0,0,1|0,0,0]=1 267 B24R3.5791 c1ccc(cc1)C(SCCN2CCCCC2)c3ccccc3 62a_100000739454_100011216954 [0,0,0,0,0,1|0,0,0]=1 268 B24R3.5791 c1ccc(cc1)C(SCOC2CCCCC2)c3ccccc3 62a_100000211591_100011935260 [0,0,0,0,0,1|2,0,0]=3 269 B24R3.5791 c1ccc(cc1)C(SCOC2CCCCC2)c3ccccc3 62a_100011935260_100011216954 [0,0,0,0,0,1|2,0,0]=3 270 B24R3.5791 c1ccc(cc1)N(CCOC2CCCCC2)c3ccccc3 34a_100010001939_100000210327 [0,0,0,0,0,1|2,0,0]=3 271 B24R3.5791 c1ccc(cc1)N(CCOC2CCCCC2)c3ccccc3 7a_100010001939_100000210327 [0,0,0,0,0,1|2,0,0]=3 272 B24R3.5791 c1ccc(cc1)[S+](CCOC2CCCCC2)c3ccccc3 7a_100000210231_100010140906 [0,0,0,0,0,1|2,0,0]=3 273 B24R3.5791 c1ccc(cc1)[S+](CCSC2CCCCC2)c3ccccc3 62a_100000210327_100010140906 [0,0,0,0,0,1|2,0,0]=3 274 B24R3.5791 c1ccc(cc1)[S+](CCSC2CCCCC2)c3ccccc3 62a_100010140906_100000210327 [0,0,0,0,0,1|2,0,0]=3 275 B24R3.5791 c1ccc(cc1)[S+](CCSC2CCSCC2)c3ccccc3 62a_100010140906_100000069128 [0,0,0,0,0,1|3,0,0]=4 276 B24R3.3681135 c1ccc(cc1)C(CCN2CCCCCC2)c3ccccc3 2230a_100000185865_100009813428 [0,0,0,0,0,1|0,0,0]=1 277 B24R3.3681135 c1ccc(cc1)C(CCN2CCCCCC2)c3ccccc3 269982a_100000185865_100009813428 [0,0,0,0,0,1|0,0,0]=1 278 B24R3.3681135 c1ccc(cc1)C(CCN2CCCCCC2)c3ccccc3 34a_100000185865_100009813428 [0,0,0,0,0,1|0,0,0]=1 279 B24R3.3681135 c1ccc(cc1)C(CNC2CCCCCC2)c3ccccc3 270004a_100000739227_100000210131 [0,0,0,0,0,1|2,0,0]=3 280 B24R3.3681135 c1ccc(cc1)C(CNC2CCCCCC2)c3ccccc3 34a_100000739227_100011217769 [0,0,0,0,0,1|2,0,0]=3 281 B24R3.3681135 c1ccc(cc1)C(COC2CCCCCC2)c3ccccc3 34a_100011215272_100011217769 [0,0,0,0,0,1|2,0,0]=3 282 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 2230a_100000162943_200000696569 [0,0,0,0,0,1|2,0,0]=3 283 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 2230a_100015204231_100000211591 [0,0,0,0,0,1|2,0,0]=3 284 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 269862a_100000162943_200000763224 [0,0,0,0,0,1|2,0,0]=3 285 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100000210122 [0,0,0,0,0,1|2,0,0]=3 286 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 34a_100000162943_200000696569 [0,0,0,0,0,1|2,0,0]=3 287 B24R3.3681135 c1ccc(cc1)C(OCC2CCCCCC2)c3ccccc3 34a_100000211180_200000696569 [0,0,0,0,0,1|2,0,0]=3 288 B24R3.3681135 c1ccc(cc1)C(OCC2CCCCCC2)c3ccccc3 7a_100000211180_200000696569 [0,0,0,0,0,1|2,0,0]=3 289 B24R3.3681135 c1ccc(cc1)C(OCC2CCCCCC2)c3ccccc3 7a_100000699130_100011216954 [0,0,0,0,0,1|2,0,0]=3 290 B24R3.3681135 c1ccc(cc1)C(OCC2CCCCCC2)c3ccccn3 7a_100000180852_200000696569 [0,0,0,0,0,1|3,0,0]=4 291 B21R2.2905 BrCCCCCOC(c1ccccc1)c2ccccc2 7a_100000746331_100011216954 [1,0,1,0,0,0|2,0,0]=4 292 B21R2.2905 BrCCCOCCC(c1ccccc1)c2ccccc2 34a_100011217188_100009813428 [1,0,1,0,0,0|2,0,0]=4 293 B21R2.2905 CCCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000210314 [1,0,1,0,0,0|1,0,0]=3 294 B21R2.2905 CCCCCCOC(c1ccccc1)c2ccccc2 7a_100000210259_100011216954 [1,0,1,0,0,0|1,0,0]=3 295 B21R2.2905 CCCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000210314 [1,0,1,0,0,0|1,0,0]=3 296 B21R2.2905 CCCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000718602 [1,0,1,0,0,0|1,0,0]=3 297 B21R2.2905 CCCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210326 [1,0,1,0,0,0|1,0,0]=3 298 B21R2.2905 CCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000210210 [1,0,1,0,0,0|1,0,0]=3 299 B21R2.2905 CCCCOCCC(c1ccccc1)c2ccccc2 34a_100000210227_100009813428 [1,0,1,0,0,0|1,0,0]=3 300 B21R2.2905 CCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000210211 [1,0,1,0,0,0|1,0,0]=3 301 B21R2.2905 CCCCOCCC(c1ccccc1)c2ccccc2 7a_100000210227_100009813428 [1,0,1,0,0,0|1,0,0]=3 302 B21R2.2905 CCCCOCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011995733 [1,0,1,0,0,0|2,0,0]=4 303 B21R2.2905 CCCCOCSC(c1ccccc1)c2ccccc2 62a_100011995733_100011216954 [1,0,1,0,0,0|2,0,0]=4 304 B21R2.2905 CCCCSCCC(c1ccccc1)c2ccccc2 62a_100000210211_100009813428 [1,0,1,0,0,0|1,0,0]=3 305 B21R2.2905 CCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000210210 [1,0,1,0,0,0|1,0,0]=3 306 B21R2.2905 CCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000210211_100010140906 [1,0,1,0,0,0|2,0,0]=4 307 B21R2.2905 CCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000210210 [1,0,1,0,0,0|2,0,0]=4 308 B21R2.2905 CSCCSCCC(c1ccccc1)c2ccccc2 62a_100000212216_100009813428 [1,0,1,0,0,0|2,0,0]=4 309 B21R2.2905 CSCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000751147 [1,0,1,0,0,0|2,0,0]=4 310 B21R2.2905 ClCCCCCOC(c1ccccc1)c2ccccc2 7a_100000746330_100011216954 [1,0,1,0,0,0|2,0,0]=4 311 B21R2.2905 FCCCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000729378 [1,0,1,0,0,0|2,0,0]=4 312 B21R2.2905 FCCCCCSC(c1ccccc1)c2ccccc2 62a_100000729378_100011216954 [1,0,1,0,0,0|2,0,0]=4 313 B21R2.2905 FCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011934791 [1,0,1,0,0,0|2,0,0]=4 314 B21R2.2905 FCCCSCCC(c1ccccc1)c2ccccc2 62a_100011934791_100009813428 [1,0,1,0,0,0|2,0,0]=4 315 B21R2.2905 ICCCCCOC(c1ccccc1)c2ccccc2 7a_200012148887_100011216954 [1,0,1,0,0,0|2,0,0]=4 316 B21R2.541 CCCC(C)COC(c1ccccc1)c2ccccc2 34a_100000211180_100011216630 [1,0,1,0,0,0|2,0,0]=4 317 B21R2.541 CCCC(C)COC(c1ccccc1)c2ccccc2 7a_100000211180_100011216630 [1,0,1,0,0,0|2,0,0]=4 318 B21R2.541 CCCC(C)COC(c1ccccc1)c2ccccc2 7a_100000688023_100011216954 [1,0,1,0,0,0|2,0,0]=4 319 B21R2.541 CCCC(C)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100011216630 [1,0,1,0,0,0|2,0,0]=4 320 B21R2.541 CCCC(C)CSC(c1ccccc1)c2ccccc2 62a_100011216630_100011216954 [1,0,1,0,0,0|2,0,0]=4 321 B21R2.541 CCCC(C)OCC(c1ccccc1)c2ccccc2 34a_100011215272_100000766640 [1,0,1,0,0,0|2,0,0]=4 322 B21R2.541 CCCC(C)OCC(c1ccccc1)c2ccccc2 7a_100011215272_100000766640 [1,0,1,0,0,0|2,0,0]=4 323 B21R2.289104 CCC(CC)COC(c1ccccc1)c2ccccc2 34a_100000211180_100011215472 [1,0,1,0,0,0|2,0,0]=4 324 B21R2.289104 CCC(CC)COC(c1ccccc1)c2ccccc2 7a_100000211180_100011215472 [1,0,1,0,0,0|2,0,0]=4 325 B21R2.289104 CCC(CC)COC(c1ccccc1)c2ccccc2 7a_100000703878_100011216954 [1,0,1,0,0,0|2,0,0]=4 326 B21R2.289104 CCC(CC)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100011215472 [1,0,1,0,0,0|2,0,0]=4 327 B21R2.289104 CCC(CC)CSC(c1ccccc1)c2ccccc2 62a_100011215472_100011216954 [1,0,1,0,0,0|2,0,0]=4 328 B21R2.289104 CCC(CC)OCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210505 [1,0,1,0,0,0|2,0,0]=4 329 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)C 270004a_100000229938_100011217825 [0,1,1,0,0,0|2,0,0]=4 330 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100000210681 [0,1,1,0,0,0|2,0,0]=4 331 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000229938_100011215489 [0,1,1,0,0,0|2,0,0]=4 332 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000210614 [0,1,1,0,0,0|2,0,0]=4 333 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100000210681 [0,1,1,0,0,0|2,0,0]=4 334 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)F 270004a_100000229938_200011219850 [0,1,1,0,0,0|2,0,0]=4 335 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000210614 [0,1,1,0,0,0|2,0,0]=4 336 B23R2.17646 CCCCCCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000210614 [0,1,1,0,0,0|2,0,0]=4 337 B23R2.17646 CCCCCCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000210614 [0,1,1,0,0,0|2,0,0]=4 338 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)C 2230a_100000736602_100000210681 [0,1,1,0,0,0|2,0,0]=4 339 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)C 270004a_100000229938_100000210966 [0,1,1,0,0,0|2,0,0]=4 340 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)C 34a_100000736602_100000210614 [0,1,1,0,0,0|2,0,0]=4 341 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000229938_100000211669 [0,1,1,0,0,0|2,0,0]=4 342 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100000210681 [0,1,1,0,0,0|2,0,0]=4 343 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000229938_100000211064 [0,1,1,0,0,0|2,0,0]=4 344 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000210614 [0,1,1,0,0,0|2,0,0]=4 345 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100000210681 [0,1,1,0,0,0|2,0,0]=4 346 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)F 270004a_100000229938_100000210425 [0,1,1,0,0,0|2,0,0]=4 347 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000210614 [0,1,1,0,0,0|2,0,0]=4 348 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000210614 [0,1,1,0,0,0|2,0,0]=4 349 B23R2.17649 CCCCCCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000210614 [0,1,1,0,0,0|2,0,0]=4 350 B23R2.17649 CCCCCCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000210614 [0,1,1,0,0,0|2,0,0]=4 351 B23R2.17649 CCCCCCCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000210614 [0,1,1,0,0,0|2,0,0]=4 352 B23R2.17649 CCCCCCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000210614 [0,1,1,0,0,0|2,0,0]=4 353 B23R2.23257 CCCC(=O)CSCCC(c1ccccc1)c2ccccc2 62a_100000747444_100009813428 [0,1,1,0,0,0|1,0,1]=4 354 B23R2.23257 CCCC(=O)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000747444 [0,1,1,0,0,0|1,0,1]=4 355 B23R2.23257 CCCC(C)CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011216630 [0,1,1,0,0,0|0,0,0]=2 356 B23R2.23257 CCCC(C)CNCCC(c1ccccc1)c2ccccc2 270004a_100000272388_100000243154 [0,1,1,0,0,0|0,0,0]=2 357 B23R2.23257 CCCC(C)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011216630 [0,1,1,0,0,0|0,0,0]=2 358 B23R2.23257 CCCC(C)COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011216630 [0,1,1,0,0,0|1,0,0]=3 359 B23R2.23257 CCCC(C)COCCC(c1ccccc1)c2ccccc2 34a_100000688023_100009813428 [0,1,1,0,0,0|1,0,0]=3 360 B23R2.23257 CCCC(C)COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011216630 [0,1,1,0,0,0|1,0,0]=3 361 B23R2.23257 CCCC(C)COCCC(c1ccccc1)c2ccccc2 7a_100000688023_100009813428 [0,1,1,0,0,0|1,0,0]=3 362 B23R2.23257 CCCC(C)COCCN(c1ccccc1)c2ccccc2 34a_100010001939_100011216630 [0,1,1,0,0,0|2,0,0]=4 363 B23R2.23257 CCCC(C)COCCN(c1ccccc1)c2ccccc2 7a_100010001939_100011216630 [0,1,1,0,0,0|2,0,0]=4 364 B23R2.23257 CCCC(C)COCC[S+](c1ccccc1)c2ccccc2 7a_100000688023_100010140906 [0,1,1,0,0,0|2,0,0]=4 365 B23R2.23257 CCCC(C)CSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100011216630 [0,1,1,0,0,0|2,0,0]=4 366 B23R2.23257 CCCC(C)CSCC[S+](c1ccccc1)c2ccccc2 62a_100011216630_100010140906 [0,1,1,0,0,0|2,0,0]=4 367 B23R2.26823 CCC(C)CCNCC=C(c1ccccc1)c2ccccc2 270004a_100020591266_100000050448 [0,1,1,0,0,0|0,0,2]=4 368 B23R2.26823 CCC(C)CCNCCC(c1ccccc1)c2ccccc2 2230a_100020591266_100009813428 [0,1,1,0,0,0|0,0,0]=2 369 B23R2.26823 CCC(C)CCOCCC(c1ccccc1)c2ccccc2 7a_100011215188_100009813428 [0,1,1,0,0,0|1,0,0]=3 370 B23R2.26823 CCC(C)CCOCC[S+](c1ccccc1)c2ccccc2 7a_100011215188_100010140906 [0,1,1,0,0,0|2,0,0]=4 371 B23R2.28171 BrCCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000746331_100009813428 [0,1,1,0,0,0|1,0,0]=3 372 B23R2.28171 BrCCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000746331_100009813428 [0,1,1,0,0,0|1,0,0]=3 373 B23R2.28171 BrCCCCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000746331_100010140906 [0,1,1,0,0,0|2,0,0]=4 374 B23R2.28171 C#CCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100010269958 [0,1,1,0,0,0|1,0,1]=4 375 B23R2.28171 C#CCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000766709_100009813428 [0,1,1,0,0,0|1,0,1]=4 376 B23R2.28171 C#CCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100010269958 [0,1,1,0,0,0|1,0,1]=4 377 B23R2.28171 C#CCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000766709_100009813428 [0,1,1,0,0,0|1,0,1]=4 378 B23R2.28171 C#CCCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100010269958 [0,1,1,0,0,0|1,0,1]=4 379 B23R2.28171 C#CCCCCSCCC(c1ccccc1)c2ccccc2 62a_100010269958_100009813428 [0,1,1,0,0,0|1,0,1]=4 380 B23R2.28171 C=CCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011215482 [0,1,1,0,0,0|0,0,1]=3 381 B23R2.28171 C=CCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000703577_100009813428 [0,1,1,0,0,0|0,0,1]=3 382 B23R2.28171 C=CCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011215482 [0,1,1,0,0,0|0,0,1]=3 383 B23R2.28171 C=CCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000703577_100009813428 [0,1,1,0,0,0|0,0,1]=3 384 B23R2.28171 C=CCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011215482 [0,1,1,0,0,0|1,0,1]=4 385 B23R2.28171 C=CCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000766645_100009813428 [0,1,1,0,0,0|1,0,1]=4 386 B23R2.28171 C=CCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011215482 [0,1,1,0,0,0|1,0,1]=4 387 B23R2.28171 C=CCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000766645_100009813428 [0,1,1,0,0,0|1,0,1]=4 388 B23R2.28171 CC/C=C\CCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100015370543 [0,1,1,0,0,0|0,0,1]=3 389 B23R2.28171 CC/C=C\CCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100015370543 [0,1,1,0,0,0|0,0,1]=3 390 B23R2.28171 CC/C=C\CCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100015370543 [0,1,1,0,0,0|1,0,1]=4 391 B23R2.28171 CC/C=C\CCOCCC(c1ccccc1)c2ccccc2 34a_100016288707_100009813428 [0,1,1,0,0,0|1,0,1]=4 392 B23R2.28171 CC/C=C\CCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100015370543 [0,1,1,0,0,0|1,0,1]=4 393 B23R2.28171 CC/C=C\CCOCCC(c1ccccc1)c2ccccc2 7a_100016288707_100009813428 [0,1,1,0,0,0|1,0,1]=4 394 B23R2.28171 CC=CCCCOCCC(c1ccccc1)c2ccccc2 34a_100020645299_100009813428 [0,1,1,0,0,0|1,0,1]=4 395 B23R2.28171 CCC#CCCOCCC(c1ccccc1)c2ccccc2 34a_100000036655_100009813428 [0,1,1,0,0,0|1,0,1]=4 396 B23R2.28171 CCC#CCCOCCC(c1ccccc1)c2ccccc2 7a_100000036655_100009813428 [0,1,1,0,0,0|1,0,1]=4 397 B23R2.28171 CCC/C=C/COCCC(c1ccccc1)c2ccccc2 34a_100016278788_100009813428 [0,1,1,0,0,0|1,0,1]=4 398 B23R2.28171 CCC/C=C/COCCC(c1ccccc1)c2ccccc2 7a_100016278788_100009813428 [0,1,1,0,0,0|1,0,1]=4 399 B23R2.28171 CCCC#CCOCCC(c1ccccc1)c2ccccc2 34a_100000034806_100009813428 [0,1,1,0,0,0|1,0,1]=4 400 B23R2.28171 CCCC#CCOCCC(c1ccccc1)c2ccccc2 7a_100000034806_100009813428 [0,1,1,0,0,0|1,0,1]=4 401 B23R2.28171 CCCC/C=C\CCOC(c1ccccc1)c2ccccc2 7a_200016286491_100011216954 [0,1,1,0,0,0|1,0,1]=4 402 B23R2.28171 CCCCC#CCCOC(c1ccccc1)c2ccccc2 7a_100000037610_100011216954 [0,1,1,0,0,0|1,0,1]=4 403 B23R2.28171 CCCCC/C=C/COC(c1ccccc1)c2ccccc2 7a_100016258190_100011216954 [0,1,1,0,0,0|1,0,1]=4 404 B23R2.28171 CCCCCC#CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100009816472 [0,1,1,0,0,0|1,0,1]=4 405 B23R2.28171 CCCCCC#CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100009816472 [0,1,1,0,0,0|1,0,1]=4 406 B23R2.28171 CCCCCC#CCOC(c1ccccc1)c2ccccc2 7a_200000033628_100011216954 [0,1,1,0,0,0|1,0,1]=4 407 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210759 [0,1,1,0,0,0|1,0,0]=3 408 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000229939_100000211591 [0,1,1,0,0,0|1,0,0]=3 409 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccccc2 270004a_100000229939_100000210122 [0,1,1,0,0,0|1,0,0]=3 410 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210759 [0,1,1,0,0,0|1,0,0]=3 411 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000210759 [0,1,1,0,0,0|2,0,0]=4 412 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccccn2 270004a_100000229939_100000210380 [0,1,1,0,0,0|2,0,0]=4 413 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000210759 [0,1,1,0,0,0|2,0,0]=4 414 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2cccnc2 270004a_100000229939_100000735413 [0,1,1,0,0,0|2,0,0]=4 415 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000210759 [0,1,1,0,0,0|2,0,0]=4 416 B23R2.28171 CCCCCCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000210759 [0,1,1,0,0,0|2,0,0]=4 417 B23R2.28171 CCCCCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000210681 [0,1,1,0,0,0|1,0,0]=3 418 B23R2.28171 CCCCCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000210614 [0,1,1,0,0,0|1,0,0]=3 419 B23R2.28171 CCCCCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000210614 [0,1,1,0,0,0|1,0,0]=3 420 B23R2.28171 CCCCCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210614 [0,1,1,0,0,0|1,0,0]=3 421 B23R2.28171 CCCCCCNCC=C(c1ccccc1)c2ccccc2 270004a_100000210581_100000050448 [0,1,1,0,0,0|0,0,2]=4 422 B23R2.28171 CCCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000210581_100009813428 [0,1,1,0,0,0|0,0,0]=2 423 B23R2.28171 CCCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000210314 [0,1,1,0,0,0|0,0,0]=2 424 B23R2.28171 CCCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000210314 [0,1,1,0,0,0|0,0,0]=2 425 B23R2.28171 CCCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000210314 [0,1,1,0,0,0|1,0,0]=3 426 B23R2.28171 CCCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000210259_100009813428 [0,1,1,0,0,0|1,0,0]=3 427 B23R2.28171 CCCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000210314 [0,1,1,0,0,0|1,0,0]=3 428 B23R2.28171 CCCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000210259_100009813428 [0,1,1,0,0,0|1,0,0]=3 429 B23R2.28171 CCCCCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000210314 [0,1,1,0,0,0|2,0,0]=4 430 B23R2.28171 CCCCCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000210314 [0,1,1,0,0,0|2,0,0]=4 431 B23R2.28171 CCCCCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000210259_100010140906 [0,1,1,0,0,0|2,0,0]=4 432 B23R2.28171 CCCCCOCCOC(c1ccccc1)c2ccccc2 34a_100000210253_100000734929 [0,1,1,0,0,0|1,0,0]=3 433 B23R2.28171 CCCCCOCCOC(c1ccccc1)c2ccccc2 7a_100000210253_100000734929 [0,1,1,0,0,0|1,0,0]=3 434 B23R2.28171 CCCCCOCCOC(c1ccccc1)c2ccccc2 7a_100011215259_100011216954 [0,1,1,0,0,0|1,0,0]=3 435 B23R2.28171 CCCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000210326_100000734929 [0,1,1,0,0,0|1,0,0]=3 436 B23R2.28171 CCCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000210326 [0,1,1,0,0,0|1,0,0]=3 437 B23R2.28171 CCCCOCCCOC(c1ccccc1)c2ccccc2 7a_200011215613_100011216954 [0,1,1,0,0,0|2,0,0]=4 438 B23R2.28171 CCCCOCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011995733 [0,1,1,0,0,0|1,0,0]=3 439 B23R2.28171 CCCCOCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011995733 [0,1,1,0,0,0|1,0,0]=3 440 B23R2.28171 CCCCOCSCCC(c1ccccc1)c2ccccc2 62a_100011995733_100009813428 [0,1,1,0,0,0|1,0,0]=3 441 B23R2.28171 CCCCOCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100011995733 [0,1,1,0,0,0|2,0,0]=4 442 B23R2.28171 CCCCOCSCC[S+](c1ccccc1)c2ccccc2 62a_100011995733_100010140906 [0,1,1,0,0,0|2,0,0]=4 443 B23R2.28171 CCCOCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011215938 [0,1,1,0,0,0|1,0,0]=3 444 B23R2.28171 CCCOCCSCCC(c1ccccc1)c2ccccc2 62a_100011215938_100009813428 [0,1,1,0,0,0|1,0,0]=3 445 B23R2.28171 CCCSCCOCCC(c1ccccc1)c2ccccc2 34a_200000230433_100009813428 [0,1,1,0,0,0|1,0,0]=3 446 B23R2.28171 CCCSCCOCCC(c1ccccc1)c2ccccc2 7a_200000230433_100009813428 [0,1,1,0,0,0|1,0,0]=3 447 B23R2.28171 CCOCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100012232248 [0,1,1,0,0,0|1,0,0]=3 448 B23R2.28171 CCOCCCSCCC(c1ccccc1)c2ccccc2 62a_100012232248_100009813428 [0,1,1,0,0,0|1,0,0]=3 449 B23R2.28171 CCSCCCOCCC(c1ccccc1)c2ccccc2 34a_100011216438_100009813428 [0,1,1,0,0,0|1,0,0]=3 450 B23R2.28171 CCSCCCOCCC(c1ccccc1)c2ccccc2 7a_100011216438_100009813428 [0,1,1,0,0,0|1,0,0]=3 451 B23R2.28171 CCSCCSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000757381 [0,1,1,0,0,0|2,0,0]=4 452 B23R2.28171 CCSCCSCCOC(c1ccccc1)c2ccccc2 62a_100000757381_100000734929 [0,1,1,0,0,0|2,0,0]=4 453 B23R2.28171 COCCCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011998445 [0,1,1,0,0,0|2,0,0]=4 454 B23R2.28171 COCCCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011998445 [0,1,1,0,0,0|2,0,0]=4 455 B23R2.28171 COCCCCCCOC(c1ccccc1)c2ccccc2 7a_200012092642_100011216954 [0,1,1,0,0,0|2,0,0]=4 456 B23R2.28171 COCCCCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011998445 [0,1,1,0,0,0|2,0,0]=4 457 B23R2.28171 COCCCCCCSC(c1ccccc1)c2ccccc2 62a_100011998445_100011216954 [0,1,1,0,0,0|2,0,0]=4 458 B23R2.28171 COCCCCSCCC(c1ccccc1)c2ccccc2 62a_100000730899_100009813428 [0,1,1,0,0,0|1,0,0]=3 459 B23R2.28171 COCCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000730899 [0,1,1,0,0,0|1,0,0]=3 460 B23R2.28171 CSCCCCOCCC(c1ccccc1)c2ccccc2 34a_100011217163_100009813428 [0,1,1,0,0,0|1,0,0]=3 461 B23R2.28171 CSCCCCOCCC(c1ccccc1)c2ccccc2 7a_100011217163_100009813428 [0,1,1,0,0,0|1,0,0]=3 462 B23R2.28171 ClCCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000746330_100009813428 [0,1,1,0,0,0|1,0,0]=3 463 B23R2.28171 ClCCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000746330_100009813428 [0,1,1,0,0,0|1,0,0]=3 464 B23R2.28171 ClCCCCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000746330_100010140906 [0,1,1,0,0,0|2,0,0]=4 465 B23R2.28171 FCCCCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100015922095 [0,1,1,0,0,0|2,0,0]=4 466 B23R2.28171 FCCCCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100015922095 [0,1,1,0,0,0|2,0,0]=4 467 B23R2.28171 FCCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000729378 [0,1,1,0,0,0|1,0,0]=3 468 B23R2.28171 FCCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000729378 [0,1,1,0,0,0|1,0,0]=3 469 B23R2.28171 FCCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000729378_100010140906 [0,1,1,0,0,0|2,0,0]=4 470 B23R2.28171 FCCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000729378 [0,1,1,0,0,0|2,0,0]=4 471 B23R2.28171 FCCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000729493_100000734929 [0,1,1,0,0,0|2,0,0]=4 472 B23R2.28171 FCCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000729493 [0,1,1,0,0,0|2,0,0]=4 473 B23R2.28171 ICCCCCOCCC(c1ccccc1)c2ccccc2 34a_200012148887_100009813428 [0,1,1,0,0,0|1,0,0]=3 474 B23R2.28171 ICCCCCOCCC(c1ccccc1)c2ccccc2 7a_200012148887_100009813428 [0,1,1,0,0,0|1,0,0]=3 475 B23R2.28171 ICCCCCOCC[S+](c1ccccc1)c2ccccc2 7a_200012148887_100010140906 [0,1,1,0,0,0|2,0,0]=4 476 B23R2.28171 ICCCCOCCOC(c1ccccc1)c2ccccc2 34a_200012148704_100000734929 [0,1,1,0,0,0|2,0,0]=4 477 B23R2.28171 N#CCCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000211819 [0,1,1,0,0,0|1,0,1]=4 478 B23R2.28171 N#CCCCCSCCC(c1ccccc1)c2ccccc2 62a_100011219923_100009813428 [0,1,1,0,0,0|1,0,1]=4 479 B23R2.28171 O=CCCCCSCCC(c1ccccc1)c2ccccc2 62a_100000139335_100009813428 [0,1,1,0,0,0|1,0,1]=4 480 B23R2.28171 O=CCCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000139335 [0,1,1,0,0,0|1,0,1]=4 481 B23R2.28171 OCCCCCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000760002 [0,1,1,0,0,0|2,0,0]=4 482 B23R2.28171 OCCCCCCCSC(c1ccccc1)c2ccccc2 62a_100000760002_100011216954 [0,1,1,0,0,0|2,0,0]=4 483 B23R2.28171 OCCCCCSCCC(c1ccccc1)c2ccccc2 62a_100000746330_100009813428 [0,1,1,0,0,0|1,0,0]=3 484 B23R2.28171 OCCCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000746330 [0,1,1,0,0,0|1,0,0]=3 485 B23R2.29366 CC(=CCCNCCC(c1ccccc1)c2ccccc2)C 2230a_100000272388_100011217483 [0,1,1,0,0,0|0,0,2]=4 486 B23R2.29366 CC(=CCCNCCC(c1ccccc1)c2ccccc2)C 34a_100000272388_100011217483 [0,1,1,0,0,0|0,0,2]=4 487 B23R2.29366 CC(=O)CCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011215641 [0,1,1,0,0,0|1,0,1]=4 488 B23R2.29366 CC(=O)CCCSCCC(c1ccccc1)c2ccccc2 62a_100011215641_100009813428 [0,1,1,0,0,0|1,0,1]=4 489 B23R2.29366 CC(C)CCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210682 [0,1,1,0,0,0|2,0,0]=4 490 B23R2.29366 CC(C)CCCCCNC(c1ccccc1)c2ccccc2 2230a_100011290863_100000211591 [0,1,1,0,0,0|2,0,0]=4 491 B23R2.29366 CC(C)CCCCCNC(c1ccccc1)c2ccccc2 270004a_100011290863_100000210122 [0,1,1,0,0,0|2,0,0]=4 492 B23R2.29366 CC(C)CCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210682 [0,1,1,0,0,0|2,0,0]=4 493 B23R2.29366 CC(C)CCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100011216152 [0,1,1,0,0,0|2,0,0]=4 494 B23R2.29366 CC(C)CCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100011216152 [0,1,1,0,0,0|2,0,0]=4 495 B23R2.29366 CC(C)CCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100011216152 [0,1,1,0,0,0|2,0,0]=4 496 B23R2.29366 CC(C)CCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100011216152 [0,1,1,0,0,0|2,0,0]=4 497 B23R2.29366 CC(C)CCCNCC=C(c1ccccc1)c2ccccc2 270004a_200000737386_100000050448 [0,1,1,0,0,0|0,0,2]=4 498 B23R2.29366 CC(C)CCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011214892 [0,1,1,0,0,0|0,0,0]=2 499 B23R2.29366 CC(C)CCCNCCC(c1ccccc1)c2ccccc2 2230a_200000737386_100009813428 [0,1,1,0,0,0|0,0,0]=2 500 B23R2.29366 CC(C)CCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011214892 [0,1,1,0,0,0|0,0,0]=2 501 B23R2.29366 CC(C)CCCNCCC(c1ccccc1)c2ccccc2 34a_200000737386_100009813428 [0,1,1,0,0,0|0,0,0]=2 502 B23R2.29366 CC(C)CCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011214892 [0,1,1,0,0,0|1,0,0]=3 503 B23R2.29366 CC(C)CCCOCCC(c1ccccc1)c2ccccc2 34a_100000210774_100009813428 [0,1,1,0,0,0|1,0,0]=3 504 B23R2.29366 CC(C)CCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011214892 [0,1,1,0,0,0|1,0,0]=3 505 B23R2.29366 CC(C)CCCOCCC(c1ccccc1)c2ccccc2 7a_100000210774_100009813428 [0,1,1,0,0,0|1,0,0]=3 506 B23R2.29366 CC(C)CCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100011214892 [0,1,1,0,0,0|2,0,0]=4 507 B23R2.29366 CC(C)CCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100011214892 [0,1,1,0,0,0|2,0,0]=4 508 B23R2.29366 CC(C)CCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000210774_100010140906 [0,1,1,0,0,0|2,0,0]=4 509 B23R2.29366 CC(C)CCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100011214892 [0,1,1,0,0,0|2,0,0]=4 510 B23R2.29366 CC(C)CCCSCC[S+](c1ccccc1)c2ccccc2 62a_100011214892_100010140906 [0,1,1,0,0,0|2,0,0]=4 511 B23R2.29366 CC(C)OCCSCCC(c1ccccc1)c2ccccc2 62a_100000211751_100009813428 [0,1,1,0,0,0|2,0,0]=4 512 B23R2.29366 CC(C)OCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000211751 [0,1,1,0,0,0|2,0,0]=4 513 B23R2.29366 CC(C)SCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000730970 [0,1,1,0,0,0|2,0,0]=4 514 B23R2.29366 CC(C)SCCOCCC(c1ccccc1)c2ccccc2 34a_200011212901_100009813428 [0,1,1,0,0,0|2,0,0]=4 515 B23R2.29366 CC(C)SCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000730970 [0,1,1,0,0,0|2,0,0]=4 516 B23R2.29366 CC(C)SCCOCCC(c1ccccc1)c2ccccc2 7a_200011212901_100009813428 [0,1,1,0,0,0|2,0,0]=4 517 B23R2.29366 CC(O)CCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_200000718107 [0,1,1,0,0,0|1,0,0]=3 518 B23R2.29366 CC(O)CCCSCCC(c1ccccc1)c2ccccc2 62a_200000718107_100009813428 [0,1,1,0,0,0|1,0,0]=3 519 B23R2.33724 C=CCCC(C)NCCC(c1ccccc1)c2ccccc2 270004a_100000272388_100000762624 [0,1,1,0,0,0|0,0,2]=4 520 B23R2.33724 CC(CCCCl)OCCC(c1ccccc1)c2ccccc2 34a_200000718107_100009813428 [0,1,1,0,0,0|2,0,0]=4 521 B23R2.33724 CC(CCCCl)OCCC(c1ccccc1)c2ccccc2 7a_200000718107_100009813428 [0,1,1,0,0,0|2,0,0]=4 522 B23R2.33724 CCCCC(C)NCC=C(c1ccccc1)c2ccccc2 270004a_100000126638_100000050448 [0,1,1,0,0,0|0,0,2]=4 523 B23R2.33724 CCCCC(C)NCCC(c1ccccc1)c2ccccc2 2230a_100000126638_100009813428 [0,1,1,0,0,0|0,0,0]=2 524 B23R2.33724 CCCCC(C)NCCC(c1ccccc1)c2ccccc2 2230a_100000272388_200011215066 [0,1,1,0,0,0|0,0,0]=2 525 B23R2.33724 CCCCC(C)NCCC(c1ccccc1)c2ccccc2 270004a_100000272388_100000210087 [0,1,1,0,0,0|0,0,0]=2 526 B23R2.33724 CCCCC(C)NCCC(c1ccccc1)c2ccccc2 34a_100000272388_200011215066 [0,1,1,0,0,0|0,0,0]=2 527 B23R2.33724 CCCCC(C)OCCC(c1ccccc1)c2ccccc2 34a_100000032380_200011215066 [0,1,1,0,0,0|1,0,0]=3 528 B23R2.33724 CCCCC(C)OCCC(c1ccccc1)c2ccccc2 34a_100000687866_100009813428 [0,1,1,0,0,0|1,0,0]=3 529 B23R2.33724 CCCCC(C)OCCC(c1ccccc1)c2ccccc2 7a_100000032380_200011215066 [0,1,1,0,0,0|1,0,0]=3 530 B23R2.33724 CCCCC(C)OCCC(c1ccccc1)c2ccccc2 7a_100000687866_100009813428 [0,1,1,0,0,0|1,0,0]=3 531 B23R2.33724 CCCCC(C)OCCN(c1ccccc1)c2ccccc2 34a_100010001939_200011215066 [0,1,1,0,0,0|2,0,0]=4 532 B23R2.33724 CCCCC(C)OCCN(c1ccccc1)c2ccccc2 7a_100010001939_200011215066 [0,1,1,0,0,0|2,0,0]=4 533 B23R2.33724 CCCCC(C)OCC[S+](c1ccccc1)c2ccccc2 7a_100000687866_100010140906 [0,1,1,0,0,0|2,0,0]=4 534 B23R2.62314 C=CCCCNC(C)CC(c1ccccc1)c2ccccc2 270004a_100000700776_200000011111 [0,1,1,0,0,0|0,0,2]=4 535 B23R2.62314 CCCCCCC(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_100000210757 [0,1,1,0,0,0|1,0,1]=4 536 B23R2.62314 CCCCCCC(C)NC(c1ccccc1)c2ccccc2 2230a_100000162943_100011215978 [0,1,1,0,0,0|2,0,0]=4 537 B23R2.62314 CCCCCCC(C)NC(c1ccccc1)c2ccccc2 2230a_100000210919_100000211591 [0,1,1,0,0,0|2,0,0]=4 538 B23R2.62314 CCCCCCC(C)NC(c1ccccc1)c2ccccc2 270004a_100000162943_100000210826 [0,1,1,0,0,0|2,0,0]=4 539 B23R2.62314 CCCCCCC(C)NC(c1ccccc1)c2ccccc2 270004a_100000210919_100000210122 [0,1,1,0,0,0|2,0,0]=4 540 B23R2.62314 CCCCCCC(C)NC(c1ccccc1)c2ccccc2 34a_100000162943_100011215978 [0,1,1,0,0,0|2,0,0]=4 541 B23R2.62314 CCCCCNC(C)CC(c1ccccc1)c2ccccc2 270004a_100000209983_200000011111 [0,1,1,0,0,0|0,0,0]=2 542 B23R2.63751 CCCCCCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000210614 [0,1,1,0,0,0|1,0,1]=4 543 B23R2.63751 CCCCCCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000211969_100011216954 [0,1,1,0,0,0|1,0,1]=4 544 B23R2.63751 CCCCCCCN(C)C(c1ccccc1)c2ccccc2 2230a_100000228206_100000211591 [0,1,1,0,0,0|2,0,0]=4 545 B23R2.63751 CCCCCCCN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000210681 [0,1,1,0,0,0|2,0,0]=4 546 B23R2.63751 CCCCCCCN(C)C(c1ccccc1)c2ccccc2 269982a_100000228206_100000211591 [0,1,1,0,0,0|2,0,0]=4 547 B23R2.63751 CCCCCCCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000210681 [0,1,1,0,0,0|2,0,0]=4 548 B23R2.63751 CCCCCCCN(C)C(c1ccccc1)c2ccccc2 270004a_100000228206_100000210122 [0,1,1,0,0,0|2,0,0]=4 549 B23R2.151646 CCCCCCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000210614 [0,1,1,0,0,0|2,0,0]=4 550 B23R2.151646 CCCCCCNCC(C)(c1ccccc1)c2ccccc2 2230a_100000706881_100000210314 [0,1,1,0,0,0|2,0,0]=4 551 B23R2.178741 C=CCCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100011713584 [0,1,1,0,0,0|0,0,2]=4 552 B23R2.178741 C=CCCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000757094 [0,1,1,0,0,0|0,0,2]=4 553 B23R2.178741 C=CCCCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000757094 [0,1,1,0,0,0|0,0,2]=4 554 B23R2.178741 CC/C=C\CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100103147603 [0,1,1,0,0,0|0,0,2]=4 555 B23R2.178741 CC/C=C\CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100103147603 [0,1,1,0,0,0|0,0,2]=4 556 B23R2.178741 CC/C=C\CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100103147603 [0,1,1,0,0,0|0,0,2]=4 557 B23R2.178741 CCCCCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000212188_100009813428 [0,1,1,0,0,0|1,0,0]=3 558 B23R2.178741 CCCCCC(=O)CC[S+](c1ccccc1)c2ccccc2 1458a_100000212188_100010140906 [0,1,1,0,0,0|2,0,0]=4 559 B23R2.178741 CCCCCC(=O)CSC(c1ccccc1)c2ccccc2 1458a_100000683935_100000210326 [0,1,1,0,0,0|2,0,0]=4 560 B23R2.178741 CCCCCC(=O)CSC(c1ccccc1)c2ccccc2 62a_100000211591_200012276598 [0,1,1,0,0,0|2,0,0]=4 561 B23R2.178741 CCCCCC(=O)CSC(c1ccccc1)c2ccccc2 62a_200012276598_100011216954 [0,1,1,0,0,0|2,0,0]=4 562 B23R2.178741 CCCCCC(C)NCC(c1ccccc1)c2ccccc2 2230a_100000739227_200011218191 [0,1,1,0,0,0|2,0,0]=4 563 B23R2.178741 CCCCCC(C)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000211708 [0,1,1,0,0,0|2,0,0]=4 564 B23R2.178741 CCCCCC(C)NCC(c1ccccc1)c2ccccc2 34a_100000739227_200011218191 [0,1,1,0,0,0|2,0,0]=4 565 B23R2.178741 CCCCCC(C)OCC(c1ccccc1)c2ccccc2 34a_100011215272_200011218191 [0,1,1,0,0,0|2,0,0]=4 566 B23R2.178741 CCCCCC(C)OCC(c1ccccc1)c2ccccc2 7a_100011215272_200011218191 [0,1,1,0,0,0|2,0,0]=4 567 B23R2.178741 CCCCCN(C)CC=C(c1ccccc1)c2ccccc2 270004a_100000223495_100000050448 [0,1,1,0,0,0|0,0,2]=4 568 B23R2.178741 CCCCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000223495_100009813428 [0,1,1,0,0,0|0,0,0]=2 569 B23R2.178741 CCCCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000210326 [0,1,1,0,0,0|0,0,0]=2 570 B23R2.178741 CCCCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100000223495_100009813428 [0,1,1,0,0,0|0,0,0]=2 571 B23R2.178741 CCCCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000210215 [0,1,1,0,0,0|0,0,0]=2 572 B23R2.178741 CCCCCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000718602 [0,1,1,0,0,0|0,0,0]=2 573 B23R2.178741 CCCSCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000217233_100009813428 [0,1,1,0,0,0|2,0,0]=4 574 B23R2.178741 CCSCCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000230768_100009813428 [0,1,1,0,0,0|2,0,0]=4 575 B23R2.178741 CSCCCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000173376_100009813428 [0,1,1,0,0,0|2,0,0]=4 576 B23R2.485364 CCCCCCCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000210681 [0,1,1,0,0,0|2,0,0]=4 577 B23R2.485364 CCCCCCCNC(c1ccccc1)c2ccccc2C 2230a_100000229938_100000230135 [0,1,1,0,0,0|2,0,0]=4 578 B23R2.485364 CCCCCCCNC(c1ccccc1)c2ccccc2C 270004a_100000229938_100000735561 [0,1,1,0,0,0|2,0,0]=4 579 B23R2.485364 CCCCCCCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000210614 [0,1,1,0,0,0|2,0,0]=4 580 B23R2.485364 CCCCCCCNC(c1ccccc1)c2ccccc2Cl 270004a_100000229938_100011215288 [0,1,1,0,0,0|2,0,0]=4 581 B23R2.485364 CCCCCCCNC(c1ccccc1)c2ccccc2F 270004a_100000229938_100011217773 [0,1,1,0,0,0|2,0,0]=4 582 B23R2.485364 CCCCCCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000210614 [0,1,1,0,0,0|2,0,0]=4 583 B23R2.485364 CCCCCCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000210614 [0,1,1,0,0,0|2,0,0]=4 584 B23R2.4774 C=CCCN(C)C(C)CC(c1ccccc1)c2ccccc2 270004a_100020639649_200000011111 [0,1,1,0,0,0|0,0,2]=4 585 B23R2.4774 CCCCC(C)C(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_200011215066 [0,1,1,0,0,0|1,0,1]=4 586 B23R2.4774 CCCCN(C)C(C)CC(c1ccccc1)c2ccccc2 270004a_100000207549_200000011111 [0,1,1,0,0,0|0,0,0]=2 587 B23R2.78354 CCCC(C)C(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000210906_100009813428 [0,1,1,0,0,0|2,0,0]=4 588 B23R2.78354 CCCC(C)C(C)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100011216282 [0,1,1,0,0,0|2,0,0]=4 589 B23R2.78354 CCCC(C)N(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000766640 [0,1,1,0,0,0|0,0,0]=2 590 B23R2.78354 CCCC(C)N(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000766640 [0,1,1,0,0,0|0,0,0]=2 591 B23R2.78354 CCCC(C)N(C)CCC(c1ccccc1)c2ccccc2 270004a_100025726140_100000211909 [0,1,1,0,0,0|0,0,0]=2 592 B23R2.78354 CCCC(C)N(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000766640 [0,1,1,0,0,0|0,0,0]=2 593 B23R2.176949 CCCCC(C)NCC(C)(c1ccccc1)c2ccccc2 2230a_100000706881_200011215066 [0,1,1,0,0,0|2,0,0]=4 594 B23R2.176949 CCCCC(C)NCC(C)(c1ccccc1)c2ccccc2 270004a_100000706881_100000210087 [0,1,1,0,0,0|2,0,0]=4 595 B23R2.472609 C=C(C)CCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000730704 [0,1,1,0,0,0|0,0,1]=3 596 B23R2.472609 C=C(C)CCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000730704 [0,1,1,0,0,0|0,0,1]=3 597 B23R2.472609 C=C(C)CCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000730704 [0,1,1,0,0,0|0,0,1]=3 598 B23R2.472609 CC(=CCN(C)CCC(c1ccccc1)c2ccccc2)C 2230a_100025726140_100000761012 [0,1,1,0,0,0|0,0,2]=4 599 B23R2.472609 CC(=CCN(C)CCC(c1ccccc1)c2ccccc2)C 269982a_100025726140_100000761012 [0,1,1,0,0,0|0,0,2]=4 600 B23R2.472609 CC(=CCN(C)CCC(c1ccccc1)c2ccccc2)C 34a_100025726140_100000761012 [0,1,1,0,0,0|0,0,2]=4 601 B23R2.472609 CC(C)CCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000181311_100009813428 [0,1,1,0,0,0|2,0,0]=4 602 B23R2.472609 CC(C)CCC(C)NCC(c1ccccc1)c2ccccc2 2230a_100000739227_100011261404 [0,1,1,0,0,0|2,0,0]=4 603 B23R2.472609 CC(C)CCC(C)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000210476 [0,1,1,0,0,0|2,0,0]=4 604 B23R2.472609 CC(C)CCC(C)NCC(c1ccccc1)c2ccccc2 34a_100000739227_100011261404 [0,1,1,0,0,0|2,0,0]=4 605 B23R2.472609 CC(C)CCC(C)OCC(c1ccccc1)c2ccccc2 34a_100011215272_100011261404 [0,1,1,0,0,0|2,0,0]=4 606 B23R2.472609 CC(C)CCN(C)CC=C(c1ccccc1)c2ccccc2 270004a_100000742789_100000050448 [0,1,1,0,0,0|0,0,2]=4 607 B23R2.472609 CC(C)CCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000742789_100009813428 [0,1,1,0,0,0|0,0,0]=2 608 B23R2.472609 CC(C)CCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000210312 [0,1,1,0,0,0|0,0,0]=2 609 B23R2.472609 CC(C)CCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100000742789_100009813428 [0,1,1,0,0,0|0,0,0]=2 610 B23R2.472609 CC(C)CCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000210312 [0,1,1,0,0,0|0,0,0]=2 611 B23R2.472609 CC(C)CCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000210312 [0,1,1,0,0,0|0,0,0]=2 612 B23R2.509616 CCCCC(CC)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000211942 [0,1,1,0,0,0|2,0,0]=4 613 B23R2.509616 CCCCC(CC)CNC(c1ccccc1)c2ccccc2 2230a_100000209976_100000211591 [0,1,1,0,0,0|2,0,0]=4 614 B23R2.509616 CCCCC(CC)CNC(c1ccccc1)c2ccccc2 269862a_100000162943_100011219736 [0,1,1,0,0,0|2,0,0]=4 615 B23R2.509616 CCCCC(CC)CNC(c1ccccc1)c2ccccc2 270004a_100000162943_100011219736 [0,1,1,0,0,0|2,0,0]=4 616 B23R2.509616 CCCCC(CC)CNC(c1ccccc1)c2ccccc2 270004a_100000209976_100000210122 [0,1,1,0,0,0|2,0,0]=4 617 B23R2.509616 CCCCC(CC)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100000211942 [0,1,1,0,0,0|2,0,0]=4 618 B23R2.509616 CCCCC(CC)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000753412 [0,1,1,0,0,0|2,0,0]=4 619 B23R2.509616 CCCCC(CC)NCC(c1ccccc1)c2ccccc2 34a_100000739227_200011216223 [0,1,1,0,0,0|2,0,0]=4 620 B23R2.509616 CCCCC(CC)OCC(c1ccccc1)c2ccccc2 34a_100011215272_200011216223 [0,1,1,0,0,0|2,0,0]=4 621 B23R2.509616 CCCCC(CC)OCC(c1ccccc1)c2ccccc2 7a_100011215272_200011216223 [0,1,1,0,0,0|2,0,0]=4 622 B23R2.509616 CCCCN(CC)CC=C(c1ccccc1)c2ccccc2 270004a_100000207695_100000050448 [0,1,1,0,0,0|0,0,2]=4 623 B23R2.509616 CCCCN(CC)CCC(c1ccccc1)c2ccccc2 2230a_100000207695_100009813428 [0,1,1,0,0,0|0,0,0]=2 624 B23R2.509616 CCCCN(CC)CCC(c1ccccc1)c2ccccc2 269982a_100000207695_100009813428 [0,1,1,0,0,0|0,0,0]=2 625 B23R2.763176 CCC(C)CC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000708755_100009813428 [0,1,1,0,0,0|2,0,0]=4 626 B23R2.763176 CCC(C)CC(C)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100011710205 [0,1,1,0,0,0|2,0,0]=4 627 B23R2.763176 CCC(C)CN(C)CC=C(c1ccccc1)c2ccccc2 270004a_100000753921_100000050448 [0,1,1,0,0,0|0,0,2]=4 628 B23R2.763176 CCC(C)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000753921_100009813428 [0,1,1,0,0,0|0,0,0]=2 629 B23R2.763176 CCC(C)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000748023 [0,1,1,0,0,0|0,0,0]=2 630 B23R2.763176 CCC(C)CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100000753921_100009813428 [0,1,1,0,0,0|0,0,0]=2 631 B23R2.763176 CCC(C)CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000748023 [0,1,1,0,0,0|0,0,0]=2 632 B23R2.763176 CCC(C)CN(C)CCC(c1ccccc1)c2ccccc2 270004a_100025726140_100000243153 [0,1,1,0,0,0|0,0,0]=2 633 B23R2.763176 CCC(C)CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000748023 [0,1,1,0,0,0|0,0,0]=2 634 B23R2.763176 CC[C@H](C)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100009816398 [0,1,1,0,0,0|0,0,0]=2 635 B23R2.763176 CC[C@H](C)CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100009816398 [0,1,1,0,0,0|0,0,0]=2 636 B23R2.763176 CC[C@H](C)CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100009816398 [0,1,1,0,0,0|0,0,0]=2 637 B23R2.5238162 CCCCC(C)COC(c1ccccc1)c2ccccc2C 7a_100011995851_100000230135 [0,1,1,0,0,0|2,0,0]=4 638 B23R2.12579442 CCCC[Si](C)(C)COC(c1ccccc1)c2ccccc2 7a_100000211180_200000073895 [0,1,1,0,0,0|2,0,0]=4 639 B23R2.35471 CCCC(CC)C(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_100011219200 [0,1,1,0,0,0|1,0,1]=4 640 B23R2.35471 CCCN(CC)C(C)CC(c1ccccc1)c2ccccc2 270004a_100000226822_200000011111 [0,1,1,0,0,0|0,0,0]=2 641 B23R2.63573 C=C(C)CN(CC)CCC(c1ccccc1)c2ccccc2 2230a_100000211296_100009813428 [0,1,1,0,0,0|0,0,1]=3 642 B23R2.63573 C=C(C)CN(CC)CCC(c1ccccc1)c2ccccc2 269982a_100000211296_100009813428 [0,1,1,0,0,0|0,0,1]=3 643 B23R2.63573 CCC(COC(c1ccccc1)c2ccccc2)CC(C)C 7a_100012186708_100011216954 [0,1,1,0,0,0|2,0,0]=4 644 B23R2.63573 CCN(CC=C(c1ccccc1)c2ccccc2)CC(C)C 270004a_100000738554_100000050448 [0,1,1,0,0,0|0,0,2]=4 645 B23R2.63573 CCN(CCC(c1ccccc1)c2ccccc2)CC(C)C 2230a_100000738554_100009813428 [0,1,1,0,0,0|0,0,0]=2 646 B23R2.63573 CCN(CCC(c1ccccc1)c2ccccc2)CC(C)C 269982a_100000738554_100009813428 [0,1,1,0,0,0|0,0,0]=2 647 B23R2.485288 C=CCN(CCC(c1ccccc1)c2ccccc2)C(C)C 2230a_100000742772_100009813428 [0,1,1,0,0,0|0,0,2]=4 648 B23R2.485288 C=CCN(CCC(c1ccccc1)c2ccccc2)C(C)C 269982a_100000742772_100009813428 [0,1,1,0,0,0|0,0,2]=4 649 B23R2.485288 CCCN(CC=C(c1ccccc1)c2ccccc2)C(C)C 270004a_106256033942_100000050448 [0,1,1,0,0,0|0,0,2]=4 650 B23R2.485288 CCCN(CCC(c1ccccc1)c2ccccc2)C(C)C 2230a_106256033942_100009813428 [0,1,1,0,0,0|0,0,0]=2 651 B23R2.485288 CCCN(CCC(c1ccccc1)c2ccccc2)C(C)C 269982a_106256033942_100009813428 [0,1,1,0,0,0|0,0,0]=2 652 B23R2.529032 CCCC(CCC)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000210088 [0,1,1,0,0,0|2,0,0]=4 653 B23R2.529032 CCCC(CCC)NCC(c1ccccc1)c2ccccc2 34a_100000739227_200011218217 [0,1,1,0,0,0|2,0,0]=4 654 B23R2.529032 CCCC(CCC)OCC(c1ccccc1)c2ccccc2 34a_100011215272_200011218217 [0,1,1,0,0,0|2,0,0]=4 655 B23R2.529032 CCCC(CCC)OCC(c1ccccc1)c2ccccc2 7a_100011215272_200011218217 [0,1,1,0,0,0|2,0,0]=4 656 B23R2.529032 CCCN(CC=C(c1ccccc1)c2ccccc2)CCC 270004a_100000210455_100000050448 [0,1,1,0,0,0|0,0,2]=4 657 B23R2.529032 CCCN(CCC)CCC(c1ccccc1)c2ccccc2 2230a_100000210455_100009813428 [0,1,1,0,0,0|0,0,0]=2 658 B23R2.529032 CCCN(CCC)CCC(c1ccccc1)c2ccccc2 269982a_100000210455_100009813428 [0,1,1,0,0,0|0,0,0]=2 659 B23R2.1002389 CCCC(CC)NCC(C)(c1ccccc1)c2ccccc2 270004a_100000706881_100000687865 [0,1,1,0,0,0|2,0,0]=4 660 B23R2.1040931 CCC(C)N(CC)CC=C(c1ccccc1)c2ccccc2 270004a_100000732650_100000050448 [0,1,1,0,0,0|0,0,2]=4 661 B23R2.1040931 CCC(C)N(CC)CCC(c1ccccc1)c2ccccc2 2230a_100000732650_100009813428 [0,1,1,0,0,0|0,0,0]=2 662 B23R2.1040931 CCC(C)N(CC)CCC(c1ccccc1)c2ccccc2 269982a_100000732650_100009813428 [0,1,1,0,0,0|0,0,0]=2 663 B23R2.9395971 CCCC(C)(CC)OCC(c1ccccc1)c2ccccc2 7a_100011215272_200000040151 [0,1,1,0,0,0|2,0,0]=4 664 B23R3.15516 CC1CCC(CC1)OC(c2ccccc2)c3ccccc3 34a_100000211180_200011216234 [0,1,0,0,1,0|2,0,0]=4 665 B23R3.15516 CC1CCC(CC1)OC(c2ccccc2)c3ccccc3 7a_100000210714_100011216954 [0,1,0,0,1,0|2,0,0]=4 666 B23R3.16362 Brc1cccc(c1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100011267660 [0,1,0,0,1,0|2,0,0]=4 667 B23R3.16362 Brc1cccc(c1)C(NC2CCCCC2)c3ccccc3 270004a_100011212009_100000210434 [0,1,0,0,1,0|2,0,0]=4 668 B23R3.16362 Brc1cccc(c1)C(NC2CCCCC2)c3ccccc3 34a_100011212009_100000210327 [0,1,0,0,1,0|2,0,0]=4 669 B23R3.16362 Cc1cccc(c1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100011217825 [0,1,0,0,1,0|2,0,0]=4 670 B23R3.16362 Clc1cccc(c1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100011215489 [0,1,0,0,1,0|2,0,0]=4 671 B23R3.16362 Clc1cccc(c1)C(NC2CCCCC2)c3ccccc3 270004a_100000741085_100000210434 [0,1,0,0,1,0|2,0,0]=4 672 B23R3.16362 Clc1cccc(c1)C(NC2CCCCC2)c3ccccc3 34a_100000741085_100000210327 [0,1,0,0,1,0|2,0,0]=4 673 B23R3.16362 Clc1cccc(c1)C(OC2CCCCC2)c3ccccc3 34a_100000733576_100000210327 [0,1,0,0,1,0|2,0,0]=4 674 B23R3.16362 Clc1cccc(c1)C(OC2CCCCC2)c3ccccc3 7a_100000733576_100000210327 [0,1,0,0,1,0|2,0,0]=4 675 B23R3.16362 Fc1cccc(c1)C(OC2CCCCC2)c3ccccc3 34a_100000749007_100000210327 [0,1,0,0,1,0|2,0,0]=4 676 B23R3.16362 Fc1cccc(c1)C(OC2CCCCC2)c3ccccc3 7a_100000749007_100000210327 [0,1,0,0,1,0|2,0,0]=4 677 B23R3.26514 CC1CCCCC1OC(c2ccccc2)c3ccccc3 7a_100000211207_100011216954 [0,1,0,0,1,0|2,0,0]=4 678 B23R3.26514 ClC1CCCCC1OC(c2ccccc2)c3ccccc3 7a_100000038908_100011216954 [0,1,0,0,1,0|2,0,0]=4 679 B23R3.26514 FC1CCCCC1OC(c2ccccc2)c3ccccc3 34a_100000211180_100015423560 [0,1,0,0,1,0|2,0,0]=4 680 B23R3.26514 FC1CCCCC1SC(c2ccccc2)c3ccccc3 62a_100000211591_100015423560 [0,1,0,0,1,0|2,0,0]=4 681 B23R3.26514 FC1CCCCC1SC(c2ccccc2)c3ccccc3 62a_100015423560_100011216954 [0,1,0,0,1,0|2,0,0]=4 682 B23R3.26514 F[C@@H]1CCCC[C@H]1OC(c2ccccc2)c3ccccc3 7a_100009816020_100011216954 [0,1,0,0,1,0|2,0,0]=4 683 B23R3.38539 Brc1ccccc1C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100000198044 [0,1,0,0,1,0|2,0,0]=4 684 B23R3.38539 Brc1ccccc1C(NC2CCCCC2)c3ccccc3 270004a_100011211563_100000210434 [0,1,0,0,1,0|2,0,0]=4 685 B23R3.38539 Brc1ccccc1C(NC2CCCCC2)c3ccccc3 34a_100011211563_100000210327 [0,1,0,0,1,0|2,0,0]=4 686 B23R3.38539 Cc1ccccc1C(NC2CCCCC2)c3ccccc3 2230a_100000182618_100000230135 [0,1,0,0,1,0|2,0,0]=4 687 B23R3.38539 Cc1ccccc1C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100000735561 [0,1,0,0,1,0|2,0,0]=4 688 B23R3.38539 Cc1ccccc1C(NC2CCCCC2)c3ccccc3 270004a_100000222801_100000210434 [0,1,0,0,1,0|2,0,0]=4 689 B23R3.38539 Cc1ccccc1C(NC2CCCCC2)c3ccccc3 34a_100000222801_100000210327 [0,1,0,0,1,0|2,0,0]=4 690 B23R3.38539 Cc1ccccc1C(OC2CCCCC2)c3ccccc3 34a_100000212071_100000210327 [0,1,0,0,1,0|2,0,0]=4 691 B23R3.38539 Cc1ccccc1C(OC2CCCCC2)c3ccccc3 7a_100000210231_100000230135 [0,1,0,0,1,0|2,0,0]=4 692 B23R3.38539 Cc1ccccc1C(OC2CCCCC2)c3ccccc3 7a_100000212071_100000210327 [0,1,0,0,1,0|2,0,0]=4 693 B23R3.38539 Clc1ccccc1C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100011215288 [0,1,0,0,1,0|2,0,0]=4 694 B23R3.38539 Clc1ccccc1C(OC2CCCCC2)c3ccccc3 34a_200011400577_100000210327 [0,1,0,0,1,0|2,0,0]=4 695 B23R3.38539 Clc1ccccc1C(OC2CCCCC2)c3ccccc3 7a_200011400577_100000210327 [0,1,0,0,1,0|2,0,0]=4 696 B23R3.51087 CC(OC1CCCCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100000210327 [0,1,0,0,1,0|2,0,0]=4 697 B23R3.68581 Brc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100000718703 [0,1,0,0,1,0|2,0,0]=4 698 B23R3.68581 Brc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000745999_100000210434 [0,1,0,0,1,0|2,0,0]=4 699 B23R3.68581 Brc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 34a_100000745999_100000210327 [0,1,0,0,1,0|2,0,0]=4 700 B23R3.68581 Brc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 34a_100011217567_100000210327 [0,1,0,0,1,0|2,0,0]=4 701 B23R3.68581 Brc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_100011217567_100000210327 [0,1,0,0,1,0|2,0,0]=4 702 B23R3.68581 Cc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100000210966 [0,1,0,0,1,0|2,0,0]=4 703 B23R3.68581 Cc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000736602_100000210434 [0,1,0,0,1,0|2,0,0]=4 704 B23R3.68581 Cc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 34a_100000736602_100000210327 [0,1,0,0,1,0|2,0,0]=4 705 B23R3.68581 Cc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 34a_100000212064_100000210327 [0,1,0,0,1,0|2,0,0]=4 706 B23R3.68581 Cc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_100000212064_100000210327 [0,1,0,0,1,0|2,0,0]=4 707 B23R3.68581 Clc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 2230a_100000182618_100000211669 [0,1,0,0,1,0|2,0,0]=4 708 B23R3.68581 Clc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100000211064 [0,1,0,0,1,0|2,0,0]=4 709 B23R3.68581 Clc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000737946_100000210434 [0,1,0,0,1,0|2,0,0]=4 710 B23R3.68581 Clc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 34a_100000737946_100000210327 [0,1,0,0,1,0|2,0,0]=4 711 B23R3.68581 Clc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 34a_100000211768_100000210327 [0,1,0,0,1,0|2,0,0]=4 712 B23R3.68581 Clc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_100000210231_100000211669 [0,1,0,0,1,0|2,0,0]=4 713 B23R3.68581 Clc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_100000211768_100000210327 [0,1,0,0,1,0|2,0,0]=4 714 B23R3.68581 Fc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 34a_200000246460_100000210327 [0,1,0,0,1,0|2,0,0]=4 715 B23R3.68581 Fc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_200000246460_100000210327 [0,1,0,0,1,0|2,0,0]=4 716 B23R3.1995413 CN(C1CCCCC1)C(c2ccccc2)c3ccccc3 2230a_100000207522_100000211591 [0,1,0,0,1,0|2,0,0]=4 717 B23R3.1995413 CN(C1CCCCC1)C(c2ccccc2)c3ccccc3 269982a_100000207522_100000211591 [0,1,0,0,1,0|2,0,0]=4 718 B23R3.1995413 CN(C1CCCCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100000210327 [0,1,0,0,1,0|2,0,0]=4 719 B23R3.1995413 CN(C1CCCCC1)C(c2ccccc2)c3ccccc3 270004a_100000207522_100000210122 [0,1,0,0,1,0|2,0,0]=4 720 B23R3.1995413 CN(C1CCCCC1)C(c2ccccc2)c3ccccc3 270004a_100103148541_100000210434 [0,1,0,0,1,0|2,0,0]=4 721 B23R3.9259605 CC1(CCCCC1)NC(c2ccccc2)c3ccccc3 2230a_100000741114_100000211591 [0,1,0,0,1,0|2,0,0]=4 722 B23R3.9259605 CC1(CCCCC1)NC(c2ccccc2)c3ccccc3 270004a_100000741114_100000210122 [0,1,0,0,1,0|2,0,0]=4 723 B23R3.9259605 CC1(CCCCC1)OC(c2ccccc2)c3ccccc3 7a_100011215885_100011216954 [0,1,0,0,1,0|2,0,0]=4 724 B23R3.5136 CC(OC(c1ccccc1)c2ccccc2)C3CCCC3 7a_100011216366_100011216954 [0,1,0,0,1,0|2,0,0]=4 725 B23R3.136526 Brc1cccc(c1)C(NCC2CCCC2)c3ccccc3 2230a_100011212009_100000740388 [0,1,0,0,1,0|2,0,0]=4 726 B23R3.136526 Brc1cccc(c1)C(NCC2CCCC2)c3ccccc3 269862a_100011212009_100000746403 [0,1,0,0,1,0|2,0,0]=4 727 B23R3.136526 Brc1cccc(c1)C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100011267660 [0,1,0,0,1,0|2,0,0]=4 728 B23R3.136526 Brc1cccc(c1)C(NCC2CCCC2)c3ccccc3 34a_100011212009_100000740388 [0,1,0,0,1,0|2,0,0]=4 729 B23R3.136526 Clc1cccc(c1)C(NCC2CCCC2)c3ccccc3 2230a_100000741085_100000740388 [0,1,0,0,1,0|2,0,0]=4 730 B23R3.136526 Clc1cccc(c1)C(NCC2CCCC2)c3ccccc3 269862a_100000741085_100000746403 [0,1,0,0,1,0|2,0,0]=4 731 B23R3.136526 Clc1cccc(c1)C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100011215489 [0,1,0,0,1,0|2,0,0]=4 732 B23R3.136526 Clc1cccc(c1)C(NCC2CCCC2)c3ccccc3 34a_100000741085_100000740388 [0,1,0,0,1,0|2,0,0]=4 733 B23R3.136526 Clc1cccc(c1)C(OCC2CCCC2)c3ccccc3 34a_100000733576_100000740388 [0,1,0,0,1,0|2,0,0]=4 734 B23R3.136526 Clc1cccc(c1)C(OCC2CCCC2)c3ccccc3 7a_100000733576_100000740388 [0,1,0,0,1,0|2,0,0]=4 735 B23R3.136526 Fc1cccc(c1)C(OCC2CCCC2)c3ccccc3 34a_100000749007_100000740388 [0,1,0,0,1,0|2,0,0]=4 736 B23R3.136526 Fc1cccc(c1)C(OCC2CCCC2)c3ccccc3 7a_100000749007_100000740388 [0,1,0,0,1,0|2,0,0]=4 737 B23R3.155183 Brc1ccccc1C(NCC2CCCC2)c3ccccc3 2230a_100011211563_100000740388 [0,1,0,0,1,0|2,0,0]=4 738 B23R3.155183 Brc1ccccc1C(NCC2CCCC2)c3ccccc3 269862a_100011211563_100000746403 [0,1,0,0,1,0|2,0,0]=4 739 B23R3.155183 Brc1ccccc1C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100000198044 [0,1,0,0,1,0|2,0,0]=4 740 B23R3.155183 Brc1ccccc1C(NCC2CCCC2)c3ccccc3 34a_100011211563_100000740388 [0,1,0,0,1,0|2,0,0]=4 741 B23R3.155183 Cc1ccccc1C(OCC2CCCC2)c3ccccc3 34a_100000212071_100000740388 [0,1,0,0,1,0|2,0,0]=4 742 B23R3.155183 Cc1ccccc1C(OCC2CCCC2)c3ccccc3 7a_100000212071_100000740388 [0,1,0,0,1,0|2,0,0]=4 743 B23R3.155183 Cc1ccccc1C(OCC2CCCC2)c3ccccc3 7a_100000742336_100000230135 [0,1,0,0,1,0|2,0,0]=4 744 B23R3.155183 Clc1ccccc1C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100011215288 [0,1,0,0,1,0|2,0,0]=4 745 B23R3.155183 Clc1ccccc1C(OCC2CCCC2)c3ccccc3 34a_200011400577_100000740388 [0,1,0,0,1,0|2,0,0]=4 746 B23R3.155183 Clc1ccccc1C(OCC2CCCC2)c3ccccc3 7a_200011400577_100000740388 [0,1,0,0,1,0|2,0,0]=4 747 B23R3.1300508 