0 B15R2.32 CN1CCNC(C1=O)c2ccccc2 1P00G48M [0,0,0,0,0,0|2,0,1]=3 1 B15R2.32 CN1CCNC(C1=O)c2ccccc2 1P027TTB [0,0,0,0,0,0|2,0,1]=3 2 B14R2.21 BrC1CCOC(C1)c2cccnc2 1P01C2MH [1,0,0,0,0,0|3,0,0]=4 3 B14R2.21 CC1CCCC(N1)c2ccccc2 1P019Z2O [1,0,0,0,0,0|3,0,0]=4 4 B14R2.21 CC1CCOC(C1)c2ccccc2 1P0066PG [1,0,0,0,0,0|1,0,0]=2 5 B14R2.21 CC1CNCC(C1)c2ccccc2 1P01C26E [1,0,0,0,0,0|3,0,0]=4 6 B14R2.21 CC1NCCC(C1)c2ccccc2 1P01B8DT [1,0,0,0,0,0|3,0,0]=4 7 B14R2.21 CN1CCC=C(C1)c2ccncc2 1P0292AQ [1,0,0,0,0,0|2,0,1]=4 8 B14R2.21 CN1CCNC(C1)c2ccccc2 1P00339L [1,0,0,0,0,0|1,0,0]=2 9 B14R2.21 C[C@@H]1CNC[C@@H](C1)c2ccccc2 1P027XCS [1,0,0,0,0,0|3,0,0]=4 10 B14R2.21 C[C@@H]1CNC[C@H](C1)c2ccccc2 1P0280LC [1,0,0,0,0,0|3,0,0]=4 11 B14R2.21 NC1CCCC(C1)c2ccccc2 1P0022EN [1,0,0,0,0,0|3,0,0]=4 12 B14R2.21 NC1CCCC(C1)c2ccccc2 1P00BI75 [1,0,0,0,0,0|3,0,0]=4 13 B14R2.21 NC1CCOC(C1)c2ccccc2 1P01ACKP [1,0,0,0,0,0|2,0,0]=3 14 B14R2.21 NC1CCOC(C1)c2cccnc2 1P01ANAS [1,0,0,0,0,0|3,0,0]=4 15 B14R2.21 NC1CCOC(C1)c2ccncc2 1P01AV3P [1,0,0,0,0,0|3,0,0]=4 16 B14R2.21 N[C@@H]1CCO[C@H](C1)c2cccnc2 1P01C5AO [1,0,0,0,0,0|3,0,0]=4 17 B14R2.21 O=C1CCCC(C1)c2ccccc2 1P002JUC [1,0,0,0,0,0|3,0,0]=4 18 B14R2.21 O=C1CCC[C@@H](C1)c2ccccc2 1P00EE87 [1,0,0,0,0,0|3,0,0]=4 19 B14R2.21 O=C1CCC[C@H](C1)c2ccccc2 1P00C8RB [1,0,0,0,0,0|3,0,0]=4 20 B14R2.21 O=C1CCNC(C1)c2ccccc2 1P000MS7 [1,0,0,0,0,0|3,0,0]=4 21 B14R2.21 O=C1CCNC(C1)c2ccccc2 1P007RGW [1,0,0,0,0,0|3,0,0]=4 22 B14R2.21 O=C1CCOC(C1)c2ccccc2 1P001FJW [1,0,0,0,0,0|2,0,0]=3 23 B14R2.21 O=S1CCNC(C1)c2ccccc2 1P01AJJY [1,0,0,0,0,0|3,0,0]=4 24 B14R2.21 O=S1CCNC(C1)c2ccccc2 1P027YK9 [1,0,0,0,0,0|3,0,0]=4 25 B14R2.21 OC1CCCC(C1)c2ccccc2 1P00E42S [1,0,0,0,0,0|3,0,0]=4 26 B14R2.21 OC1CCOC(C1)c2ccccc2 1P0010QV [1,0,0,0,0,0|2,0,0]=3 27 B14R2.21 O[C@H]1CCO[C@H](C1)c2ccccc2 1P01BCPZ [1,0,0,0,0,0|2,0,0]=3 28 B14R2.24 CC1CCNCC1c2ccccc2 1P01BISY [1,0,0,0,0,0|3,0,0]=4 29 B14R2.24 CC1CNCCC1c2ccccc2 1P019S8Q [1,0,0,0,0,0|3,0,0]=4 30 B14R2.24 CC1SCCNC1c2ccccc2 1P01AJWA [1,0,0,0,0,0|2,0,0]=3 31 B14R2.24 C[C@@H]1CCNC[C@@H]1c2ccccc2 1P02805V [1,0,0,0,0,0|3,0,0]=4 