Brc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 2230a_100000745999_100000740388 [0,1,0,0,1,0|2,0,0]=4 748 B23R3.1300508 Brc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 269862a_100000745999_100000746403 [0,1,0,0,1,0|2,0,0]=4 749 B23R3.1300508 Brc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100000718703 [0,1,0,0,1,0|2,0,0]=4 750 B23R3.1300508 Brc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 34a_100000745999_100000740388 [0,1,0,0,1,0|2,0,0]=4 751 B23R3.1300508 Brc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 34a_100011217567_100000740388 [0,1,0,0,1,0|2,0,0]=4 752 B23R3.1300508 Brc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 7a_100011217567_100000740388 [0,1,0,0,1,0|2,0,0]=4 753 B23R3.1300508 Cc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 34a_100000212064_100000740388 [0,1,0,0,1,0|2,0,0]=4 754 B23R3.1300508 Cc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 7a_100000212064_100000740388 [0,1,0,0,1,0|2,0,0]=4 755 B23R3.1300508 Clc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 2230a_100000737946_100000740388 [0,1,0,0,1,0|2,0,0]=4 756 B23R3.1300508 Clc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 2230a_100000737975_100000211669 [0,1,0,0,1,0|2,0,0]=4 757 B23R3.1300508 Clc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 269862a_100000737946_100000746403 [0,1,0,0,1,0|2,0,0]=4 758 B23R3.1300508 Clc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100000211064 [0,1,0,0,1,0|2,0,0]=4 759 B23R3.1300508 Clc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 34a_100000737946_100000740388 [0,1,0,0,1,0|2,0,0]=4 760 B23R3.1300508 Clc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 34a_100000211768_100000740388 [0,1,0,0,1,0|2,0,0]=4 761 B23R3.1300508 Clc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 7a_100000211768_100000740388 [0,1,0,0,1,0|2,0,0]=4 762 B23R3.1300508 Clc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 7a_100000742336_100000211669 [0,1,0,0,1,0|2,0,0]=4 763 B23R3.1300508 Fc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 34a_200000246460_100000740388 [0,1,0,0,1,0|2,0,0]=4 764 B23R3.1300508 Fc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 7a_200000246460_100000740388 [0,1,0,0,1,0|2,0,0]=4 765 B23R3.1958141 CC(OCC1CCCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100000740388 [0,1,0,0,1,0|2,0,0]=4 766 B25R3.23392 Cc1ccc(cc1)CC(NCC2CCCCC2)c3ccccc3 2230a_217856618520_100000211423 [0,1,0,0,0,1|2,0,0]=4 767 B25R3.23392 Cc1ccc(cc1)CC(NCC2CCCCC2)c3ccccc3 269862a_217856618520_100000211278 [0,1,0,0,0,1|2,0,0]=4 768 B25R3.23392 Cc1ccc(cc1)CC(NCC2CCCCC2)c3ccccc3 34a_217856618520_100000211423 [0,1,0,0,0,1|2,0,0]=4 769 B25R3.25239 Cc1cccc(c1)N(CCC2CCCCC2)Cc3ccccc3 2230a_100000185206_100012355289 [0,1,0,0,0,1|2,0,0]=4 770 B25R3.25239 Cc1cccc(c1)N(CCC2CCCCC2)Cc3ccccc3 269982a_100000185206_100011273959 [0,1,0,0,0,1|2,0,0]=4 771 B25R3.25239 Cc1cccc(c1)N(CCC2CCCCC2)Cc3ccccc3 34a_100000185206_100011209188 [0,1,0,0,0,1|2,0,0]=4 772 B25R3.25239 Fc1cccc(c1)N(CCC2CCCCC2)Cc3ccccc3 2230a_100102952868_100012355289 [0,1,0,0,0,1|2,0,0]=4 773 B25R3.25239 Fc1cccc(c1)N(CCC2CCCCC2)Cc3ccccc3 269982a_100102952868_100011273959 [0,1,0,0,0,1|2,0,0]=4 774 B25R3.25239 Fc1cccc(c1)N(CCC2CCCCC2)Cc3ccccc3 34a_100102952868_100011209188 [0,1,0,0,0,1|2,0,0]=4 775 B25R3.26011 Cc1ccccc1N(CCC2CCCCC2)Cc3ccccc3 2230a_100102946366_100012355289 [0,1,0,0,0,1|2,0,0]=4 776 B25R3.26011 Cc1ccccc1N(CCC2CCCCC2)Cc3ccccc3 269982a_100102946366_100011273959 [0,1,0,0,0,1|2,0,0]=4 777 B25R3.26011 Cc1ccccc1N(CCC2CCCCC2)Cc3ccccc3 34a_100102946366_100011209188 [0,1,0,0,0,1|2,0,0]=4 778 B25R3.26011 Fc1ccccc1N(CCC2CCCCC2)Cc3ccccc3 2230a_100025753533_100012355289 [0,1,0,0,0,1|2,0,0]=4 779 B25R3.26011 Fc1ccccc1N(CCC2CCCCC2)Cc3ccccc3 269982a_100025753533_100011273959 [0,1,0,0,0,1|2,0,0]=4 780 B25R3.26011 Fc1ccccc1N(CCC2CCCCC2)Cc3ccccc3 34a_100025753533_100011209188 [0,1,0,0,0,1|2,0,0]=4 781 B25R3.45367 Fc1ccccc1CN(CCC2CCCCC2)c3ccccc3 2230a_100000224004_100012355289 [0,1,0,0,0,1|2,0,0]=4 782 B25R3.45367 Fc1ccccc1CN(CCC2CCCCC2)c3ccccc3 269982a_100000224004_100011273959 [0,1,0,0,0,1|2,0,0]=4 783 B25R3.45367 Fc1ccccc1CN(CCC2CCCCC2)c3ccccc3 34a_100000224004_100011209188 [0,1,0,0,0,1|2,0,0]=4 784 B25R3.82774 O=C(CC1CCCCC1)C(Cc2ccccc2)c3ccccc3 1458a_200000261918_100000211423 [0,1,0,0,0,1|1,0,1]=4 785 B25R3.83042 CC(NC(Cc1ccccc1)c2ccccc2)C3CCCCC3 269862a_100025772854_100000210989 [0,1,0,0,0,1|2,0,0]=4 786 B25R3.114826 Cc1ccc(cc1)N(CCC2CCCCC2)Cc3ccccc3 2230a_100000185259_100012355289 [0,1,0,0,0,1|2,0,0]=4 787 B25R3.114826 Cc1ccc(cc1)N(CCC2CCCCC2)Cc3ccccc3 269982a_100000185259_100011273959 [0,1,0,0,0,1|2,0,0]=4 788 B25R3.114826 Cc1ccc(cc1)N(CCC2CCCCC2)Cc3ccccc3 34a_100000185259_100011209188 [0,1,0,0,0,1|2,0,0]=4 789 B25R3.114826 Fc1ccc(cc1)C(Cc2ccccc2)NCC3CCCCC3 2230a_103496528834_100000211423 [0,1,0,0,0,1|2,0,0]=4 790 B25R3.114826 Fc1ccc(cc1)C(Cc2ccccc2)NCC3CCCCC3 269862a_103496528834_100000211278 [0,1,0,0,0,1|2,0,0]=4 791 B25R3.114826 Fc1ccc(cc1)C(Cc2ccccc2)NCC3CCCCC3 34a_103496528834_100000211423 [0,1,0,0,0,1|2,0,0]=4 792 B25R3.114826 Oc1ccc(cc1)N(CCC2CCCCC2)Cc3ccccc3 269982a_200000188756_100011273959 [0,1,0,0,0,1|2,0,0]=4 793 B25R3.114826 Oc1ccc(cc1)N(CCC2CCCCC2)Cc3ccccc3 34a_200000188756_100011209188 [0,1,0,0,0,1|2,0,0]=4 794 B25R3.2109392 N[C@H](c1ccccc1)[C@@H](OCC2CCCCC2)c3ccccc3 34a_100000765503_100000211423 [0,1,0,0,0,1|2,0,0]=4 795 B25R3.2109392 O=C(c1ccccc1)C(OCC2CCCCC2)c3ccccc3 7a_100000185998_100000211423 [0,1,0,0,0,1|2,0,0]=4 796 B25R3.2109392 O=C(c1ccccc1)C(OCC2CCCCC2)c3ccccc3 7a_100000212181_100000211254 [0,1,0,0,0,1|2,0,0]=4 797 B25R3.2109392 O=C(c1ccccc1)C(SCC2CCCCC2)c3ccccc3 62a_100000211254_100000211423 [0,1,0,0,0,1|2,0,0]=4 798 B25R3.2109392 O=C(c1ccccc1)C(SCC2CCCCC2)c3ccccc3 62a_100000211423_100000211254 [0,1,0,0,0,1|2,0,0]=4 799 B25R3.18363891 CC1(CCCCC1)CNC(Cc2ccccc2)c3ccccc3 269862a_100025772854_100011935227 [0,1,0,0,0,1|2,0,0]=4 800 B25R3.20636 CC(NCC(c1ccccc1)c2ccccc2)C3CCCCC3 269862a_100000739227_100000210989 [0,1,0,0,0,1|1,0,0]=3 801 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 2230a_100000207522_100009813428 [0,1,0,0,0,1|1,0,0]=3 802 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 269982a_100000207522_100009813428 [0,1,0,0,0,1|1,0,0]=3 803 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 269982a_100025726140_100000210327 [0,1,0,0,0,1|1,0,0]=3 804 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 270004a_100025726140_100000210434 [0,1,0,0,0,1|1,0,0]=3 805 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 34a_100000207522_100009813428 [0,1,0,0,0,1|1,0,0]=3 806 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 34a_100025726140_100000210327 [0,1,0,0,0,1|1,0,0]=3 807 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCSC3 270004a_100025726140_100000057913 [0,1,0,0,0,1|2,0,0]=4 808 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 2230a_100015184757_100009813428 [0,1,0,0,0,1|2,0,0]=4 809 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 269982a_100015184757_100009813428 [0,1,0,0,0,1|2,0,0]=4 810 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 269982a_100025726140_100000069128 [0,1,0,0,0,1|2,0,0]=4 811 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 270004a_100025726140_100000203788 [0,1,0,0,0,1|2,0,0]=4 812 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 34a_100015184757_100009813428 [0,1,0,0,0,1|2,0,0]=4 813 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 34a_100025726140_100000069128 [0,1,0,0,0,1|2,0,0]=4 814 B25R3.20636 O=C(CCC(c1ccccc1)c2ccccc2)C3=CCCCC3 1458a_100000765259_100009813428 [0,1,0,0,0,1|1,0,1]=4 815 B25R3.20636 O=C(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 1458a_100000210647_100009813428 [0,1,0,0,0,1|1,0,0]=3 816 B25R3.20636 O=C(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 1458a_100000755232_100009813428 [0,1,0,0,0,1|2,0,0]=4 817 B25R3.20636 O=C(CC[S+](c1ccccc1)c2ccccc2)C3CCCCC3 1458a_100000210647_100010140906 [0,1,0,0,0,1|2,0,0]=4 818 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)C3CCCCC3 1458a_100000683935_100000210327 [0,1,0,0,0,1|1,0,1]=4 819 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)C3CCCCC3 62a_100000211591_100000241979 [0,1,0,0,0,1|1,0,1]=4 820 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)C3CCCCC3 62a_100000241979_100011216954 [0,1,0,0,0,1|1,0,1]=4 821 B25R3.25375 CC1CCCC(C1)NCCC(c2ccccc2)c3ccccc3 2230a_100011194320_100009813428 [0,1,0,0,0,1|1,0,0]=3 822 B25R3.25375 CC1CCCC(C1)NCCC(c2ccccc2)c3ccccc3 270004a_100000272388_100000183594 [0,1,0,0,0,1|1,0,0]=3 823 B25R3.25375 CC1CCCC(C1)NCCC(c2ccccc2)c3ccccc3 34a_100011194320_100009813428 [0,1,0,0,0,1|1,0,0]=3 824 B25R3.25375 CC1CCCC(C1)OCCC(c2ccccc2)c3ccccc3 34a_100000211399_100009813428 [0,1,0,0,0,1|1,0,0]=3 825 B25R3.25375 CC1CCCN(C1)CCSC(c2ccccc2)c3ccccc3 62a_100000211591_100000766211 [0,1,0,0,0,1|0,0,0]=2 826 B25R3.26173 CC1CCCCC1NCCC(c2ccccc2)c3ccccc3 2230a_100000211402_100009813428 [0,1,0,0,0,1|1,0,0]=3 827 B25R3.26173 CC1CCCCC1NCCC(c2ccccc2)c3ccccc3 269862a_100000272388_100000210921 [0,1,0,0,0,1|1,0,0]=3 828 B25R3.26173 CC1CCCCC1NCCC(c2ccccc2)c3ccccc3 270004a_100000272388_100000210921 [0,1,0,0,0,1|1,0,0]=3 829 B25R3.26173 CC1CCCCC1NCCC(c2ccccc2)c3ccccc3 34a_100000211402_100009813428 [0,1,0,0,0,1|1,0,0]=3 830 B25R3.26173 CC1CCCCC1OCCC(c2ccccc2)c3ccccc3 34a_100000211207_100009813428 [0,1,0,0,0,1|1,0,0]=3 831 B25R3.26173 CC1CCCCC1OCCC(c2ccccc2)c3ccccc3 7a_100000211207_100009813428 [0,1,0,0,0,1|1,0,0]=3 832 B25R3.26173 CC1CCCCC1OCC[S+](c2ccccc2)c3ccccc3 7a_100000211207_100010140906 [0,1,0,0,0,1|2,0,0]=4 833 B25R3.26173 CN1CCCCC1CCSC(c2ccccc2)c3ccccc3 62a_100000211591_100000211948 [0,1,0,0,0,1|2,0,0]=4 834 B25R3.26173 CN1CCCCC1CCSC(c2ccccc2)c3ccccc3 62a_100000211948_100011216954 [0,1,0,0,0,1|2,0,0]=4 835 B25R3.26173 ClC1CCCCC1OCCC(c2ccccc2)c3ccccc3 34a_100000038908_100009813428 [0,1,0,0,0,1|1,0,0]=3 836 B25R3.26173 ClC1CCCCC1OCCC(c2ccccc2)c3ccccc3 7a_100000038908_100009813428 [0,1,0,0,0,1|1,0,0]=3 837 B25R3.26173 ClC1CCCCC1OCC[S+](c2ccccc2)c3ccccc3 7a_100000038908_100010140906 [0,1,0,0,0,1|2,0,0]=4 838 B25R3.26173 FC1CCCCC1NCCC(c2ccccc2)c3ccccc3 34a_100000272388_100015423560 [0,1,0,0,0,1|1,0,0]=3 839 B25R3.26173 FC1CCCCC1OCCC(c2ccccc2)c3ccccc3 34a_100000032380_100015423560 [0,1,0,0,0,1|1,0,0]=3 840 B25R3.26173 FC1CCCCC1OCCN(c2ccccc2)c3ccccc3 34a_100010001939_100015423560 [0,1,0,0,0,1|2,0,0]=4 841 B25R3.26173 FC1CCCCC1SCC[S+](c2ccccc2)c3ccccc3 62a_100010140906_100015423560 [0,1,0,0,0,1|2,0,0]=4 842 B25R3.26173 FC1CCCCC1SCC[S+](c2ccccc2)c3ccccc3 62a_100015423560_100010140906 [0,1,0,0,0,1|2,0,0]=4 843 B25R3.26173 F[C@@H]1CCCC[C@H]1NCCC(c2ccccc2)c3ccccc3 2230a_100015195156_100009813428 [0,1,0,0,0,1|1,0,0]=3 844 B25R3.26173 F[C@@H]1CCCC[C@H]1NCCC(c2ccccc2)c3ccccc3 34a_100015195156_100009813428 [0,1,0,0,0,1|1,0,0]=3 845 B25R3.26173 F[C@@H]1CCCC[C@H]1OCCC(c2ccccc2)c3ccccc3 34a_100009816020_100009813428 [0,1,0,0,0,1|1,0,0]=3 846 B25R3.26173 F[C@@H]1CCCC[C@H]1OCCC(c2ccccc2)c3ccccc3 7a_100009816020_100009813428 [0,1,0,0,0,1|1,0,0]=3 847 B25R3.26173 F[C@@H]1CCCC[C@H]1OCC[S+](c2ccccc2)c3ccccc3 7a_100009816020_100010140906 [0,1,0,0,0,1|2,0,0]=4 848 B25R3.26173 O=C1CCCCC1SCCC(c2ccccc2)c3ccccc3 62a_100000204591_100009813428 [0,1,0,0,0,1|1,0,1]=4 849 B25R3.26173 O=C1CCCCC1SCCC(c2ccccc2)c3ccccc3 62a_100009813428_100000204591 [0,1,0,0,0,1|1,0,1]=4 850 B25R3.26173 OC1CCCCC1SCCC(c2ccccc2)c3ccccc3 62a_100000038908_100009813428 [0,1,0,0,0,1|1,0,0]=3 851 B25R3.26173 OC1CCCCC1SCCC(c2ccccc2)c3ccccc3 62a_100009813428_100000038908 [0,1,0,0,0,1|1,0,0]=3 852 B25R3.61794 Brc1ccccc1C(NCCC2CCCCC2)c3cccnc3 270004a_100000738074_100011532686 [0,1,0,0,0,1|2,0,0]=4 853 B25R3.61794 Brc1ccccc1C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100000198044 [0,1,0,0,0,1|2,0,0]=4 854 B25R3.61794 Brc1ccccc1C(NCOC2CCCCC2)c3ccccc3 2230a_100011211563_100011935260 [0,1,0,0,0,1|2,0,0]=4 855 B25R3.61794 Brc1ccccc1C(NCOC2CCCCC2)c3ccccc3 34a_100011211563_100011935260 [0,1,0,0,0,1|2,0,0]=4 856 B25R3.61794 Cc1ccccc1C(NCCC2=CCCCC2)c3ccccc3 2230a_100000212019_100000230135 [0,1,0,0,0,1|1,0,1]=4 857 B25R3.61794 Cc1ccccc1C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100000735561 [0,1,0,0,0,1|1,0,1]=4 858 B25R3.61794 Cc1ccccc1C(NCCC2CCCCC2)c3ccccc3 2230a_100000222801_100012355289 [0,1,0,0,0,1|1,0,0]=3 859 B25R3.61794 Cc1ccccc1C(NCCC2CCCCC2)c3ccccc3 2230a_100000738074_100000230135 [0,1,0,0,0,1|1,0,0]=3 860 B25R3.61794 Cc1ccccc1C(NCCC2CCCCC2)c3ccccc3 270004a_100000222801_100011713444 [0,1,0,0,0,1|1,0,0]=3 861 B25R3.61794 Cc1ccccc1C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100000735561 [0,1,0,0,0,1|1,0,0]=3 862 B25R3.61794 Cc1ccccc1C(NCCC2CCCCC2)c3ccccc3 34a_100000222801_100011209188 [0,1,0,0,0,1|1,0,0]=3 863 B25R3.61794 Cc1ccccc1C(NCCC2CCCCC2)c3ccncc3 2230a_100015184055_100012355289 [0,1,0,0,0,1|2,0,0]=4 864 B25R3.61794 Cc1ccccc1C(NCCC2CCCCC2)c3ccncc3 270004a_100015184055_100011713444 [0,1,0,0,0,1|2,0,0]=4 865 B25R3.61794 Cc1ccccc1C(OCOC2CCCCC2)c3ccccc3 34a_100000212071_100011935260 [0,1,0,0,0,1|2,0,0]=4 866 B25R3.61794 Cc1ccccc1C(OCOC2CCCCC2)c3ccccc3 7a_100000212071_100011935260 [0,1,0,0,0,1|2,0,0]=4 867 B25R3.61794 Cc1ccccc1C(SCCC2CCOCC2)c3ccccc3 62a_100000230135_100011934994 [0,1,0,0,0,1|2,0,0]=4 868 B25R3.61794 Cc1ccccc1C(SCCC2CCOCC2)c3ccccc3 62a_100011934994_100000230135 [0,1,0,0,0,1|2,0,0]=4 869 B25R3.61794 Cc1ccccc1C(SCCN2CCCCC2)c3ccccc3 62a_100000230135_100000739454 [0,1,0,0,0,1|0,0,0]=2 870 B25R3.61794 Cc1ccccc1C(SCCN2CCCCC2)c3ccccc3 62a_100000739454_100000230135 [0,1,0,0,0,1|0,0,0]=2 871 B25R3.61794 Clc1ccccc1C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100011215288 [0,1,0,0,0,1|1,0,1]=4 872 B25R3.61794 Clc1ccccc1C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100011215288 [0,1,0,0,0,1|1,0,0]=3 873 B25R3.61794 Clc1ccccc1C(NCCC2CCCCC2)c3ccccn3 270004a_100000738074_100011400554 [0,1,0,0,0,1|2,0,0]=4 874 B25R3.61794 Clc1ccccc1C(NCCC2CCCCC2)c3cccnc3 270004a_100000738074_200011400555 [0,1,0,0,0,1|2,0,0]=4 875 B25R3.61794 Clc1ccccc1C(OCCC2CCOCC2)c3ccccc3 34a_200011400577_100011934994 [0,1,0,0,0,1|2,0,0]=4 876 B25R3.61794 Clc1ccccc1C(OCCC2CCOCC2)c3ccccc3 7a_200011400577_100011934994 [0,1,0,0,0,1|2,0,0]=4 877 B25R3.61794 Clc1ccccc1C(OCOC2CCCCC2)c3ccccc3 34a_200011400577_100011935260 [0,1,0,0,0,1|2,0,0]=4 878 B25R3.61794 Clc1ccccc1C(OCOC2CCCCC2)c3ccccc3 7a_200011400577_100011935260 [0,1,0,0,0,1|2,0,0]=4 879 B25R3.61794 Fc1ccccc1C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100011217773 [0,1,0,0,0,1|1,0,1]=4 880 B25R3.61794 Fc1ccccc1C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100011217773 [0,1,0,0,0,1|1,0,0]=3 881 B25R3.61794 Nc1ccccc1C(OCCC2CCCCC2)c3ccccc3 34a_100000246470_100011209188 [0,1,0,0,0,1|1,0,0]=3 882 B25R3.61794 Nc1ccccc1C(OCCC2CCCCC2)c3ccccc3 7a_100000246470_100011273959 [0,1,0,0,0,1|1,0,0]=3 883 B25R3.82807 CC(CC(c1ccccc1)c2ccccc2)NC3CCCCC3 270004a_100000182618_200000011111 [0,1,0,0,0,1|1,0,0]=3 884 B25R3.82807 CC(CC(c1ccccc1)c2ccccc2)NC3CCSCC3 270004a_100000748639_200000011111 [0,1,0,0,0,1|2,0,0]=4 885 B25R3.82807 CC(CC1CCCCC1)NC(c2ccccc2)c3ccccc3 270004a_100000162943_100011215996 [0,1,0,0,0,1|1,0,0]=3 886 B25R3.82807 CC(CC1CCCCC1)NC(c2ccccc2)c3ccccn3 270004a_100000689936_100011215996 [0,1,0,0,0,1|2,0,0]=4 887 B25R3.82807 CC(CC1CCCCC1)NC(c2ccccc2)c3cccnc3 270004a_100011232609_100011215996 [0,1,0,0,0,1|2,0,0]=4 888 B25R3.82807 CC(CC1CCCCC1)NC(c2ccccc2)c3ccncc3 270004a_100025760769_100011215996 [0,1,0,0,0,1|2,0,0]=4 889 B25R3.82807 CC(CN1CCCCC1)SC(c2ccccc2)c3ccccc3 62a_100000211591_100009831500 [0,1,0,0,0,1|0,0,0]=2 890 B25R3.82807 CC(CN1CCCCC1)SC(c2ccccc2)c3ccccc3 62a_100009831500_100011216954 [0,1,0,0,0,1|0,0,0]=2 891 B25R3.82807 O=C(CC1CCCCC1)CC(c2ccccc2)c3ccccc3 1458a_100000499737_100000211423 [0,1,0,0,0,1|1,0,0]=3 892 B25R3.114844 C=C1CCC(CC1)NCCC(c2ccccc2)c3ccccc3 270004a_100000272388_100010272673 [0,1,0,0,0,1|1,0,1]=4 893 B25R3.114844 CC1CCC(CC1)NCCC(c2ccccc2)c3ccccc3 270004a_100000272388_100000185489 [0,1,0,0,0,1|1,0,0]=3 894 B25R3.114844 CC1CCC(CC1)NCCC(c2ccccc2)c3ccccc3 34a_100000272388_200011216234 [0,1,0,0,0,1|1,0,0]=3 895 B25R3.114844 CC1CCC(CC1)OCCC(c2ccccc2)c3ccccc3 34a_100000032380_200011216234 [0,1,0,0,0,1|1,0,0]=3 896 B25R3.114844 CC1CCC(CC1)OCCC(c2ccccc2)c3ccccc3 34a_100000210714_100009813428 [0,1,0,0,0,1|1,0,0]=3 897 B25R3.114844 CC1CCC(CC1)OCCC(c2ccccc2)c3ccccc3 7a_100000210714_100009813428 [0,1,0,0,0,1|1,0,0]=3 898 B25R3.114844 CC1CCC(CC1)OCCN(c2ccccc2)c3ccccc3 34a_100010001939_200011216234 [0,1,0,0,0,1|2,0,0]=4 899 B25R3.114844 CC1CCC(CC1)OCC[S+](c2ccccc2)c3ccccc3 7a_100000210714_100010140906 [0,1,0,0,0,1|2,0,0]=4 900 B25R3.114844 CN1CCC(CC1)SCCC(c2ccccc2)c3ccccc3 62a_100009813428_100011215917 [0,1,0,0,0,1|2,0,0]=4 901 B25R3.114844 C[C@H]1CC[C@@H](CC1)NCCC(c2ccccc2)c3ccccc3 2230a_100020625639_100009813428 [0,1,0,0,0,1|1,0,0]=3 902 B25R3.114844 C[C@H]1CC[C@@H](CC1)NCCC(c2ccccc2)c3ccccc3 34a_100020625639_100009813428 [0,1,0,0,0,1|1,0,0]=3 903 B25R3.121526 Brc1ccc(cc1)C(NCCC2CCCCC2)c3ccccn3 270004a_100000738074_200010179208 [0,1,0,0,0,1|2,0,0]=4 904 B25R3.121526 Brc1ccc(cc1)C(NCCC2CCCCC2)c3cccnc3 270004a_100000738074_100000753996 [0,1,0,0,0,1|2,0,0]=4 905 B25R3.121526 Brc1ccc(cc1)C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100000718703 [0,1,0,0,0,1|2,0,0]=4 906 B25R3.121526 Brc1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 2230a_100000745999_100011935260 [0,1,0,0,0,1|2,0,0]=4 907 B25R3.121526 Brc1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 34a_100000745999_100011935260 [0,1,0,0,0,1|2,0,0]=4 908 B25R3.121526 Brc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 34a_100011217567_100011934994 [0,1,0,0,0,1|2,0,0]=4 909 B25R3.121526 Brc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 7a_100011217567_100011934994 [0,1,0,0,0,1|2,0,0]=4 910 B25R3.121526 Brc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 34a_100011217567_100000739454 [0,1,0,0,0,1|0,0,0]=2 911 B25R3.121526 Brc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 7a_100011217567_100000739454 [0,1,0,0,0,1|0,0,0]=2 912 B25R3.121526 Brc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 34a_100011217567_100011935260 [0,1,0,0,0,1|2,0,0]=4 913 B25R3.121526 Brc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 7a_100011217567_100011935260 [0,1,0,0,0,1|2,0,0]=4 914 B25R3.121526 Cc1ccc(cc1)C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100000210966 [0,1,0,0,0,1|1,0,1]=4 915 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000736602_100012355289 [0,1,0,0,0,1|1,0,0]=3 916 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000736602_100011713444 [0,1,0,0,0,1|1,0,0]=3 917 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100000210966 [0,1,0,0,0,1|1,0,0]=3 918 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 34a_100000736602_100011209188 [0,1,0,0,0,1|1,0,0]=3 919 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCCCC2)c3ccncc3 270004a_200015185284_100011713444 [0,1,0,0,0,1|2,0,0]=4 920 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCCCC2)c3ccncc3 34a_200015185284_100011209188 [0,1,0,0,0,1|2,0,0]=4 921 B25R3.121526 Cc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 34a_100000212064_100011935260 [0,1,0,0,0,1|2,0,0]=4 922 B25R3.121526 Cc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 7a_100000212064_100011935260 [0,1,0,0,0,1|2,0,0]=4 923 B25R3.121526 Clc1ccc(cc1)C(NCCC2=CCCCC2)c3ccccc3 2230a_100000212019_100000211669 [0,1,0,0,0,1|1,0,1]=4 924 B25R3.121526 Clc1ccc(cc1)C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100000211064 [0,1,0,0,0,1|1,0,1]=4 925 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000737946_100012355289 [0,1,0,0,0,1|1,0,0]=3 926 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000738074_100000211669 [0,1,0,0,0,1|1,0,0]=3 927 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000737946_100011713444 [0,1,0,0,0,1|1,0,0]=3 928 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100000211064 [0,1,0,0,0,1|1,0,0]=3 929 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 34a_100000737946_100011209188 [0,1,0,0,0,1|1,0,0]=3 930 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccn3 2230a_100000738074_200010188304 [0,1,0,0,0,1|2,0,0]=4 931 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccn3 270004a_100000738074_100000753647 [0,1,0,0,0,1|2,0,0]=4 932 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3cccnc3 270004a_100000738074_100000753233 [0,1,0,0,0,1|2,0,0]=4 933 B25R3.121526 Clc1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 2230a_100000737946_100011935260 [0,1,0,0,0,1|2,0,0]=4 934 B25R3.121526 Clc1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 34a_100000737946_100011935260 [0,1,0,0,0,1|2,0,0]=4 935 B25R3.121526 Clc1ccc(cc1)C(OCCC2CCCCC2)c3ccccn3 34a_100000242608_100011209188 [0,1,0,0,0,1|2,0,0]=4 936 B25R3.121526 Clc1ccc(cc1)C(OCCC2CCCCC2)c3ccccn3 7a_100011217863_200010188304 [0,1,0,0,0,1|2,0,0]=4 937 B25R3.121526 Clc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 34a_100000211768_100011934994 [0,1,0,0,0,1|2,0,0]=4 938 B25R3.121526 Clc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 7a_100000211768_100011934994 [0,1,0,0,0,1|2,0,0]=4 939 B25R3.121526 Clc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 7a_100011933979_100000211669 [0,1,0,0,0,1|2,0,0]=4 940 B25R3.121526 Clc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 34a_100000211768_100011935260 [0,1,0,0,0,1|2,0,0]=4 941 B25R3.121526 Clc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 7a_100000211768_100011935260 [0,1,0,0,0,1|2,0,0]=4 942 B25R3.121526 Clc1ccc(cc1)C(SCCC2CCOCC2)c3ccccc3 62a_100000211669_100011934994 [0,1,0,0,0,1|2,0,0]=4 943 B25R3.121526 Clc1ccc(cc1)C(SCCC2CCOCC2)c3ccccc3 62a_100011934994_100000211669 [0,1,0,0,0,1|2,0,0]=4 944 B25R3.121526 Clc1ccc(cc1)C(SCCN2CCCCC2)c3ccccc3 62a_100000211669_100000739454 [0,1,0,0,0,1|0,0,0]=2 945 B25R3.121526 Clc1ccc(cc1)C(SCCN2CCCCC2)c3ccccc3 62a_100000739454_100000211669 [0,1,0,0,0,1|0,0,0]=2 946 B25R3.121526 Clc1ccc(cc1)C(SCCN2CCCCC2)c3ccccn3 62a_100000739454_200010188304 [0,1,0,0,0,1|1,0,0]=3 947 B25R3.121526 Clc1ccc(cc1)C(SCCN2CCCCC2)c3ccccn3 62a_200010188304_100000739454 [0,1,0,0,0,1|1,0,0]=3 948 B25R3.121526 Fc1ccc(cc1)C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100000210425 [0,1,0,0,0,1|1,0,1]=4 949 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000737529_100012355289 [0,1,0,0,0,1|1,0,0]=3 950 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000737529_100011713444 [0,1,0,0,0,1|1,0,0]=3 951 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100000210425 [0,1,0,0,0,1|1,0,0]=3 952 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 34a_100000737529_100011209188 [0,1,0,0,0,1|1,0,0]=3 953 B25R3.121526 Fc1ccc(cc1)C(OCCC2CCCCC2)c3ccccc3 34a_200000246460_100011209188 [0,1,0,0,0,1|1,0,0]=3 954 B25R3.121526 Fc1ccc(cc1)C(OCCC2CCCCC2)c3ccccc3 7a_200000246460_100011273959 [0,1,0,0,0,1|1,0,0]=3 955 B25R3.121526 Fc1ccc(cc1)C(OCCC2CCCCC2)c3ccncc3 34a_100000748166_100011209188 [0,1,0,0,0,1|2,0,0]=4 956 B25R3.121526 Fc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 34a_200000246460_100011935260 [0,1,0,0,0,1|2,0,0]=4 957 B25R3.121526 Fc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 7a_200000246460_100011935260 [0,1,0,0,0,1|2,0,0]=4 958 B25R3.121526 Nc1ccc(cc1)C(OCCC2CCCCC2)c3ccccc3 34a_100011236343_100011209188 [0,1,0,0,0,1|1,0,0]=3 959 B25R3.121526 Nc1ccc(cc1)C(OCCC2CCCCC2)c3ccccc3 7a_100011236343_100011273959 [0,1,0,0,0,1|1,0,0]=3 960 B25R3.121526 Oc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000198503_100011713444 [0,1,0,0,0,1|1,0,0]=3 961 B25R3.121526 Oc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 34a_100000198503_100011209188 [0,1,0,0,0,1|1,0,0]=3 962 B25R3.2033538 CN(CCC1CCCCC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_100012355289 [0,1,0,0,0,1|1,0,0]=3 963 B25R3.2033538 CN(CCC1CCCCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100011273959 [0,1,0,0,0,1|1,0,0]=3 964 B25R3.2033538 CN(CCC1CCCCC1)C(c2ccccc2)c3ccccc3 270004a_100103148541_100011713444 [0,1,0,0,0,1|1,0,0]=3 965 B25R3.2033538 CN(COC1CCCCC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_100011935260 [0,1,0,0,0,1|2,0,0]=4 966 B25R3.2033538 CN(COC1CCCCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100011935260 [0,1,0,0,0,1|2,0,0]=4 967 B25R3.2033538 O=C(CCC1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100011273959 [0,1,0,0,0,1|1,0,0]=3 968 B25R3.2033538 O=C(CCC1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000211375_100011216954 [0,1,0,0,0,1|1,0,0]=3 969 B25R3.2577903 Brc1cccc(c1)C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100011267660 [0,1,0,0,0,1|2,0,0]=4 970 B25R3.2577903 Brc1cccc(c1)C(NCOC2CCCCC2)c3ccccc3 2230a_100011212009_100011935260 [0,1,0,0,0,1|2,0,0]=4 971 B25R3.2577903 Brc1cccc(c1)C(NCOC2CCCCC2)c3ccccc3 34a_100011212009_100011935260 [0,1,0,0,0,1|2,0,0]=4 972 B25R3.2577903 Brc1cncc(c1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100011267668 [0,1,0,0,0,1|2,0,0]=4 973 B25R3.2577903 Cc1cccc(c1)C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100011217825 [0,1,0,0,0,1|1,0,1]=4 974 B25R3.2577903 Cc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100011217825 [0,1,0,0,0,1|1,0,0]=3 975 B25R3.2577903 Clc1cccc(c1)C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100011215489 [0,1,0,0,0,1|1,0,1]=4 976 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000741085_100012355289 [0,1,0,0,0,1|1,0,0]=3 977 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100011215489 [0,1,0,0,0,1|1,0,0]=3 978 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000741085_100011713444 [0,1,0,0,0,1|1,0,0]=3 979 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 34a_100000741085_100011209188 [0,1,0,0,0,1|1,0,0]=3 980 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCCCC2)c3ccccn3 270004a_100000738074_100000688346 [0,1,0,0,0,1|2,0,0]=4 981 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCCCC2)c3cccnc3 270004a_100000738074_100000752423 [0,1,0,0,0,1|2,0,0]=4 982 B25R3.2577903 Clc1cccc(c1)C(NCOC2CCCCC2)c3ccccc3 2230a_100000741085_100011935260 [0,1,0,0,0,1|2,0,0]=4 983 B25R3.2577903 Clc1cccc(c1)C(NCOC2CCCCC2)c3ccccc3 34a_100000741085_100011935260 [0,1,0,0,0,1|2,0,0]=4 984 B25R3.2577903 Clc1cccc(c1)C(OCCC2CCOCC2)c3ccccc3 34a_100000733576_100011934994 [0,1,0,0,0,1|2,0,0]=4 985 B25R3.2577903 Clc1cccc(c1)C(OCCC2CCOCC2)c3ccccc3 7a_100000733576_100011934994 [0,1,0,0,0,1|2,0,0]=4 986 B25R3.2577903 Clc1cccc(c1)C(OCOC2CCCCC2)c3ccccc3 34a_100000733576_100011935260 [0,1,0,0,0,1|2,0,0]=4 987 B25R3.2577903 Clc1cccc(c1)C(OCOC2CCCCC2)c3ccccc3 7a_100000733576_100011935260 [0,1,0,0,0,1|2,0,0]=4 988 B25R3.2577903 Fc1cccc(c1)C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_200011219850 [0,1,0,0,0,1|1,0,1]=4 989 B25R3.2577903 Fc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000686443_100012355289 [0,1,0,0,0,1|1,0,0]=3 990 B25R3.2577903 Fc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000686443_100011713444 [0,1,0,0,0,1|1,0,0]=3 991 B25R3.2577903 Fc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_200011219850 [0,1,0,0,0,1|1,0,0]=3 992 B25R3.2577903 Fc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 34a_100000686443_100011209188 [0,1,0,0,0,1|1,0,0]=3 993 B25R3.2577903 Fc1cccc(c1)C(OCCC2CCCCC2)c3ccccc3 34a_100000749007_100011209188 [0,1,0,0,0,1|1,0,0]=3 994 B25R3.2577903 Fc1cccc(c1)C(OCCC2CCCCC2)c3ccccc3 7a_100000749007_100011273959 [0,1,0,0,0,1|1,0,0]=3 995 B25R3.2577903 Fc1cccc(c1)C(OCOC2CCCCC2)c3ccccc3 34a_100000749007_100011935260 [0,1,0,0,0,1|2,0,0]=4 996 B25R3.2577903 Fc1cccc(c1)C(OCOC2CCCCC2)c3ccccc3 7a_100000749007_100011935260 [0,1,0,0,0,1|2,0,0]=4 997 B25R3.3975663 CC(CNCC1CCCCC1)(c2ccccc2)c3ccccc3 2230a_100000706881_100000211423 [0,1,0,0,0,1|1,0,0]=3 998 B25R3.3975663 CC(CNCC1CCCCC1)(c2ccccc2)c3ccccc3 269862a_100000706881_100000211278 [0,1,0,0,0,1|1,0,0]=3 999 B25R3.3975663 CC(OCCC1CCCCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100011273959 [0,1,0,0,0,1|1,0,0]=3 1000 B25R3.3975663 CC(OCCC1CCCCC1)(c2ccccc2)c3ccccn3 7a_200000075192_100011273959 [0,1,0,0,0,1|2,0,0]=4 1001 B25R3.3975663 CC(OCOC1CCCCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100011935260 [0,1,0,0,0,1|2,0,0]=4 1002 B25R3.18363890 CC1(CCCCC1)CNCC(c2ccccc2)c3ccccc3 269862a_100000739227_100011935227 [0,1,0,0,0,1|1,0,0]=3 1003 B25R3.18363890 CC1(CCCCC1)NCCC(c2ccccc2)c3ccccc3 2230a_100000741114_100009813428 [0,1,0,0,0,1|1,0,0]=3 1004 B25R3.18363890 CC1(CCCCC1)NCCC(c2ccccc2)c3ccccc3 34a_100000741114_100009813428 [0,1,0,0,0,1|1,0,0]=3 1005 B25R3.18363890 CC1(CCCCC1)NCC[S+](c2ccccc2)c3ccccc3 2230a_100000741114_100010140906 [0,1,0,0,0,1|2,0,0]=4 1006 B25R3.18363890 CC1(CCCCC1)OCCC(c2ccccc2)c3ccccc3 34a_100011215885_100009813428 [0,1,0,0,0,1|1,0,0]=3 1007 B25R3.18363890 CC1(CCCCC1)OCCC(c2ccccc2)c3ccccc3 7a_100011215885_100009813428 [0,1,0,0,0,1|1,0,0]=3 1008 B25R3.18363890 CC1(CCCCC1)OCC[S+](c2ccccc2)c3ccccc3 7a_100011215885_100010140906 [0,1,0,0,0,1|2,0,0]=4 1009 B25R3.18363890 CC1(CCSCC1)OCCC(c2ccccc2)c3ccccc3 34a_200011004327_100009813428 [0,1,0,0,0,1|2,0,0]=4 1010 B25R3.18363890 CC1(CCSCC1)OCCC(c2ccccc2)c3ccccc3 7a_200011004327_100009813428 [0,1,0,0,0,1|2,0,0]=4 1011 B25R3.834369 Cc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 2230a_100000736602_200000696569 [0,1,0,0,0,1|2,0,0]=4 1012 B25R3.834369 Cc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 269862a_100000736602_200000763224 [0,1,0,0,0,1|2,0,0]=4 1013 B25R3.834369 Cc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100000210966 [0,1,0,0,0,1|2,0,0]=4 1014 B25R3.834369 Cc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 34a_100000736602_200000696569 [0,1,0,0,0,1|2,0,0]=4 1015 B25R3.834369 Clc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 2230a_100000737946_200000696569 [0,1,0,0,0,1|2,0,0]=4 1016 B25R3.834369 Clc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 2230a_100015204231_100000211669 [0,1,0,0,0,1|2,0,0]=4 1017 B25R3.834369 Clc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 269862a_100000737946_200000763224 [0,1,0,0,0,1|2,0,0]=4 1018 B25R3.834369 Clc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100000211064 [0,1,0,0,0,1|2,0,0]=4 1019 B25R3.834369 Clc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 34a_100000737946_200000696569 [0,1,0,0,0,1|2,0,0]=4 1020 B25R3.834369 Fc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 2230a_100000737529_200000696569 [0,1,0,0,0,1|2,0,0]=4 1021 B25R3.834369 Fc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 269862a_100000737529_200000763224 [0,1,0,0,0,1|2,0,0]=4 1022 B25R3.834369 Fc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100000210425 [0,1,0,0,0,1|2,0,0]=4 1023 B25R3.834369 Fc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 34a_100000737529_200000696569 [0,1,0,0,0,1|2,0,0]=4 1024 B25R3.834369 Fc1ccc(cc1)C(OCC2CCCCCC2)c3ccccc3 34a_200000246460_200000696569 [0,1,0,0,0,1|2,0,0]=4 1025 B25R3.834369 Fc1ccc(cc1)C(OCC2CCCCCC2)c3ccccc3 7a_200000246460_200000696569 [0,1,0,0,0,1|2,0,0]=4 1026 B25R3.834369 Nc1ccc(cc1)C(OCC2CCCCCC2)c3ccccc3 34a_100011236343_200000696569 [0,1,0,0,0,1|2,0,0]=4 1027 B25R3.834369 Nc1ccc(cc1)C(OCC2CCCCCC2)c3ccccc3 7a_100011236343_200000696569 [0,1,0,0,0,1|2,0,0]=4 1028 B25R3.834369 Oc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 34a_100000198503_200000696569 [0,1,0,0,0,1|2,0,0]=4 1029 B25R3.3516444 Cc1ccccc1C(NCC2CCCCCC2)c3ccccc3 2230a_100000222801_200000696569 [0,1,0,0,0,1|2,0,0]=4 1030 B25R3.3516444 Cc1ccccc1C(NCC2CCCCCC2)c3ccccc3 2230a_100015204231_100000230135 [0,1,0,0,0,1|2,0,0]=4 1031 B25R3.3516444 Cc1ccccc1C(NCC2CCCCCC2)c3ccccc3 269862a_100000222801_200000763224 [0,1,0,0,0,1|2,0,0]=4 1032 B25R3.3516444 Cc1ccccc1C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100000735561 [0,1,0,0,0,1|2,0,0]=4 1033 B25R3.3516444 Cc1ccccc1C(NCC2CCCCCC2)c3ccccc3 34a_100000222801_200000696569 [0,1,0,0,0,1|2,0,0]=4 1034 B25R3.3516444 Clc1ccccc1C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100011215288 [0,1,0,0,0,1|2,0,0]=4 1035 B25R3.3516444 Fc1ccccc1C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100011217773 [0,1,0,0,0,1|2,0,0]=4 1036 B25R3.3516444 Nc1ccccc1C(OCC2CCCCCC2)c3ccccc3 34a_100000246470_200000696569 [0,1,0,0,0,1|2,0,0]=4 1037 B25R3.3516444 Nc1ccccc1C(OCC2CCCCCC2)c3ccccc3 7a_100000246470_200000696569 [0,1,0,0,0,1|2,0,0]=4 1038 B25R3.6509934 CC(CC(c1ccccc1)c2ccccc2)N3CCCCCC3 270004a_100000185865_200000011111 [0,1,0,0,0,1|0,0,0]=2 1039 B25R3.6509934 O=C(CC(c1ccccc1)c2ccccc2)C3CCCCCC3 1458a_100000499737_100011217769 [0,1,0,0,0,1|1,0,1]=4 1040 B25R3.13743512 Cc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100011217825 [0,1,0,0,0,1|2,0,0]=4 1041 B25R3.13743512 Clc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 2230a_100000741085_200000696569 [0,1,0,0,0,1|2,0,0]=4 1042 B25R3.13743512 Clc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 269862a_100000741085_200000763224 [0,1,0,0,0,1|2,0,0]=4 1043 B25R3.13743512 Clc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100011215489 [0,1,0,0,0,1|2,0,0]=4 1044 B25R3.13743512 Clc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 34a_100000741085_200000696569 [0,1,0,0,0,1|2,0,0]=4 1045 B25R3.13743512 Fc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 2230a_100000686443_200000696569 [0,1,0,0,0,1|2,0,0]=4 1046 B25R3.13743512 Fc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 269862a_100000686443_200000763224 [0,1,0,0,0,1|2,0,0]=4 1047 B25R3.13743512 Fc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_200011219850 [0,1,0,0,0,1|2,0,0]=4 1048 B25R3.13743512 Fc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 34a_100000686443_200000696569 [0,1,0,0,0,1|2,0,0]=4 1049 B25R3.13743512 Fc1cccc(c1)C(OCC2CCCCCC2)c3ccccc3 34a_100000749007_200000696569 [0,1,0,0,0,1|2,0,0]=4 1050 B25R3.13743512 Fc1cccc(c1)C(OCC2CCCCCC2)c3ccccc3 7a_100000749007_200000696569 [0,1,0,0,0,1|2,0,0]=4 1051 B25R3.17940601 CC1CCCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100025706717_100000050448 [0,1,0,0,0,1|0,0,2]=4 1052 B25R3.17940601 CC1CCCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100025706717_100009813428 [0,1,0,0,0,1|0,0,0]=2 1053 B25R3.17940601 CC1CCCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100025706717_100009813428 [0,1,0,0,0,1|0,0,0]=2 1054 B25R3.17940601 CC1CCCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100025706717_100009813428 [0,1,0,0,0,1|0,0,0]=2 1055 B25R3.32596367 CN(CC1CCCCCC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_200000696569 [0,1,0,0,0,1|2,0,0]=4 1056 B25R3.32596367 CN(CC1CCCCCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_200000696569 [0,1,0,0,0,1|2,0,0]=4 1057 B25R3.32596367 O=C(CC1CCCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_200000696569 [0,1,0,0,0,1|1,0,1]=4 1058 B25R3.32596367 O=C(CC1CCCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000685095_100011216954 [0,1,0,0,0,1|1,0,1]=4 1059 B25R3.32690298 CC(CNC1CCCCCC1)(c2ccccc2)c3ccccc3 270004a_100000706881_100000210131 [0,1,0,0,0,1|2,0,0]=4 1060 B25R3.32690298 CC(OCC1CCCCCC1)(c2ccccc2)c3ccccc3 7a_100011202337_200000696569 [0,1,0,0,0,1|2,0,0]=4 1061 B25R3.1136 C=C1CCN(CC1)C(C)CC(c2ccccc2)c3ccccc3 270004a_100000752442_200000011111 [0,2,0,0,0,0|0,0,1]=3 1062 B25R3.1136 CC(CC(c1ccccc1)c2ccccc2)N3CCC(CC3)F 270004a_100015193889_200000011111 [0,2,0,0,0,0|0,0,0]=2 1063 B25R3.1136 CC1=CCN(CC1)C(C)CC(c2ccccc2)c3ccccc3 270004a_100000693516_200000011111 [0,2,0,0,0,0|0,0,2]=4 1064 B25R3.1136 CC1CCC(CC1)C(=O)CC(c2ccccc2)c3ccccc3 1458a_100000499737_200011216234 [0,2,0,0,0,0|1,0,1]=4 1065 B25R3.1136 CC1CCN(CC1)C(C)CC(c2ccccc2)c3ccccc3 270004a_100000188429_200000011111 [0,2,0,0,0,0|0,0,0]=2 1066 B25R3.23513 CC(NC(c1ccccc1)c2ccc(cc2)Cl)C3CCCCC3 269862a_100000737946_100000210989 [0,2,0,0,0,0|2,0,0]=4 1067 B25R3.23513 CC(NC(c1ccccc1)c2ccc(cc2)F)C3CCCCC3 269862a_100000737529_100000210989 [0,2,0,0,0,0|2,0,0]=4 1068 B25R3.23513 C[C@@H](NC(c1ccccc1)c2ccc(cc2)Cl)C3CCCCC3 2230a_100025707633_100000211669 [0,2,0,0,0,0|2,0,0]=4 1069 B25R3.23513 C[C@@H](NC(c1ccccc1)c2ccc(cc2)Cl)C3CCCCC3 270004a_100025707633_100000211064 [0,2,0,0,0,0|2,0,0]=4 1070 B25R3.23513 C[C@@H](NC(c1ccccc1)c2ccc(cc2)F)C3CCCCC3 270004a_100025707633_100000210425 [0,2,0,0,0,0|2,0,0]=4 1071 B25R3.23513 Cc1ccc(cc1)C(NC(C)C2CCCCC2)c3ccccc3 269862a_100000736602_100000210989 [0,2,0,0,0,0|2,0,0]=4 1072 B25R3.23513 Cc1ccc(cc1)C(N[C@H](C)C2CCCCC2)c3ccccc3 270004a_100025707633_100000210966 [0,2,0,0,0,0|2,0,0]=4 1073 B25R3.24883 CCC(NC(c1ccccc1)c2ccccc2)C3CCCCC3 269862a_100000162943_100011216311 [0,2,0,0,0,0|2,0,0]=4 1074 B25R3.24883 CC[C@H](NC(c1ccccc1)c2ccccc2)C3CCCCC3 2230a_100020639352_100000211591 [0,2,0,0,0,0|2,0,0]=4 1075 B25R3.24883 CC[C@H](NC(c1ccccc1)c2ccccc2)C3CCCCC3 270004a_100020639352_100000210122 [0,2,0,0,0,0|2,0,0]=4 1076 B25R3.25109 CC(NC(c1ccccc1)c2cccc(c2)Cl)C3CCCCC3 269862a_100000741085_100000210989 [0,2,0,0,0,0|2,0,0]=4 1077 B25R3.25109 CC(NC(c1ccccc1)c2cccc(c2)F)C3CCCCC3 269862a_100000686443_100000210989 [0,2,0,0,0,0|2,0,0]=4 1078 B25R3.25109 C[C@@H](NC(c1ccccc1)c2cccc(c2)Cl)C3CCCCC3 270004a_100025707633_100011215489 [0,2,0,0,0,0|2,0,0]=4 1079 B25R3.25109 C[C@@H](NC(c1ccccc1)c2cccc(c2)F)C3CCCCC3 270004a_100025707633_200011219850 [0,2,0,0,0,0|2,0,0]=4 1080 B25R3.25109 Cc1cccc(c1)C(N[C@H](C)C2CCCCC2)c3ccccc3 270004a_100025707633_100011217825 [0,2,0,0,0,0|2,0,0]=4 1081 B25R3.45469 C[C@@H](NC(c1ccccc1)c2ccccc2Cl)C3CCCCC3 270004a_100025707633_100011215288 [0,2,0,0,0,0|2,0,0]=4 1082 B25R3.45469 C[C@@H](NC(c1ccccc1)c2ccccc2F)C3CCCCC3 270004a_100025707633_100011217773 [0,2,0,0,0,0|2,0,0]=4 1083 B25R3.45469 Cc1ccccc1C(NC(C)C2CCCCC2)c3ccccc3 269862a_100000222801_100000210989 [0,2,0,0,0,0|2,0,0]=4 1084 B25R3.45469 Cc1ccccc1C(N[C@H](C)C2CCCCC2)c3ccccc3 2230a_100025707633_100000230135 [0,2,0,0,0,0|2,0,0]=4 1085 B25R3.45469 Cc1ccccc1C(N[C@H](C)C2CCCCC2)c3ccccc3 270004a_100025707633_100000735561 [0,2,0,0,0,0|2,0,0]=4 1086 B25R3.68061 CC(CC(c1ccccc1)c2ccccc2)N3CCCC(C3)F 270004a_100000697950_200000011111 [0,2,0,0,0,0|0,0,0]=2 1087 B25R3.68061 CC(CC(c1ccccc1)c2ccccc2)N3CCC[C@@H](C3)C 270004a_100000717927_200000011111 [0,2,0,0,0,0|0,0,0]=2 1088 B25R3.68061 CC1=CCCN(C1)C(C)CC(c2ccccc2)c3ccccc3 270004a_100000725631_200000011111 [0,2,0,0,0,0|0,0,2]=4 1089 B25R3.2609278 CC1CCCCN1C(C)CC(c2ccccc2)c3ccccc3 270004a_100000211376_200000011111 [0,2,0,0,0,0|0,0,0]=2 1090 B25R3.6896509 CC(C(=O)C(c1ccccc1)c2ccccc2)C3CCCCC3 1458a_100011435303_100011216954 [0,2,0,0,0,0|1,0,1]=4 1091 B25R3.12843 CCc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100012339983 [0,2,0,0,0,0|2,0,0]=4 1092 B25R3.12843 COc1cccc(c1)C(OCC2CCCCC2)c3ccccc3 34a_200017279661_100000211423 [0,2,0,0,0,0|2,0,0]=4 1093 B25R3.12843 COc1cccc(c1)C(OCC2CCCCC2)c3ccccc3 7a_200017279661_100000211423 [0,2,0,0,0,0|2,0,0]=4 1094 B25R3.22825 Fc1cc(cc(c1)C(NCC2CCCCC2)c3ccccc3)F 270004a_100000210473_100011218726 [0,2,0,0,0,0|2,0,0]=4 1095 B25R3.22825 Fc1cc(cc(c1)C(OCC2CCCCC2)c3ccccc3)F 34a_200005489329_100000211423 [0,2,0,0,0,0|2,0,0]=4 1096 B25R3.22825 Fc1cc(cc(c1)C(OCC2CCCCC2)c3ccccc3)F 7a_200005489329_100000211423 [0,2,0,0,0,0|2,0,0]=4 1097 B25R3.26855 Fc1ccc(c(c1)C(NCC2CCCCC2)c3ccccc3)F 270004a_100000210473_100011217027 [0,2,0,0,0,0|2,0,0]=4 1098 B25R3.26855 Nc1ccc(cc1C(OCC2CCCCC2)c3ccccc3)Cl 34a_100000011915_100000211423 [0,2,0,0,0,0|2,0,0]=4 1099 B25R3.26855 Nc1ccc(cc1C(OCC2CCCCC2)c3ccccc3)Cl 7a_100000011915_100000211423 [0,2,0,0,0,0|2,0,0]=4 1100 B25R3.117189 Cc1ccc(cc1C)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000185006 [0,2,0,0,0,0|2,0,0]=4 1101 B25R3.117189 Fc1ccc(cc1F)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011218205 [0,2,0,0,0,0|2,0,0]=4 1102 B25R3.743843 Fc1ccc(cc1)C(NCC2CCCCC2)c3cccc(c3)Br 270004a_100000210473_200011267472 [0,2,0,0,0,0|2,0,0]=4 1103 B25R3.743843 Fc1ccc(cc1)C(NCC2CCCCC2)c3cccc(c3)F 270004a_100000210473_100000185714 [0,2,0,0,0,0|2,0,0]=4 1104 B25R3.743843 Fc1cccc(c1)C(NCC2CCCCC2)c3ccc(cc3)Br 2230a_200000296200_100000211423 [0,2,0,0,0,0|2,0,0]=4 1105 B25R3.743843 Fc1cccc(c1)C(NCC2CCCCC2)c3ccc(cc3)Br 269862a_200000296200_100000211278 [0,2,0,0,0,0|2,0,0]=4 1106 B25R3.743843 Fc1cccc(c1)C(NCC2CCCCC2)c3ccc(cc3)Br 34a_200000296200_100000211423 [0,2,0,0,0,0|2,0,0]=4 1107 B25R3.746999 CC1CCC(CC1)CNC(c2ccccc2)c3cccc(c3)Br 270004a_103436935547_100011267660 [0,2,0,0,0,0|2,0,0]=4 1108 B25R3.746999 CC1CCC(CC1)CNC(c2ccccc2)c3cccc(c3)Cl 270004a_103436935547_100011215489 [0,2,0,0,0,0|2,0,0]=4 1109 B25R3.746999 CC1CCC(CC1)CNC(c2ccccc2)c3cccc(c3)F 270004a_103436935547_200011219850 [0,2,0,0,0,0|2,0,0]=4 1110 B25R3.746999 Cc1cccc(c1)C(NCC2CCC(CC2)C)c3ccccc3 270004a_103436935547_100011217825 [0,2,0,0,0,0|2,0,0]=4 1111 B25R3.2572876 CN(CC1CCCCC1)C(c2ccccc2)c3cccc(c3)Cl 270004a_100000736448_100011215489 [0,2,0,0,0,0|2,0,0]=4 1112 B25R3.2572876 CN(CC1CCCCC1)C(c2ccccc2)c3cccc(c3)F 270004a_100000736448_200011219850 [0,2,0,0,0,0|2,0,0]=4 1113 B25R3.2572876 Cc1cccc(c1)C(c2ccccc2)N(C)CC3CCCCC3 270004a_100000736448_100011217825 [0,2,0,0,0,0|2,0,0]=4 1114 B25R3.2577885 Fc1cccc(c1)C(NCC2CCCCC2)c3cccc(c3)Br 270004a_100000210473_100000687359 [0,2,0,0,0,0|2,0,0]=4 1115 B25R3.2577885 Fc1cccc(c1)C(NCC2CCCCC2)c3cccc(c3)F 270004a_100000210473_100011215574 [0,2,0,0,0,0|2,0,0]=4 1116 B25R3.2577885 Fc1cccc(c1)C(OCC2CCCCC2)c3cccc(c3)F 34a_200000373135_100000211423 [0,2,0,0,0,0|2,0,0]=4 1117 B25R3.2577885 Fc1cccc(c1)C(OCC2CCCCC2)c3cccc(c3)F 7a_200000373135_100000211423 [0,2,0,0,0,0|2,0,0]=4 1118 B25R3.2577889 Fc1cccc(c1)C(NCC2CCCCC2)c3ccccc3F 270004a_100000210473_100011218100 [0,2,0,0,0,0|2,0,0]=4 1119 B25R3.123585167 CC1(CCCCC1)CNC(c2ccccc2)c3cccc(c3)Cl 269862a_100000741085_100011935227 [0,2,0,0,0,0|2,0,0]=4 1120 B25R3.123585167 CC1(CCCCC1)CNC(c2ccccc2)c3cccc(c3)Cl 270004a_100000706052_100011215489 [0,2,0,0,0,0|2,0,0]=4 1121 B25R3.123585167 CC1(CCCCC1)CNC(c2ccccc2)c3cccc(c3)F 269862a_100000686443_100011935227 [0,2,0,0,0,0|2,0,0]=4 1122 B25R3.123585167 CC1(CCCCC1)CNC(c2ccccc2)c3cccc(c3)F 270004a_100000706052_200011219850 [0,2,0,0,0,0|2,0,0]=4 1123 B25R3.123585167 Cc1cccc(c1)C(NCC2(CCCCC2)C)c3ccccc3 270004a_100000706052_100011217825 [0,2,0,0,0,0|2,0,0]=4 1124 B25R3.61813 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3Cl 270004a_100000736448_100011215288 [0,2,0,0,0,0|2,0,0]=4 1125 B25R3.61813 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3F 270004a_100000736448_100011217773 [0,2,0,0,0,0|2,0,0]=4 1126 B25R3.61813 Cc1ccccc1C(c2ccccc2)N(C)CC3CCCCC3 2230a_100000736448_100000230135 [0,2,0,0,0,0|2,0,0]=4 1127 B25R3.61813 Cc1ccccc1C(c2ccccc2)N(C)CC3CCCCC3 269982a_100000736448_100000230135 [0,2,0,0,0,0|2,0,0]=4 1128 B25R3.61813 Cc1ccccc1C(c2ccccc2)N(C)CC3CCCCC3 270004a_100000736448_100000735561 [0,2,0,0,0,0|2,0,0]=4 1129 B25R3.743847 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3Cl 270004a_100000210473_100000758304 [0,2,0,0,0,0|2,0,0]=4 1130 B25R3.743847 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3Br 270004a_100000210473_100011267497 [0,2,0,0,0,0|2,0,0]=4 1131 B25R3.743847 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3Cl 270004a_100000210473_100000297523 [0,2,0,0,0,0|2,0,0]=4 1132 B25R3.747003 CC1CCC(CC1)CNC(c2ccccc2)c3ccccc3Br 270004a_103436935547_100000198044 [0,2,0,0,0,0|2,0,0]=4 1133 B25R3.747003 CC1CCC(CC1)CNC(c2ccccc2)c3ccccc3Cl 270004a_103436935547_100011215288 [0,2,0,0,0,0|2,0,0]=4 1134 B25R3.747003 CC1CCC(CC1)CNC(c2ccccc2)c3ccccc3F 270004a_103436935547_100011217773 [0,2,0,0,0,0|2,0,0]=4 1135 B25R3.747003 Cc1ccccc1C(NCC2CCC(CC2)C)c3ccccc3 2230a_103436935547_100000230135 [0,2,0,0,0,0|2,0,0]=4 1136 B25R3.747003 Cc1ccccc1C(NCC2CCC(CC2)C)c3ccccc3 270004a_103436935547_100000735561 [0,2,0,0,0,0|2,0,0]=4 1137 B25R3.2630524 Cc1ccc(c(c1)C)C(NCC2CCCCC2)c3ccccc3 2230a_100102946505_100000211423 [0,2,0,0,0,0|2,0,0]=4 1138 B25R3.2630524 Cc1ccc(c(c1)C)C(NCC2CCCCC2)c3ccccc3 269862a_100102946505_100000211278 [0,2,0,0,0,0|2,0,0]=4 1139 B25R3.2630524 Cc1ccc(c(c1)C)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000185008 [0,2,0,0,0,0|2,0,0]=4 1140 B25R3.2630524 Cc1ccc(c(c1)C)C(NCC2CCCCC2)c3ccccc3 34a_100102946505_100000211423 [0,2,0,0,0,0|2,0,0]=4 1141 B25R3.2630524 Fc1ccc(c(c1)F)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_200011215470 [0,2,0,0,0,0|2,0,0]=4 1142 B25R3.128396070 CC1(CCCCC1)CNC(c2ccccc2)c3ccccc3Cl 270004a_100000706052_100011215288 [0,2,0,0,0,0|2,0,0]=4 1143 B25R3.128396070 CC1(CCCCC1)CNC(c2ccccc2)c3ccccc3F 270004a_100000706052_100011217773 [0,2,0,0,0,0|2,0,0]=4 1144 B25R3.128396070 Cc1ccccc1C(NCC2(CCCCC2)C)c3ccccc3 2230a_100000706052_100000230135 [0,2,0,0,0,0|2,0,0]=4 1145 B25R3.128396070 Cc1ccccc1C(NCC2(CCCCC2)C)c3ccccc3 269862a_100000222801_100011935227 [0,2,0,0,0,0|2,0,0]=4 1146 B25R3.128396070 Cc1ccccc1C(NCC2(CCCCC2)C)c3ccccc3 270004a_100000706052_100000735561 [0,2,0,0,0,0|2,0,0]=4 1147 B25R3.128396070 Cc1ccccc1C(OCC2(CCCCC2)F)c3ccccc3 7a_100000090305_100000230135 [0,2,0,0,0,0|2,0,0]=4 1148 B25R3.45336 CC1CCCC(C1NCC(c2ccccc2)c3ccccc3)C 269862a_100000739227_100000211995 [0,2,0,0,0,0|2,0,0]=4 1149 B25R3.45336 CC1CCCC(N1CCC(c2ccccc2)c3ccccc3)C 2230a_100000210447_100009813428 [0,2,0,0,0,0|0,0,0]=2 1150 B25R3.45336 CC1CCCC(N1CCC(c2ccccc2)c3ccccc3)C 269982a_100000210447_100009813428 [0,2,0,0,0,0|0,0,0]=2 1151 B25R3.45336 CC1CCCC(N1CCC(c2ccccc2)c3ccccc3)C 34a_100000210447_100009813428 [0,2,0,0,0,0|0,0,0]=2 1152 B25R3.137631 CCC1CCCCC1NCC(c2ccccc2)c3ccccc3 269862a_100000739227_100000757040 [0,2,0,0,0,0|2,0,0]=4 1153 B25R3.137631 CCC1CCCCC1NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000757040 [0,2,0,0,0,0|2,0,0]=4 1154 B25R3.137631 CCC1CCCCN1CC=C(c2ccccc2)c3ccccc3 270004a_100000210034_100000050448 [0,2,0,0,0,0|0,0,2]=4 1155 B25R3.137631 CCC1CCCCN1CCC(c2ccccc2)c3ccccc3 2230a_100000210034_100009813428 [0,2,0,0,0,0|0,0,0]=2 1156 B25R3.137631 CCC1CCCCN1CCC(c2ccccc2)c3ccccc3 269982a_100000210034_100009813428 [0,2,0,0,0,0|0,0,0]=2 1157 B25R3.137631 CCC1CCCCN1CCC(c2ccccc2)c3ccccc3 34a_100000210034_100009813428 [0,2,0,0,0,0|0,0,0]=2 1158 B25R3.2892036 CC1(CCCCC1NCC(c2ccccc2)c3ccccc3)C 269862a_100000739227_100000031690 [0,2,0,0,0,0|2,0,0]=4 1159 B25R3.2892036 FC1(CCCCC1OCC(c2ccccc2)c3ccccc3)F 34a_100011215272_200009832135 [0,2,0,0,0,0|2,0,0]=4 1160 B25R3.2961275 CC1CCCCC1NCC(C)(c2ccccc2)c3ccccc3 269862a_100000706881_100000210921 [0,2,0,0,0,0|2,0,0]=4 1161 B25R3.2961275 CC1CCCCC1NCC(C)(c2ccccc2)c3ccccc3 270004a_100000706881_100000210921 [0,2,0,0,0,0|2,0,0]=4 1162 B25R3.3729861 CC1CCC(C(C1)NCC(c2ccccc2)c3ccccc3)C 269862a_100000739227_100000034887 [0,2,0,0,0,0|2,0,0]=4 1163 B25R3.3729861 CC1CCC(C(C1)NCC(c2ccccc2)c3ccccc3)C 270004a_100000739227_100000034887 [0,2,0,0,0,0|2,0,0]=4 1164 B25R3.82776 CC(C(=O)CC1CCCCC1)(c2ccccc2)c3ccccc3 1458a_100000752439_100000211423 [0,2,0,0,0,0|1,0,1]=4 1165 B25R3.120105 CC1CCC(CC1)CC(=O)C(c2ccccc2)c3ccccc3 1458a_100011215564_100011216954 [0,2,0,0,0,0|1,0,1]=4 1166 B25R3.121554 CN(CC1CCCCC1)C(c2ccccc2)c3ccc(cc3)Cl 2230a_100000736448_100000211669 [0,2,0,0,0,0|2,0,0]=4 1167 B25R3.121554 CN(CC1CCCCC1)C(c2ccccc2)c3ccc(cc3)Cl 269982a_100000736448_100000211669 [0,2,0,0,0,0|2,0,0]=4 1168 B25R3.121554 CN(CC1CCCCC1)C(c2ccccc2)c3ccc(cc3)Cl 270004a_100000736448_100000211064 [0,2,0,0,0,0|2,0,0]=4 1169 B25R3.121554 CN(CC1CCCCC1)C(c2ccccc2)c3ccc(cc3)F 270004a_100000736448_100000210425 [0,2,0,0,0,0|2,0,0]=4 1170 B25R3.121554 Cc1ccc(cc1)C(c2ccccc2)N(C)CC3CCCCC3 270004a_100000736448_100000210966 [0,2,0,0,0,0|2,0,0]=4 1171 B25R3.2580977 CC1CCCC(C1)CC(=O)C(c2ccccc2)c3ccccc3 1458a_100000748788_100011216954 [0,2,0,0,0,0|1,0,1]=4 1172 B25R3.2785 COc1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 34a_100000286541_100000211423 [0,2,0,0,0,0|2,0,0]=4 1173 B25R3.2785 COc1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 7a_100000286541_100000211423 [0,2,0,0,0,0|2,0,0]=4 1174 B25R3.114827 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccc(cc3)C 270004a_100000210473_100000181741 [0,2,0,0,0,0|2,0,0]=4 1175 B25R3.114827 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccc(cc3)Cl 270004a_100000210473_100011267710 [0,2,0,0,0,0|2,0,0]=4 1176 B25R3.114827 Cc1ccc(cc1)C(OCC2CCCCC2)c3ccc(cc3)C 34a_100000297768_100000211423 [0,2,0,0,0,0|2,0,0]=4 1177 B25R3.114827 Cc1ccc(cc1)C(OCC2CCCCC2)c3ccc(cc3)C 7a_100000297768_100000211423 [0,2,0,0,0,0|2,0,0]=4 1178 B25R3.114827 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccc(cc3)Br 270004a_100000210473_200011267496 [0,2,0,0,0,0|2,0,0]=4 1179 B25R3.114827 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccc(cc3)F 2230a_100000210473_100000211696 [0,2,0,0,0,0|2,0,0]=4 1180 B25R3.114827 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccc(cc3)F 2230a_100000743883_100000211423 [0,2,0,0,0,0|2,0,0]=4 1181 B25R3.114827 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccc(cc3)F 34a_100000743883_100000211423 [0,2,0,0,0,0|2,0,0]=4 1182 B25R3.114827 Fc1ccc(cc1)C(OCC2CCCCC2)c3ccc(cc3)F 34a_100000272419_100000211423 [0,2,0,0,0,0|2,0,0]=4 1183 B25R3.114827 Fc1ccc(cc1)C(OCC2CCCCC2)c3ccc(cc3)F 7a_100000212181_100000211696 [0,2,0,0,0,0|2,0,0]=4 1184 B25R3.114827 Fc1ccc(cc1)C(OCC2CCCCC2)c3ccc(cc3)F 7a_100000272419_100000211423 [0,2,0,0,0,0|2,0,0]=4 1185 B25R3.114943 CC1CCC(CC1)CNC(c2ccccc2)c3ccc(cc3)Br 270004a_103436935547_100000718703 [0,2,0,0,0,0|2,0,0]=4 1186 B25R3.114943 CC1CCC(CC1)CNC(c2ccccc2)c3ccc(cc3)Cl 2230a_103436935547_100000211669 [0,2,0,0,0,0|2,0,0]=4 1187 B25R3.114943 CC1CCC(CC1)CNC(c2ccccc2)c3ccc(cc3)Cl 270004a_103436935547_100000211064 [0,2,0,0,0,0|2,0,0]=4 1188 B25R3.114943 CC1CCC(CC1)CNC(c2ccccc2)c3ccc(cc3)F 270004a_103436935547_100000210425 [0,2,0,0,0,0|2,0,0]=4 1189 B25R3.114943 Cc1ccc(cc1)C(NCC2CCC(CC2)C)c3ccccc3 270004a_103436935547_100000210966 [0,2,0,0,0,0|2,0,0]=4 1190 B25R3.295449717 CC1(CCCCC1)CNC(c2ccccc2)c3ccc(cc3)Cl 2230a_100000706052_100000211669 [0,2,0,0,0,0|2,0,0]=4 1191 B25R3.295449717 CC1(CCCCC1)CNC(c2ccccc2)c3ccc(cc3)Cl 269862a_100000737946_100011935227 [0,2,0,0,0,0|2,0,0]=4 1192 B25R3.295449717 CC1(CCCCC1)CNC(c2ccccc2)c3ccc(cc3)Cl 270004a_100000706052_100000211064 [0,2,0,0,0,0|2,0,0]=4 1193 B25R3.295449717 CC1(CCCCC1)CNC(c2ccccc2)c3ccc(cc3)F 269862a_100000737529_100011935227 [0,2,0,0,0,0|2,0,0]=4 1194 B25R3.295449717 CC1(CCCCC1)CNC(c2ccccc2)c3ccc(cc3)F 270004a_100000706052_100000210425 [0,2,0,0,0,0|2,0,0]=4 1195 B25R3.295449717 Cc1ccc(cc1)C(NCC2(CCCCC2)C)c3ccccc3 269862a_100000736602_100011935227 [0,2,0,0,0,0|2,0,0]=4 1196 B25R3.295449717 Cc1ccc(cc1)C(NCC2(CCCCC2)C)c3ccccc3 270004a_100000706052_100000210966 [0,2,0,0,0,0|2,0,0]=4 1197 B25R3.31048 CCC1CCC(CC1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000210631 [0,2,0,0,0,0|2,0,0]=4 1198 B25R3.31048 CCC1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100000754474_100000050448 [0,2,0,0,0,0|0,0,2]=4 1199 B25R3.31048 CCC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100000754474_100009813428 [0,2,0,0,0,0|0,0,0]=2 1200 B25R3.31048 CCC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100000754474_100009813428 [0,2,0,0,0,0|0,0,0]=2 1201 B25R3.31048 CCC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100000754474_100009813428 [0,2,0,0,0,0|0,0,0]=2 1202 B25R3.31048 COC1CCC(CC1)COC(c2ccccc2)c3ccccc3 34a_100000211180_100013032858 [0,2,0,0,0,0|2,0,0]=4 1203 B25R3.31048 COC1CCC(CC1)COC(c2ccccc2)c3ccccc3 7a_100000211180_100013032858 [0,2,0,0,0,0|2,0,0]=4 1204 B25R3.31048 COC1CCC(CC1)CSC(c2ccccc2)c3ccccc3 62a_100000211591_100013032858 [0,2,0,0,0,0|2,0,0]=4 1205 B25R3.31048 COC1CCC(CC1)CSC(c2ccccc2)c3ccccc3 62a_100013032858_100011216954 [0,2,0,0,0,0|2,0,0]=4 1206 B25R3.31048 CSC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100015202541_100009813428 [0,2,0,0,0,0|0,0,0]=2 1207 B25R3.31048 CSC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100015202541_100009813428 [0,2,0,0,0,0|0,0,0]=2 1208 B25R3.31048 CSC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100015202541_100009813428 [0,2,0,0,0,0|0,0,0]=2 1209 B25R3.116384 CC1CCC(CC1C)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000759390 [0,2,0,0,0,0|2,0,0]=4 1210 B25R3.121401 CC1CCC(CC1)NCC(C)(c2ccccc2)c3ccccc3 270004a_100000706881_100000185489 [0,2,0,0,0,0|2,0,0]=4 1211 B25R3.17226985 CC1(CCC(CC1)NCC(c2ccccc2)c3ccccc3)C 270004a_100000739227_100000061838 [0,2,0,0,0,0|2,0,0]=4 1212 B25R3.17226985 CC1(CCN(CC1)CC=C(c2ccccc2)c3ccccc3)C 270004a_100000750138_100000050448 [0,2,0,0,0,0|0,0,2]=4 1213 B25R3.17226985 CC1(CCN(CC1)CCC(c2ccccc2)c3ccccc3)C 2230a_100000750138_100009813428 [0,2,0,0,0,0|0,0,0]=2 1214 B25R3.17226985 CC1(CCN(CC1)CCC(c2ccccc2)c3ccccc3)C 269982a_100000750138_100009813428 [0,2,0,0,0,0|0,0,0]=2 1215 B25R3.17226985 C[Si]1(CCN(CC1)CCC(c2ccccc2)c3ccccc3)C 2230a_100025715224_100009813428 [0,2,0,0,0,0|0,1,0]=3 1216 B25R3.17226985 C[Si]1(CCN(CC1)CCC(c2ccccc2)c3ccccc3)C 269982a_100025715224_100009813428 [0,2,0,0,0,0|0,1,0]=3 1217 B25R3.17226985 FC1(CCC(CC1)CNC(c2ccccc2)c3ccccc3)F 2230a_100000162943_100012361406 [0,2,0,0,0,0|2,0,0]=4 1218 B25R3.17226985 FC1(CCC(CC1)CNC(c2ccccc2)c3ccccc3)F 2230a_100016988479_100000211591 [0,2,0,0,0,0|2,0,0]=4 1219 B25R3.17226985 FC1(CCC(CC1)CNC(c2ccccc2)c3ccccc3)F 269862a_100000162943_100011361451 [0,2,0,0,0,0|2,0,0]=4 1220 B25R3.17226985 FC1(CCC(CC1)CNC(c2ccccc2)c3ccccc3)F 270004a_100016988479_100000210122 [0,2,0,0,0,0|2,0,0]=4 1221 B25R3.17226985 FC1(CCC(CC1)CNC(c2ccccc2)c3ccccc3)F 34a_100000162943_100012361406 [0,2,0,0,0,0|2,0,0]=4 1222 B25R3.17226985 FC1(CCC(CC1)COC(c2ccccc2)c3ccccc3)F 34a_100000211180_100012361406 [0,2,0,0,0,0|2,0,0]=4 1223 B25R3.17226985 FC1(CCC(CC1)COC(c2ccccc2)c3ccccc3)F 7a_100000211180_100012361406 [0,2,0,0,0,0|2,0,0]=4 1224 B25R3.17226985 FC1(CCC(CC1)COC(c2ccccc2)c3ccccc3)F 7a_100012179939_100011216954 [0,2,0,0,0,0|2,0,0]=4 1225 B25R3.17226985 FC1(CCC(CC1)OCC(c2ccccc2)c3ccccc3)F 34a_100011215272_100009865109 [0,2,0,0,0,0|2,0,0]=4 1226 B25R3.17226985 FC1(CCC(CC1)OCC(c2ccccc2)c3ccccc3)F 7a_100011215272_100009865109 [0,2,0,0,0,0|2,0,0]=4 1227 B25R3.1604115 CCC1CCCC(C1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000756783 [0,2,0,0,0,0|2,0,0]=4 1228 B25R3.1604115 CSC1CCCC(C1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100012138059 [0,2,0,0,0,0|2,0,0]=4 1229 B25R3.2518667 CC1CC(CC(C1)NCC(c2ccccc2)c3ccccc3)C 270004a_100000739227_100000753413 [0,2,0,0,0,0|2,0,0]=4 1230 B25R3.2518667 CC1CC(CN(C1)CC=C(c2ccccc2)c3ccccc3)C 270004a_100000210448_100000050448 [0,2,0,0,0,0|0,0,2]=4 1231 B25R3.2518667 CC1CC(CN(C1)CCC(c2ccccc2)c3ccccc3)C 2230a_100000210448_100009813428 [0,2,0,0,0,0|0,0,0]=2 1232 B25R3.2518667 CC1CC(CN(C1)CCC(c2ccccc2)c3ccccc3)C 269982a_100000210448_100009813428 [0,2,0,0,0,0|0,0,0]=2 1233 B25R3.2518667 CC1CC(CN(C1)CCC(c2ccccc2)c3ccccc3)C 34a_100000210448_100009813428 [0,2,0,0,0,0|0,0,0]=2 1234 B25R3.3709786 CC1CCCC(C1)NCC(C)(c2ccccc2)c3ccccc3 270004a_100000706881_100000183594 [0,2,0,0,0,0|2,0,0]=4 1235 B25R3.18218583 CC1(CCCC(C1)NCC(c2ccccc2)c3ccccc3)C 270004a_100000739227_100000031663 [0,2,0,0,0,0|2,0,0]=4 1236 B25R3.18218583 CC1(CCCN(C1)CC=C(c2ccccc2)c3ccccc3)C 270004a_100000716857_100000050448 [0,2,0,0,0,0|0,0,2]=4 1237 B25R3.18218583 CC1(CCCN(C1)CCC(c2ccccc2)c3ccccc3)C 2230a_100000716857_100009813428 [0,2,0,0,0,0|0,0,0]=2 1238 B25R3.18218583 CC1(CCCN(C1)CCC(c2ccccc2)c3ccccc3)C 269982a_100000716857_100009813428 [0,2,0,0,0,0|0,0,0]=2 1239 B25R3.18218583 CC1(CCCN(C1)CCC(c2ccccc2)c3ccccc3)C 34a_100000716857_100009813428 [0,2,0,0,0,0|0,0,0]=2 1240 B25R3.2488225 C#CC(OCC1CCCCC1)(c2ccccc2)c3ccccc3 34a_100000033177_100000211423 [0,2,0,0,0,0|2,0,0]=4 1241 B25R3.2488225 C#CC(OCC1CCCCC1)(c2ccccc2)c3ccccc3 7a_100000033177_100000211423 [0,2,0,0,0,0|2,0,0]=4 1242 B25R3.64240365 N#CC1(CCCCC1)COC(c2ccccc2)c3ccccc3 34a_100000211180_100011219015 [0,2,0,0,0,0|2,0,0]=4 1243 B25R3.64240365 N#CC1(CCCCC1)CSC(c2ccccc2)c3ccccc3 62a_100000211591_100011219015 [0,2,0,0,0,0|2,0,0]=4 1244 B25R3.64240365 N#CC1(CCCCC1)CSC(c2ccccc2)c3ccccc3 62a_100011219015_100011216954 [0,2,0,0,0,0|2,0,0]=4 1245 B23R3.1793 CCC1CCCCN1C(c2ccccc2)c3ccccc3 2230a_100000210034_100000211591 [0,0,1,1,0,0|2,0,0]=4 1246 B23R3.1793 CCC1CCCCN1C(c2ccccc2)c3ccccc3 269982a_100000210034_100000211591 [0,0,1,1,0,0|2,0,0]=4 1247 B23R3.1793 CCC1CCCCN1C(c2ccccc2)c3ccccc3 270004a_100000210034_100000210122 [0,0,1,1,0,0|2,0,0]=4 1248 B23R3.1927702 c1ccc(cc1)C(c2ccccc2)N3CCCCCCC3 2230a_100000211400_100000211591 [0,0,1,1,0,0|2,0,0]=4 1249 B23R3.1927702 c1ccc(cc1)C(c2ccccc2)N3CCCCCCC3 269982a_100000211400_100000211591 [0,0,1,1,0,0|2,0,0]=4 1250 B23R3.1927702 c1ccc(cc1)C(c2ccccc2)N3CCCCCCC3 270004a_100000211400_100000210122 [0,0,1,1,0,0|2,0,0]=4 1251 B23R3.1927729 c1ccc(cc1)C(NC2CCCCCC2)c3ccccc3 2230a_100000210984_100000211591 [0,0,1,1,0,0|2,0,0]=4 1252 B23R3.1927729 c1ccc(cc1)C(NC2CCCCCC2)c3ccccc3 270004a_100000162943_100000210131 [0,0,1,1,0,0|2,0,0]=4 1253 B23R3.1927729 c1ccc(cc1)C(NC2CCCCCC2)c3ccccc3 270004a_100000210984_100000210122 [0,0,1,1,0,0|2,0,0]=4 1254 B23R3.1927729 c1ccc(cc1)C(NC2CCCCCC2)c3ccccc3 34a_100000162943_100011217769 [0,0,1,1,0,0|2,0,0]=4 1255 B23R3.1927729 c1ccc(cc1)C(OC2CCCCCC2)c3ccccc3 34a_100000211180_100011217769 [0,0,1,1,0,0|2,0,0]=4 1256 B23R3.1927729 c1ccc(cc1)C(OC2CCCCCC2)c3ccccc3 7a_100000210887_100011216954 [0,0,1,1,0,0|2,0,0]=4 1257 B23R3.1974330 c1ccc(cc1)C(CCOCCC2CC2)c3ccccc3 34a_100000032380_100000694398 [0,0,1,1,0,0|1,0,0]=3 1258 B23R3.1974330 c1ccc(cc1)C(CCOCCC2CC2)c3ccccc3 34a_100000754188_100009813428 [0,0,1,1,0,0|1,0,0]=3 1259 B23R3.1974330 c1ccc(cc1)C(CCOCCC2CC2)c3ccccc3 7a_100000032380_100000764125 [0,0,1,1,0,0|1,0,0]=3 1260 B23R3.1974330 c1ccc(cc1)C(CCOCCC2CC2)c3ccccc3 7a_100000754188_100009813428 [0,0,1,1,0,0|1,0,0]=3 1261 B23R3.1974330 c1ccc(cc1)C(CCSCCC2CC2)c3ccccc3 62a_100000764125_100009813428 [0,0,1,1,0,0|1,0,0]=3 1262 B23R3.1974330 c1ccc(cc1)C(CCSCCC2CC2)c3ccccc3 62a_100009813428_100000764125 [0,0,1,1,0,0|1,0,0]=3 1263 B23R3.1974330 c1ccc(cc1)[S+](CCSCCC2CC2)c3ccccc3 62a_100000764125_100010140906 [0,0,1,1,0,0|2,0,0]=4 1264 B23R3.1974330 c1ccc(cc1)[S+](CCSCCC2CC2)c3ccccc3 62a_100010140906_100000764125 [0,0,1,1,0,0|2,0,0]=4 1265 B23R3.3868845 c1ccc(cc1)C(CCOC2CCCC2)c3ccccc3 34a_100000032380_100000179811 [0,0,1,1,0,0|1,0,0]=3 1266 B23R3.3868845 c1ccc(cc1)C(CCOC2CCCC2)c3ccccc3 34a_100000210269_100009813428 [0,0,1,1,0,0|1,0,0]=3 1267 B23R3.3868845 c1ccc(cc1)C(CCOC2CCCC2)c3ccccc3 7a_100000032380_100000179811 [0,0,1,1,0,0|1,0,0]=3 1268 B23R3.3868845 c1ccc(cc1)C(CCOC2CCCC2)c3ccccc3 7a_100000210269_100009813428 [0,0,1,1,0,0|1,0,0]=3 1269 B23R3.3868845 c1ccc(cc1)C(CCSC2CCCC2)c3ccccc3 62a_100009813428_100000179811 [0,0,1,1,0,0|1,0,0]=3 1270 B23R3.3868845 c1ccc(cc1)C(CCSC2CCCC2)c3ccccc3 62a_100011217020_100009813428 [0,0,1,1,0,0|1,0,0]=3 1271 B23R3.3868845 c1ccc(cc1)C(COCC2CCCC2)c3ccccc3 34a_100011215272_100000740388 [0,0,1,1,0,0|2,0,0]=4 1272 B23R3.3868845 c1ccc(cc1)C(COCC2CCCC2)c3ccccc3 7a_100011215272_100000740388 [0,0,1,1,0,0|2,0,0]=4 1273 B23R3.3868845 c1ccc(cc1)C(OCCC2CCCC2)c3ccccc3 34a_100000211180_100000760354 [0,0,1,1,0,0|2,0,0]=4 1274 B23R3.3868845 c1ccc(cc1)C(OCCC2CCCC2)c3ccccc3 7a_100000211180_100000760354 [0,0,1,1,0,0|2,0,0]=4 1275 B23R3.3868845 c1ccc(cc1)C(OCCC2CCCC2)c3ccccc3 7a_100000749090_100011216954 [0,0,1,1,0,0|2,0,0]=4 1276 B23R3.3868845 c1ccc(cc1)[S+](CCSC2CCCC2)c3ccccc3 62a_100010140906_100000179811 [0,0,1,1,0,0|2,0,0]=4 1277 B23R3.3868845 c1ccc(cc1)[S+](CCSC2CCCC2)c3ccccc3 62a_100011217020_100010140906 [0,0,1,1,0,0|2,0,0]=4 1278 B23R3.3868848 c1ccc(cc1)C(CCOCC2CCC2)c3ccccc3 34a_100000032380_100000763275 [0,0,1,1,0,0|1,0,0]=3 1279 B23R3.3868848 c1ccc(cc1)C(CCOCC2CCC2)c3ccccc3 34a_100000760304_100009813428 [0,0,1,1,0,0|1,0,0]=3 1280 B23R3.3868848 c1ccc(cc1)C(CCOCC2CCC2)c3ccccc3 7a_100000032380_100000763275 [0,0,1,1,0,0|1,0,0]=3 1281 B23R3.3868848 c1ccc(cc1)C(CCSCC2CCC2)c3ccccc3 62a_100000763275_100009813428 [0,0,1,1,0,0|1,0,0]=3 1282 B23R3.3868848 c1ccc(cc1)C(CCSCC2CCC2)c3ccccc3 62a_100009813428_100000763275 [0,0,1,1,0,0|1,0,0]=3 1283 B23R3.3868848 c1ccc(cc1)[S+](CCSCC2CCC2)c3ccccc3 62a_100000763275_100010140906 [0,0,1,1,0,0|2,0,0]=4 1284 B23R3.3868848 c1ccc(cc1)[S+](CCSCC2CCC2)c3ccccc3 62a_100010140906_100000763275 [0,0,1,1,0,0|2,0,0]=4 1285 B23R3.19744219 CCCCCCCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100000210681 [0,0,1,1,0,0|2,0,0]=4 1286 B23R3.19744219 CCCCCCCNC1c2ccccc2-c3c1cccc3 2230a_100000229938_100000211598 [0,0,1,1,0,0|2,0,0]=4 1287 B23R3.19744219 CCCCCCCOC1c2ccccc2-c3c1cccc3 7a_100000210272_100000211598 [0,0,1,1,0,0|2,0,0]=4 1288 B23R3.19744219 CCCCCCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000210614 [0,0,1,1,0,0|2,0,0]=4 1289 B23R3.19744219 CCCCCCOCC1c2ccccc2-c3c1cccc3 34a_100011215202_100000210314 [0,0,1,1,0,0|2,0,0]=4 1290 B23R3.19744219 CCCCCCOCC1c2ccccc2-c3c1cccc3 7a_100011215202_100000210314 [0,0,1,1,0,0|2,0,0]=4 1291 B23R3.19744219 CCCCCOCCn1c2ccccc2c3c1cccc3 34a_100000297428_100000718602 [0,0,1,1,0,0|2,0,0]=4 1292 B23R3.32362876 CCCCC(C)COC1c2ccccc2-c3c1cccc3 7a_100011995851_100000211598 [0,0,1,1,0,0|2,0,0]=4 1293 B23R3.32362876 CCCCC(C)OCC1c2ccccc2-c3c1cccc3 34a_100011215202_200011215066 [0,0,1,1,0,0|2,0,0]=4 1294 B23R3.32362876 CCCCC(C)OCC1c2ccccc2-c3c1cccc3 7a_100011215202_200011215066 [0,0,1,1,0,0|2,0,0]=4 1295 B23R3.8717540 CCCC(CC)OCC1c2ccccc2-c3c1cccc3 7a_100011215202_100011219200 [0,0,1,1,0,0|2,0,0]=4 1296 B23R4.1520393 c1ccc2c(c1)-c3ccccc3C2OC4CCCCC4 7a_100000210231_100000211598 [0,0,0,1,1,0|2,0,0]=4 1297 B23R4.1520393 c1ccc2c(c1)-c3ccccc3C2OC4CCCCC4 7a_100000211495_100000210327 [0,0,0,1,1,0|2,0,0]=4 1298 B23R4.1520393 c1ccc2c(c1)-c3ccccc3C2SC4CCCCC4 62a_100000211598_100000210327 [0,0,0,1,1,0|2,0,0]=4 1299 B23R4.1517316 c1ccc2c(c1)-c3ccccc3C2SCC4CCCC4 62a_100000211598_100000740388 [0,0,0,1,1,0|2,0,0]=4 1300 B25R4.8312528 c1ccc(cc1)CC(OC2C3CCC2CC3)c4ccccc4 34a_100000246494_100009813300 [0,0,0,1,0,1|2,0,0]=4 1301 B25R4.1655245 C1=C(CCCC1)CCNC2c3ccccc3-c4c2cccc4 2230a_100000212019_100000211598 [0,0,0,1,0,1|1,0,1]=4 1302 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2COCC4CCCCC4 34a_100011215202_100000211423 [0,0,0,1,0,1|1,0,0]=3 1303 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2COCC4CCCCC4 7a_100011215202_100000211423 [0,0,0,1,0,1|1,0,0]=3 1304 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2NCCC4CCCCC4 2230a_100000104097_100012355289 [0,0,0,1,0,1|1,0,0]=3 1305 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2NCCC4CCCCC4 2230a_100000738074_100000211598 [0,0,0,1,0,1|1,0,0]=3 1306 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2NCCC4CCCCC4 270004a_100000104097_100011713444 [0,0,0,1,0,1|1,0,0]=3 1307 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2OCCC4CCCCC4 7a_100000211495_100011273959 [0,0,0,1,0,1|1,0,0]=3 1308 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2OCCC4CCCCC4 7a_100011217863_100000211598 [0,0,0,1,0,1|1,0,0]=3 1309 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2OCOC4CCCCC4 7a_100000211495_100011935260 [0,0,0,1,0,1|2,0,0]=4 1310 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2SCCC4CCOCC4 62a_100000211598_100011934994 [0,0,0,1,0,1|2,0,0]=4 1311 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2SCOC4CCCCC4 62a_100000211598_100011935260 [0,0,0,1,0,1|2,0,0]=4 1312 B25R4.1655245 c1ccc2c(c1)c3ccccc3n2CCOC4CCCCC4 34a_100000297428_100000210327 [0,0,0,1,0,1|2,0,0]=4 1313 B25R4.8313090 c1ccc(cc1)C(CCOC2CCC3C2C3)c4ccccc4 34a_200012295571_100009813428 [0,0,0,1,0,1|1,0,0]=3 1314 B25R4.8313093 c1ccc(cc1)C(COC2C3CCC2CC3)c4ccccc4 34a_100011215272_100009813300 [0,0,0,1,0,1|1,0,0]=3 1315 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2CNC4CCCCCC4 270004a_100016995487_100000210131 [0,0,0,1,0,1|2,0,0]=4 1316 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2CNC4CCCCCC4 34a_100016995487_100011217769 [0,0,0,1,0,1|2,0,0]=4 1317 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2COC4CCCCCC4 34a_100011215202_100011217769 [0,0,0,1,0,1|2,0,0]=4 1318 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2NCC4CCCCCC4 2230a_100000104097_200000696569 [0,0,0,1,0,1|2,0,0]=4 1319 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2NCC4CCCCCC4 2230a_100015204231_100000211598 [0,0,0,1,0,1|2,0,0]=4 1320 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2NCC4CCCCCC4 269862a_100000104097_200000763224 [0,0,0,1,0,1|2,0,0]=4 1321 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2OCC4CCCCCC4 7a_100000211495_200000696569 [0,0,0,1,0,1|2,0,0]=4 1322 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2OCC4CCCCCC4 7a_100000699130_100000211598 [0,0,0,1,0,1|2,0,0]=4 1323 B25R4.54373159 CC(NC1c2ccccc2-c3c1cccc3)C4CCCCC4 269862a_100000104097_100000210989 [0,1,0,1,0,0|2,0,0]=4 1324 B25R4.54373159 CC(OC1c2ccccc2-c3c1cccc3)C4CCCCC4 7a_100011216961_100000211598 [0,1,0,1,0,0|2,0,0]=4 1325 B25R4.54373159 C[C@@H](NC1c2ccccc2-c3c1cccc3)C4CCCCC4 2230a_100025707633_100000211598 [0,1,0,1,0,0|2,0,0]=4 1326 B25R4.54373159 O=C(CC1c2ccccc2-c3c1cccc3)C4CCCCC4 1458a_100000011082_100000210327 [0,1,0,1,0,0|1,0,1]=4 1327 B25R4.2295206 Brc1cccc(c1)C(NC2C3CCC2CC3)c4ccccc4 34a_100011212009_100009813300 [0,1,0,1,0,0|2,0,0]=4 1328 B25R4.2295206 Clc1cccc(c1)C(NC2C3CCC2CC3)c4ccccc4 34a_100000741085_100009813300 [0,1,0,1,0,0|2,0,0]=4 1329 B25R4.2295206 Clc1cccc(c1)C(OC2C3CCC2CC3)c4ccccc4 34a_100000733576_100009813300 [0,1,0,1,0,0|2,0,0]=4 1330 B25R4.2295206 Fc1cccc(c1)C(OC2C3CCC2CC3)c4ccccc4 34a_100000749007_100009813300 [0,1,0,1,0,0|2,0,0]=4 1331 B25R4.50009191 Brc1cccc(c1)C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100011267660 [0,1,0,1,0,0|2,0,0]=4 1332 B25R4.50009191 Clc1cccc(c1)C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100011215489 [0,1,0,1,0,0|2,0,0]=4 1333 B25R4.2786505 Brc1ccccc1C(NC2C3CCC2CC3)c4ccccc4 34a_100011211563_100009813300 [0,1,0,1,0,0|2,0,0]=4 1334 B25R4.2786505 Cc1ccccc1C(OC2C3CCC2CC3)c4ccccc4 34a_100000212071_100009813300 [0,1,0,1,0,0|2,0,0]=4 1335 B25R4.2786505 Clc1ccccc1C(OC2C3CCC2CC3)c4ccccc4 34a_200011400577_100009813300 [0,1,0,1,0,0|2,0,0]=4 1336 B25R4.3999423 Brc1ccccc1C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100000198044 [0,1,0,1,0,0|2,0,0]=4 1337 B25R4.3999423 Clc1ccccc1C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100011215288 [0,1,0,1,0,0|2,0,0]=4 1338 B25R4.8316760 c1ccc2c(c1)Oc3ccccc3C2NCC4CCCCC4 2230a_200000704616_100000211423 [0,1,0,1,0,0|2,0,0]=4 1339 B25R4.8316760 c1ccc2c(c1)Oc3ccccc3C2NCC4CCCCC4 269862a_200000704616_100000211278 [0,1,0,1,0,0|2,0,0]=4 1340 B25R4.8316760 c1ccc2c(c1)Oc3ccccc3C2OCC4CCCCC4 7a_100000210167_100000211423 [0,1,0,1,0,0|2,0,0]=4 1341 B25R4.2358200 FC1CCCCC1OCC2c3ccccc3-c4c2cccc4 34a_100011215202_100015423560 [0,1,0,1,0,0|2,0,0]=4 1342 B25R4.8321568 c1ccc(cc1)C(COC2CC3CCC2C3)c4ccccc4 34a_100011215272_100000727232 [0,1,0,1,0,0|2,0,0]=4 1343 B25R4.4911602 CN(CC1CCCCC1)C2c3ccccc3-c4c2cccc4 2230a_100000736448_100000211598 [0,1,0,1,0,0|2,0,0]=4 1344 B25R4.4911602 CN(CC1CCCCC1)C2c3ccccc3-c4c2cccc4 269982a_100000736448_100000211598 [0,1,0,1,0,0|2,0,0]=4 1345 B25R4.4911602 C[C@@H](OC1CCCCC1)C2c3ccccc3-c4c2cccc4 34a_200102646376_100000210327 [0,1,0,1,0,0|2,0,0]=4 1346 B25R4.4911602 C[C@@H](OC1CCCCC1)C2c3ccccc3-c4c2cccc4 7a_200102646376_100000210327 [0,1,0,1,0,0|2,0,0]=4 1347 B25R4.4911602 O=C(CC1CCCCC1)C2c3ccccc3-c4c2cccc4 1458a_100000182576_100000211423 [0,1,0,1,0,0|1,0,1]=4 1348 B25R4.2257094 Brc1ccc(cc1)C(NC2C3CCC2CC3)c4ccccc4 34a_100000745999_100009813300 [0,1,0,1,0,0|2,0,0]=4 1349 B25R4.2257094 Brc1ccc(cc1)C(OC2C3CCC2CC3)c4ccccc4 34a_100011217567_100009813300 [0,1,0,1,0,0|2,0,0]=4 1350 B25R4.2257094 Cc1ccc(cc1)C(OC2C3CCC2CC3)c4ccccc4 34a_100000212064_100009813300 [0,1,0,1,0,0|2,0,0]=4 1351 B25R4.2257094 Clc1ccc(cc1)C(NC2C3CCC2CC3)c4ccccc4 34a_100000737946_100009813300 [0,1,0,1,0,0|2,0,0]=4 1352 B25R4.2257094 Clc1ccc(cc1)C(OC2C3CCC2CC3)c4ccccc4 34a_100000211768_100009813300 [0,1,0,1,0,0|2,0,0]=4 1353 B25R4.2257094 Fc1ccc(cc1)C(OC2C3CCC2CC3)c4ccccc4 34a_200000246460_100009813300 [0,1,0,1,0,0|2,0,0]=4 1354 B25R4.5855172 Brc1ccc(cc1)C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100000718703 [0,1,0,1,0,0|2,0,0]=4 1355 B25R4.5855172 Clc1ccc(cc1)C(c2ccccc2)N3CC4CCC3CC4 2230a_100000750499_100000211669 [0,1,0,1,0,0|2,0,0]=4 1356 B25R4.5855172 Clc1ccc(cc1)C(c2ccccc2)N3CC4CCC3CC4 269982a_100000750499_100000211669 [0,1,0,1,0,0|2,0,0]=4 1357 B25R4.5855172 Clc1ccc(cc1)C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100000211064 [0,1,0,1,0,0|2,0,0]=4 1358 B25R4.5851424 CC1CCC(CC1)CNC2c3ccccc3-c4c2cccc4 2230a_103436935547_100000211598 [0,1,0,1,0,0|2,0,0]=4 1359 B25R4.5851424 CC1CCC(CC1)OCC2c3ccccc3-c4c2cccc4 34a_100011215202_200011216234 [0,1,0,1,0,0|2,0,0]=4 1360 B25R4.203346805 CC1(c2ccccc2-c3c1cccc3)OCC4CCCCC4 34a_100000075291_100000211423 [0,1,0,1,0,0|2,0,0]=4 1361 B25R4.203346805 CC1(c2ccccc2-c3c1cccc3)OCC4CCCCC4 7a_100000075291_100000211423 [0,1,0,1,0,0|2,0,0]=4 1362 B25R4.236874653 CC1(CCCCC1)CNC2c3ccccc3-c4c2cccc4 2230a_100000706052_100000211598 [0,1,0,1,0,0|2,0,0]=4 1363 B25R4.236874653 CC1(CCCCC1)CNC2c3ccccc3-c4c2cccc4 269862a_100000104097_100011935227 [0,1,0,1,0,0|2,0,0]=4 1364 B25R4.236874653 CC1(CCCCC1)COC2c3ccccc3-c4c2cccc4 7a_100000688186_100000211598 [0,1,0,1,0,0|2,0,0]=4 1365 B25R4.236874653 FC1(CCCCC1)COC2c3ccccc3-c4c2cccc4 7a_100000090305_100000211598 [0,1,0,1,0,0|2,0,0]=4 1366 B25R5.1148993 c1ccc2c(c1)-c3ccccc3C2SC4C5CCC4CC5 62a_100000211598_100009813300 [0,0,0,2,0,0|2,0,0]=4 1367 B21R2.25778 CCCCC(C)OC(c1ccccc1)c2ccccc2 34a_100000211180_200011215066 [0,0,1,0,1,0|2,0,0]=4 1368 B21R2.25778 CCCCC(C)OC(c1ccccc1)c2ccccc2 7a_100000211180_200011215066 [0,0,1,0,1,0|2,0,0]=4 1369 B21R2.25778 CCCCC(C)OC(c1ccccc1)c2ccccc2 7a_100000687866_100011216954 [0,0,1,0,1,0|2,0,0]=4 1370 B21R2.5883 CCCC(CC)OC(c1ccccc1)c2ccccc2 7a_100000211180_100011219200 [0,0,1,0,1,0|2,0,0]=4 1371 B21R2.5883 CCCC(CC)OC(c1ccccc1)c2ccccc2 7a_100000687864_100011216954 [0,0,1,0,1,0|2,0,0]=4 1372 B21R3.47836 c1ccc(cc1)C(SC2CCCC2)c3ccccc3 62a_100000211591_100000179811 [0,0,0,0,2,0|2,0,0]=4 1373 B21R3.47836 c1ccc(cc1)C(SC2CCCC2)c3ccccc3 62a_100011217020_100011216954 [0,0,0,0,2,0|2,0,0]=4 1374 B21R3.47850 c1ccc(cc1)C(SCC2CCC2)c3ccccc3 62a_100000211591_100000763275 [0,0,0,0,2,0|2,0,0]=4 1375 B21R3.47850 c1ccc(cc1)C(SCC2CCC2)c3ccccc3 62a_100000763275_100011216954 [0,0,0,0,2,0|2,0,0]=4 1376 B23R2.3575 CCCCCCCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000210681 [0,0,1,0,0,1|2,0,0]=4 1377 B23R2.3575 CCCCCCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000210614 [0,0,1,0,0,1|2,0,0]=4 1378 B23R2.3575 CCCCCCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000210614 [0,0,1,0,0,1|2,0,0]=4 1379 B23R2.6160 CCCC(CC)NCCC(c1ccccc1)c2ccccc2 2230a_100000747048_100009813428 [0,0,1,0,0,1|1,0,0]=3 1380 B23R2.6160 CCCC(CC)NCCC(c1ccccc1)c2ccccc2 270004a_100000272388_100000687865 [0,0,1,0,0,1|1,0,0]=3 1381 B23R2.6160 CCCC(CC)OCCC(c1ccccc1)c2ccccc2 34a_100000687864_100009813428 [0,0,1,0,0,1|1,0,0]=3 1382 B23R2.6160 CCCC(CC)OCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011219200 [0,0,1,0,0,1|1,0,0]=3 1383 B23R2.6160 CCCC(CC)OCCC(c1ccccc1)c2ccccc2 7a_100000687864_100009813428 [0,0,1,0,0,1|1,0,0]=3 1384 B23R2.6160 CCCC(CC)OCCN(c1ccccc1)c2ccccc2 7a_100010001939_100011219200 [0,0,1,0,0,1|2,0,0]=4 1385 B23R2.6160 CCCC(CC)OCC[S+](c1ccccc1)c2ccccc2 7a_100000687864_100010140906 [0,0,1,0,0,1|2,0,0]=4 1386 B23R2.6160 CCCC(CCOC(c1ccccc1)c2ccccc2)SC 7a_100000032865_100011216954 [0,0,1,0,0,1|2,0,0]=4 1387 B23R3.4587 c1ccc(cc1)CC(OC2CCCCC2)c3ccccc3 34a_100000246494_100000210327 [0,0,0,0,1,1|2,0,0]=4 1388 B23R3.4587 c1ccc(cc1)CC(OC2CCCCC2)c3ccccc3 7a_100000246494_100000210327 [0,0,0,0,1,1|2,0,0]=4 1389 B23R3.4587 c1ccc(cc1)CN(CC2CCCCC2)c3ccccc3 2230a_100000188819_100000211423 [0,0,0,0,1,1|2,0,0]=4 1390 B23R3.4587 c1ccc(cc1)CN(CC2CCCCC2)c3ccccc3 269982a_100000188819_100000211423 [0,0,0,0,1,1|2,0,0]=4 1391 B23R3.4587 c1ccc(cc1)CN(CC2CCCCC2)c3ccccc3 34a_100000188819_100000211423 [0,0,0,0,1,1|2,0,0]=4 1392 B23R3.4595 c1ccc(cc1)C(NCCC2CCCCC2)c3cccs3 2230a_100025760362_100012355289 [0,0,0,0,1,1|2,0,0]=4 1393 B23R3.4595 c1ccc(cc1)C(NCCC2CCCCC2)c3cccs3 270004a_100000738074_100011214959 [0,0,0,0,1,1|2,0,0]=4 1394 B23R3.4595 c1ccc(cc1)C(NCCC2CCCCC2)c3cccs3 270004a_100025760362_100011713444 [0,0,0,0,1,1|2,0,0]=4 1395 B23R3.4595 c1ccc(cc1)C(NCCC2CCCCC2)c3cccs3 34a_100025760362_100011209188 [0,0,0,0,1,1|2,0,0]=4 1396 B23R3.1974208 c1ccc(cc1)CC(OCC2CCCC2)c3ccccc3 34a_100000246494_100000740388 [0,0,0,0,1,1|2,0,0]=4 1397 B23R3.1974208 c1ccc(cc1)CC(OCC2CCCC2)c3ccccc3 7a_100000246494_100000740388 [0,0,0,0,1,1|2,0,0]=4 1398 B23R3.1974208 c1ccc(cc1)CN(CCC2CCCC2)c3ccccc3 2230a_100000188819_100000760354 [0,0,0,0,1,1|2,0,0]=4 1399 B23R3.1974208 c1ccc(cc1)CN(CCC2CCCC2)c3ccccc3 269982a_100000188819_100000760354 [0,0,0,0,1,1|2,0,0]=4 1400 B23R3.1974208 c1ccc(cc1)CN(CCC2CCCC2)c3ccccc3 34a_100000188819_100000760354 [0,0,0,0,1,1|2,0,0]=4 1401 B25R3.6850 c1ccc(cc1)CC(Cc2ccccc2)NCC3CCCCC3 2230a_100000261440_100000211423 [0,0,0,0,0,2|2,0,0]=4 1402 B25R3.6850 c1ccc(cc1)CC(Cc2ccccc2)NCC3CCCCC3 269862a_100000261440_100000211278 [0,0,0,0,0,2|2,0,0]=4 1403 B25R3.6850 c1ccc(cc1)CC(Cc2ccccc2)OCC3CCCCC3 34a_100000285930_100000211423 [0,0,0,0,0,2|2,0,0]=4 1404 B25R3.6850 c1ccc(cc1)CC(Cc2ccccc2)OCC3CCCCC3 7a_100000285930_100000211423 [0,0,0,0,0,2|2,0,0]=4 1405 B25R3.6850 c1ccc(cc1)CN(CCC2CCCCC2)Cc3ccccc3 2230a_100000185734_100012355289 [0,0,0,0,0,2|2,0,0]=4 1406 B25R3.6850 c1ccc(cc1)CN(CCC2CCCCC2)Cc3ccccc3 269982a_100000185734_100011273959 [0,0,0,0,0,2|2,0,0]=4 1407 B25R3.6850 c1ccc(cc1)CN(CCC2CCCCC2)Cc3ccccc3 270004a_100000185734_100011713444 [0,0,0,0,0,2|2,0,0]=4 1408 B25R3.6855 c1ccc(cc1)CC(NCCC2CCCCC2)c3ccccc3 2230a_100025772854_100012355289 [0,0,0,0,0,2|1,0,0]=3 1409 B25R3.6855 c1ccc(cc1)CC(NCCC2CCCCC2)c3ccccc3 270004a_100025772854_100011713444 [0,0,0,0,0,2|1,0,0]=3 1410 B25R3.6855 c1ccc(cc1)CC(OCCC2CCCCC2)c3ccccc3 34a_100000246494_100011209188 [0,0,0,0,0,2|1,0,0]=3 1411 B25R3.6855 c1ccc(cc1)CC(OCCC2CCCCC2)c3ccccc3 7a_100000246494_100011273959 [0,0,0,0,0,2|1,0,0]=3 1412 B25R3.6855 c1ccc(cc1)CC(OCOC2CCCCC2)c3ccccc3 34a_100000246494_100011935260 [0,0,0,0,0,2|2,0,0]=4 1413 B25R3.6855 c1ccc(cc1)CC(OCOC2CCCCC2)c3ccccc3 7a_100000246494_100011935260 [0,0,0,0,0,2|2,0,0]=4 1414 B25R3.6855 c1ccc(cc1)CN(CCOC2CCCCC2)c3ccccc3 2230a_100000188819_100011211530 [0,0,0,0,0,2|2,0,0]=4 1415 B25R3.6855 c1ccc(cc1)CN(CCOC2CCCCC2)c3ccccc3 269982a_100000188819_100011211530 [0,0,0,0,0,2|2,0,0]=4 1416 B25R3.6855 c1ccc(cc1)CN(CCOC2CCCCC2)c3ccccc3 34a_100000188819_100011211530 [0,0,0,0,0,2|2,0,0]=4 1417 B25R3.1946061 c1ccc(cc1)CC(NCC2CCCCCC2)c3ccccc3 2230a_100025772854_200000696569 [0,0,0,0,0,2|2,0,0]=4 1418 B25R3.1946061 c1ccc(cc1)CC(NCC2CCCCCC2)c3ccccc3 269862a_100025772854_200000763224 [0,0,0,0,0,2|2,0,0]=4 1419 B25R3.1946061 c1ccc(cc1)CC(OCC2CCCCCC2)c3ccccc3 34a_100000246494_200000696569 [0,0,0,0,0,2|2,0,0]=4 1420 B25R3.1946061 c1ccc(cc1)CC(OCC2CCCCCC2)c3ccccc3 7a_100000246494_200000696569 [0,0,0,0,0,2|2,0,0]=4 1421 B25R3.2065771 C(#CC(OCC1CCCCC1)c2ccccc2)c3ccccc3 34a_200000068236_100000211423 [0,0,0,0,0,2|2,0,0]=4 1422 B25R3.2065771 C(#CC(OCC1CCCCC1)c2ccccc2)c3ccccc3 7a_200000068236_100000211423 [0,0,0,0,0,2|2,0,0]=4 1423 B25R3.2065771 c1ccc(cc1)CCC(NCC2CCCCC2)c3ccccc3 2230a_100000741669_100000211423 [0,0,0,0,0,2|2,0,0]=4 1424 B25R3.2065771 c1ccc(cc1)CCC(NCC2CCCCC2)c3ccccc3 269862a_100000210473_100000685657 [0,0,0,0,0,2|2,0,0]=4 1425 B25R3.2065771 c1ccc(cc1)CCC(NCC2CCCCC2)c3ccccc3 269862a_100000741669_100000211278 [0,0,0,0,0,2|2,0,0]=4 1426 B25R3.2065771 c1ccc(cc1)CCC(NCC2CCCCC2)c3ccccc3 34a_100000741669_100000211423 [0,0,0,0,0,2|2,0,0]=4 1427 B25R3.2065771 c1ccc(cc1)CCC(OCC2CCCCC2)c3ccccc3 34a_200000373236_100000211423 [0,0,0,0,0,2|2,0,0]=4 1428 B25R3.2065771 c1ccc(cc1)CCC(OCC2CCCCC2)c3ccccc3 7a_200000373236_100000211423 [0,0,0,0,0,2|2,0,0]=4 1429 B25R3.2065771 c1ccc(cc1)OCC(OCC2CCCCC2)c3ccccc3 34a_100000259978_100000211423 [0,0,0,0,0,2|2,0,0]=4 1430 B25R3.2065771 c1ccc(cc1)OCC(OCC2CCCCC2)c3ccccc3 7a_100000259978_100000211423 [0,0,0,0,0,2|2,0,0]=4 1431 B25R3.6854 C(=C(c1ccccc1)c2ccccc2)CNCC3CCCCC3 270004a_100000210473_100000050448 [0,0,0,0,0,2|1,0,1]=4 1432 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCC2)c3ccccc3 2230a_100000210473_100009813428 [0,0,0,0,0,2|1,0,0]=3 1433 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCC2)c3ccccc3 2230a_100000272388_100000211423 [0,0,0,0,0,2|1,0,0]=3 1434 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCC2)c3ccccc3 269862a_100000272388_100000211278 [0,0,0,0,0,2|1,0,0]=3 1435 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCC2)c3ccccc3 34a_100000210473_100009813428 [0,0,0,0,0,2|1,0,0]=3 1436 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCC2)c3ccccc3 34a_100000272388_100000211423 [0,0,0,0,0,2|1,0,0]=3 1437 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCCC2)c3ccccc3 34a_100000032380_100000211423 [0,0,0,0,0,2|1,0,0]=3 1438 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCCC2)c3ccccc3 34a_100000212181_100009813428 [0,0,0,0,0,2|1,0,0]=3 1439 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCCC2)c3ccccc3 7a_100000032380_100000211423 [0,0,0,0,0,2|1,0,0]=3 1440 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCCC2)c3ccccc3 7a_100000212181_100009813428 [0,0,0,0,0,2|1,0,0]=3 1441 B25R3.6854 c1ccc(cc1)C(CCOCC2CCSCC2)c3ccccc3 34a_100000070558_100009813428 [0,0,0,0,0,2|2,0,0]=4 1442 B25R3.6854 c1ccc(cc1)C(CCOCC2CCSCC2)c3ccccc3 7a_100000070558_100009813428 [0,0,0,0,0,2|2,0,0]=4 1443 B25R3.6854 c1ccc(cc1)C(CCSCC2CCCCO2)c3ccccc3 62a_100000211543_100009813428 [0,0,0,0,0,2|2,0,0]=4 1444 B25R3.6854 c1ccc(cc1)C(CCSCC2CCCCO2)c3ccccc3 62a_100009813428_100000211543 [0,0,0,0,0,2|2,0,0]=4 1445 B25R3.6854 c1ccc(cc1)C(CCSCC2CCCOC2)c3ccccc3 62a_100000741521_100009813428 [0,0,0,0,0,2|2,0,0]=4 1446 B25R3.6854 c1ccc(cc1)C(CCSCC2CCCOC2)c3ccccc3 62a_100009813428_100000741521 [0,0,0,0,0,2|2,0,0]=4 1447 B25R3.6854 c1ccc(cc1)C(CCSCC2CCOCC2)c3ccccc3 62a_100000754603_100009813428 [0,0,0,0,0,2|2,0,0]=4 1448 B25R3.6854 c1ccc(cc1)C(CCSCC2CCOCC2)c3ccccc3 62a_100009813428_100000749018 [0,0,0,0,0,2|2,0,0]=4 1449 B25R3.6854 c1ccc(cc1)C(CNCCC2CCCCC2)c3ccccc3 2230a_100000739227_100012355289 [0,0,0,0,0,2|1,0,0]=3 1450 B25R3.6854 c1ccc(cc1)C(CNCCC2CCCCC2)c3ccccc3 270004a_100000739227_100011713444 [0,0,0,0,0,2|1,0,0]=3 1451 B25R3.6854 c1ccc(cc1)C(CNCCC2CCCCC2)c3ccccc3 34a_100000739227_100011209188 [0,0,0,0,0,2|1,0,0]=3 1452 B25R3.6854 c1ccc(cc1)C(COCCC2CCCCC2)c3ccccc3 34a_100011215272_100011209188 [0,0,0,0,0,2|1,0,0]=3 1453 B25R3.6854 c1ccc(cc1)C(COCCC2CCCCC2)c3ccccc3 7a_100011215272_100011273959 [0,0,0,0,0,2|1,0,0]=3 1454 B25R3.6854 c1ccc(cc1)C(COCOC2CCCCC2)c3ccccc3 34a_100011215272_100011935260 [0,0,0,0,0,2|1,0,0]=3 1455 B25R3.6854 c1ccc(cc1)C(COCOC2CCCCC2)c3ccccc3 7a_100011215272_100011935260 [0,0,0,0,0,2|1,0,0]=3 1456 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3ccccc3 2230a_100000162943_100011713725 [0,0,0,0,0,2|1,0,0]=3 1457 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3ccccc3 2230a_100011211642_100000211591 [0,0,0,0,0,2|1,0,0]=3 1458 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3ccccc3 270004a_100011211642_100000210122 [0,0,0,0,0,2|1,0,0]=3 1459 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3ccccc3 34a_100000162943_100011713725 [0,0,0,0,0,2|1,0,0]=3 1460 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3ccccn3 2230a_100000689936_100011713725 [0,0,0,0,0,2|2,0,0]=4 1461 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3ccccn3 270004a_100011211642_100000210380 [0,0,0,0,0,2|2,0,0]=4 1462 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3cccnc3 2230a_100011232609_100011713725 [0,0,0,0,0,2|2,0,0]=4 1463 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3cccnc3 270004a_100011211642_100000735413 [0,0,0,0,0,2|2,0,0]=4 1464 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3ccncc3 2230a_100025760769_100011713725 [0,0,0,0,0,2|2,0,0]=4 1465 B25R3.6854 c1ccc(cc1)C(OCCCC2CCCCC2)c3ccccn3 7a_100000180852_100011713725 [0,0,0,0,0,2|2,0,0]=4 1466 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCC2)c3ccccc3 34a_100000210231_100000734929 [0,0,0,0,0,2|1,0,0]=3 1467 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCC2)c3ccccc3 34a_100000211180_100011211530 [0,0,0,0,0,2|1,0,0]=3 1468 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCC2)c3ccccc3 7a_100000210231_100000734929 [0,0,0,0,0,2|1,0,0]=3 1469 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCC2)c3ccccc3 7a_100000211180_100011211530 [0,0,0,0,0,2|1,0,0]=3 1470 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCC2)c3ccccc3 7a_100011249652_100011216954 [0,0,0,0,0,2|1,0,0]=3 1471 B25R3.6854 c1ccc(cc1)C(OCCSC2CCCCC2)c3ccccc3 62a_100000210327_100000734929 [0,0,0,0,0,2|1,0,0]=3 1472 B25R3.6854 c1ccc(cc1)C(OCCSC2CCCCC2)c3ccccc3 62a_100000734929_100000210327 [0,0,0,0,0,2|1,0,0]=3 1473 B25R3.6854 c1ccc(cc1)C(OCCSC2CCSCC2)c3ccccc3 62a_100000734929_100000069128 [0,0,0,0,0,2|2,0,0]=4 1474 B25R3.6854 c1ccc(cc1)C(SCCCN2CCCCC2)c3ccccc3 62a_100000211591_100000007876 [0,0,0,0,0,2|0,0,0]=2 1475 B25R3.6854 c1ccc(cc1)C(SCCCN2CCCCC2)c3ccccc3 62a_100132302099_100011216954 [0,0,0,0,0,2|0,0,0]=2 1476 B25R3.6854 c1ccc(cc1)C(SCCOC2CCCCC2)c3ccccc3 62a_100000211591_100011211530 [0,0,0,0,0,2|1,0,0]=3 1477 B25R3.6854 c1ccc(cc1)C(SCCOC2CCCCC2)c3ccccc3 62a_100011211530_100011216954 [0,0,0,0,0,2|1,0,0]=3 1478 B25R3.6854 c1ccc(cc1)C(SCCOC2CCCCO2)c3ccccc3 62a_100000211591_100000744793 [0,0,0,0,0,2|2,0,0]=4 1479 B25R3.6854 c1ccc(cc1)C(SCCOC2CCCCO2)c3ccccc3 62a_100000744793_100011216954 [0,0,0,0,0,2|2,0,0]=4 1480 B25R3.6854 c1ccc(cc1)N(CCOCC2CCCCC2)c3ccccc3 34a_100010001939_100000211423 [0,0,0,0,0,2|2,0,0]=4 1481 B25R3.6854 c1ccc(cc1)N(CCOCC2CCCCC2)c3ccccc3 7a_100010001939_100000211423 [0,0,0,0,0,2|2,0,0]=4 1482 B25R3.6854 c1ccc(cc1)[S+](CCOCC2CCCCC2)c3ccccc3 7a_100000212181_100010140906 [0,0,0,0,0,2|2,0,0]=4 1483 B25R3.1946081 c1ccc(cc1)C(CCNC2CCCCCC2)c3ccccc3 2230a_100000210984_100009813428 [0,0,0,0,0,2|1,0,0]=3 1484 B25R3.1946081 c1ccc(cc1)C(CCNC2CCCCCC2)c3ccccc3 270004a_100000272388_100000210131 [0,0,0,0,0,2|1,0,0]=3 1485 B25R3.1946081 c1ccc(cc1)C(CCNC2CCCCCC2)c3ccccc3 34a_100000210984_100009813428 [0,0,0,0,0,2|1,0,0]=3 1486 B25R3.1946081 c1ccc(cc1)C(CCNC2CCCCCC2)c3ccccc3 34a_100000272388_100011217769 [0,0,0,0,0,2|1,0,0]=3 1487 B25R3.1946081 c1ccc(cc1)C(CCOC2CCCCCC2)c3ccccc3 34a_100000032380_100011217769 [0,0,0,0,0,2|1,0,0]=3 1488 B25R3.1946081 c1ccc(cc1)C(CCOC2CCCCCC2)c3ccccc3 34a_100000210887_100009813428 [0,0,0,0,0,2|1,0,0]=3 1489 B25R3.1946081 c1ccc(cc1)C(CCOC2CCCCCC2)c3ccccc3 7a_100000210887_100009813428 [0,0,0,0,0,2|1,0,0]=3 1490 B25R3.1946081 c1ccc(cc1)C(CNCC2CCCCCC2)c3ccccc3 2230a_100000739227_200000696569 [0,0,0,0,0,2|1,0,0]=3 1491 B25R3.1946081 c1ccc(cc1)C(CNCC2CCCCCC2)c3ccccc3 269862a_100000739227_200000763224 [0,0,0,0,0,2|1,0,0]=3 1492 B25R3.1946081 c1ccc(cc1)C(CNCC2CCCCCC2)c3ccccc3 34a_100000739227_200000696569 [0,0,0,0,0,2|1,0,0]=3 1493 B25R3.1946081 c1ccc(cc1)C(COCC2CCCCCC2)c3ccccc3 34a_100011215272_200000696569 [0,0,0,0,0,2|1,0,0]=3 1494 B25R3.1946081 c1ccc(cc1)C(COCC2CCCCCC2)c3ccccc3 7a_100011215272_200000696569 [0,0,0,0,0,2|1,0,0]=3 1495 B25R3.1946081 c1ccc(cc1)C(NCCC2CCCCCC2)c3ccccc3 2230a_100011532351_100000211591 [0,0,0,0,0,2|1,0,0]=3 1496 B25R3.1946081 c1ccc(cc1)C(NCCC2CCCCCC2)c3ccccc3 270004a_100011532351_100000210122 [0,0,0,0,0,2|1,0,0]=3 1497 B25R3.1946081 c1ccc(cc1)C(NCCC2CCCCCC2)c3ccccn3 270004a_100011532351_100000210380 [0,0,0,0,0,2|2,0,0]=4 1498 B25R3.1946081 c1ccc(cc1)C(NCCC2CCCCCC2)c3cccnc3 270004a_100011532351_100000735413 [0,0,0,0,0,2|2,0,0]=4 1499 B25R3.1946081 c1ccc(cc1)C(SCCN2CCCCCC2)c3ccccc3 62a_100000211591_100000722644 [0,0,0,0,0,2|0,0,0]=2 1500 B25R3.1946081 c1ccc(cc1)C(SCCN2CCCCCC2)c3ccccc3 62a_100000722644_100011216954 [0,0,0,0,0,2|0,0,0]=2 1501 B25R3.1946081 c1ccc(cc1)N(CCOC2CCCCCC2)c3ccccc3 34a_100010001939_100011217769 [0,0,0,0,0,2|2,0,0]=4 1502 B25R3.1946081 c1ccc(cc1)[S+](CCNC2CCCCCC2)c3ccccc3 2230a_100000210984_100010140906 [0,0,0,0,0,2|2,0,0]=4 1503 B25R3.1946081 c1ccc(cc1)[S+](CCOC2CCCCCC2)c3ccccc3 7a_100000210887_100010140906 [0,0,0,0,0,2|2,0,0]=4 1504 B25R3.4239545 C(=C(c1ccccc1)c2ccccc2)CN3CCCCCCC3 270004a_100000211400_100000050448 [0,0,0,0,0,2|0,0,2]=4 1505 B25R3.4239545 C\1=C\CCC(CCC1)CNC(c2ccccc2)c3ccccc3 2230a_100102730862_100000211591 [0,0,0,0,0,2|2,0,0]=4 1506 B25R3.4239545 C\1=C\CCC(CCC1)CNC(c2ccccc2)c3ccccc3 270004a_100102730862_100000210122 [0,0,0,0,0,2|2,0,0]=4 1507 B25R3.4239545 C\1=C\CCC(CCC1)NCC(c2ccccc2)c3ccccc3 34a_100000739227_100021000466 [0,0,0,0,0,2|2,0,0]=4 1508 B25R3.4239545 C\1=C\CCC(CCC1)OCC(c2ccccc2)c3ccccc3 34a_100011215272_100021000466 [0,0,0,0,0,2|2,0,0]=4 1509 B25R3.4239545 C\1=C\CCC(CCC1)OCC(c2ccccc2)c3ccccc3 7a_100011215272_100021000466 [0,0,0,0,0,2|2,0,0]=4 1510 B25R3.4239545 c1ccc(cc1)C(CCN2CCCCCCC2)c3ccccc3 2230a_100000211400_100009813428 [0,0,0,0,0,2|0,0,0]=2 1511 B25R3.4239545 c1ccc(cc1)C(CCN2CCCCCCC2)c3ccccc3 269982a_100000211400_100009813428 [0,0,0,0,0,2|0,0,0]=2 1512 B25R3.4239545 c1ccc(cc1)C(CCN2CCCCCCC2)c3ccccc3 34a_100000211400_100009813428 [0,0,0,0,0,2|0,0,0]=2 1513 B25R3.4239545 c1ccc(cc1)C(CNC2CCCCCCC2)c3ccccc3 270004a_100000739227_100000210524 [0,0,0,0,0,2|2,0,0]=4