32 B14R2.24 F[C@@H]1CCCN[C@@H]1c2ccccc2 1P027UL5 [1,0,0,0,0,0|3,0,0]=4 33 B14R2.24 F[C@H]1CCCN[C@H]1c2ccccc2 1P027UDM [1,0,0,0,0,0|3,0,0]=4 34 B14R2.24 NC1CCCCC1c2ccccc2 1P028K2R [1,0,0,0,0,0|3,0,0]=4 35 B14R2.24 NC1CCCOC1c2ccncc2 1P01BAMG [1,0,0,0,0,0|3,0,0]=4 36 B14R2.24 N[C@@H]1CCCC[C@H]1c2ccccc2 1P002CW1 [1,0,0,0,0,0|3,0,0]=4 37 B14R2.24 N[C@H]1CCCO[C@@H]1c2ccncc2 1P01AGV8 [1,0,0,0,0,0|3,0,0]=4 38 B14R2.24 O=C1NCCNC1c2ccccc2 1P00DC14 [1,0,0,0,0,0|2,0,1]=4 39 B14R2.24 O=C1NCCNC1c2ccccc2 1P01FKPO [1,0,0,0,0,0|2,0,1]=4 40 B14R2.24 O=C1NCCN[C@@H]1c2ccccc2 1P00HHZL [1,0,0,0,0,0|2,0,1]=4 41 B14R2.24 O=C1NCCN[C@H]1c2ccccc2 1P00HHZK [1,0,0,0,0,0|2,0,1]=4 42 B14R2.24 O=C1NCCSC1c2ccccc2 1P005XYV [1,0,0,0,0,0|1,1,1]=4 43 B14R2.24 OC1CCCCC1c2ccccc2 1P00ABUS [1,0,0,0,0,0|3,0,0]=4 44 B14R2.24 O[C@@H]1CCCC[C@H]1c2ccccc2 1P002OER [1,0,0,0,0,0|3,0,0]=4 45 B14R2.24 O[C@H]1CCCC[C@@H]1c2ccccc2 1P003BYZ [1,0,0,0,0,0|3,0,0]=4 46 B14R1.60 CC(N(CC#C)C)Cc1ccccc1 1P00BVIA [0,0,1,0,0,0|1,0,1]=3 47 B14R1.60 C[C@@H](N(CC#C)C)Cc1ccccc1 1P001E5Z [0,0,1,0,0,0|1,0,1]=3 48 B14R1.60 NCCC(N(Cc1ccccc1)C)C 1P019TTB [0,0,1,0,0,0|3,0,0]=4 49 B14R1.85 O=CN(C(C(c1ccccc1)O)C)C 1P01C0W5 [0,0,1,0,0,0|1,0,1]=3 50 B14R1.121 CCCCNC(c1ccccc1)CC 1P01AIX8 [0,0,1,0,0,0|2,0,0]=3 51 B14R1.121 CNCCCN(c1ccccc1)CC 1P027ZDQ [0,0,1,0,0,0|2,0,0]=3 52 B14R1.716 COC(=O)CCOCc1ccccc1 1P00CJ99 [0,0,1,0,0,0|3,0,0]=4 53 B14R1.716 OCC(CCOCc1ccccc1)N 1P02933N [0,0,1,0,0,0|3,0,0]=4 54 B14R1.716 OC[C@H](CCOCc1ccccc1)O 1P003D33 [0,0,1,0,0,0|3,0,0]=4 55 B16R3.1739 NC1C2CCC(C1c3ccccc3)C2 1P01DWRU [0,0,0,1,0,0|3,0,0]=4 56 B16R2.35 CN1CCNC(C1=O)Cc2ccccc2 1P01FKJ2 [0,0,0,0,0,1|2,0,1]=4 57 B13R1.42 NCCN(CCc1ccccc1)C 1P001TZY [1,0,1,0,0,0|1,0,0]=3 58 B13R1.42 OCCC(CCc1ccccc1)C 1P00DEIU [1,0,1,0,0,0|1,0,0]=3 59 B13R1.42 OCCC(NCc1ccccc1)C 1P01A4R6 [1,0,1,0,0,0|2,0,0]=4 60 B13R1.42 OCCC(OCc1ccccc1)C 1P01B283 [1,0,1,0,0,0|2,0,0]=4 61 B13R1.44 CC(Cc1ccccc1)NCC#C 1P002IEE [1,0,1,0,0,0|1,0,1]=4 62 B13R1.44 CC(Cc1ccccc1)NCC#C 1P019SIY [1,0,1,0,0,0|1,0,1]=4 63 B13R1.44 OCCCC(Cc1ccccc1)N 1P00GBUB [1,0,1,0,0,0|2,0,0]=4 64 B13R1.135 CCC(=O)C(Cc1ccccc1)C 1P01EKCK [1,0,1,0,0,0|2,0,0]=4 65 B13R1.47 CCCC(C(c1ccccc1)O)N 1P01BGVD [1,0,1,0,0,0|2,0,0]=4 66 B13R1.47 CCNC(C(c1ccccc1)O)C 1P01ALKS [1,0,1,0,0,0|0,0,0]=2 67 B13R1.152 OC(C(=O)N(C)C)c1ccccc1 1P01FPBL [1,0,1,0,0,0|1,0,1]=4 68 B13R1.152 OC(c1ccccc1)C(C(C)C)N 1P01BGHU [1,0,1,0,0,0|2,0,0]=4 69 B13R1.152 O[C@@H](C(=O)N(C)C)c1ccccc1 1P01K0VK [1,0,1,0,0,0|1,0,1]=4 70 B13R1.152 O[C@H](c1ccccc1)[C@H](C(C)C)N 1P002ISC [1,0,1,0,0,0|2,0,0]=4 71 B13R1.24 CC(c1ccccc1)OCCC#N 1P019UTF [1,0,1,0,0,0|2,0,0]=4 72 B13R1.24 CCCCNC(c1ccccc1)C 1P01AKDM [1,0,1,0,0,0|2,0,0]=4 73 B13R1.24 COCCNC(c1ccccc1)C 1P019M8I [1,0,1,0,0,0|2,0,0]=4 74 B13R1.24 NCCCOC(c1ccccc1)C 1P019P22 [1,0,1,0,0,0|2,0,0]=4 75 B13R1.26 CCC(c1ccccc1)NCCC 1P019M6J [1,0,1,0,0,0|1,0,0]=3 76 B13R1.26 CCC(c1ccccc1)NCCO 1P01AZ06 [1,0,1,0,0,0|2,0,0]=4 77 B13R1.26 CCC(c1ccccc1)OCCBr 1P01C5X9 [1,0,1,0,0,0|1,0,0]=3 78 B13R1.26 CCC(c1ccccc1)OCCO 1P01C5SM [1,0,1,0,0,0|1,0,0]=3 79 B13R1.26 CCNCC(c1ccccc1)CC 1P01AFOR [1,0,1,0,0,0|2,0,0]=4 80 B13R1.26 NCCCN(c1ccccc1)CC 1P00E3XX [1,0,1,0,0,0|2,0,0]=4 81 B13R1.398 CCOC(c1ccccc1)OCC 1P003OH3 [1,0,1,0,0,0|2,0,0]=4 82 B13R1.405 CCNC(c1cccnc1)C(C)C 1P01AB03 [1,0,1,0,0,0|2,0,0]=4 83 B13R1.28 BrCCCCOCc1ccccc1 1P0037K9 [1,0,1,0,0,0|2,0,0]=4 84 B13R1.28 CCCCCCCc1ccccc1 1P009PY5 [1,0,1,0,0,0|2,0,0]=4 85 B13R1.28 CCCCNOCc1ccccc1 1P01NWKF [1,0,1,0,0,0|2,0,0]=4 86 B13R1.28 CCOCCSCc1ccccc1 1P01FFSQ [1,0,1,0,0,0|1,1,0]=4 87 B13R1.28 CNCCCOCc1ccccc1 1P00AVUR [1,0,1,0,0,0|2,0,0]=4 88 B13R1.28 ICCCCOCc1ccccc1 1P00DGVE [1,0,1,0,0,0|2,0,0]=4 89 B13R1.28 NCCCCOCc1ccccc1 1P01A8NN [1,0,1,0,0,0|2,0,0]=4 90 B13R1.28 NCCCCOCc1ccccc1 1P028AS7 [1,0,1,0,0,0|2,0,0]=4 91 B13R1.28 OCCCCOCc1ccccc1 1P003L9Q [1,0,1,0,0,0|2,0,0]=4 92 B13R1.337 CC(=O)CCOCc1ccccc1 1P003L9S [1,0,1,0,0,0|2,0,0]=4 93 B13R1.337 CC(CCNCc1ccccc1)C 1P00E08O [1,0,1,0,0,0|2,0,0]=4 94 B13R1.337 CC(CCNCc1ccccc1)C 1P01S7X8 [1,0,1,0,0,0|2,0,0]=4 95 B13R1.337 CC(CCOCc1ccccc1)N 1P01BBSD [1,0,1,0,0,0|2,0,0]=4 96 B13R1.337 CC(CCOCc1ccccc1)O 1P00DOW1 [1,0,1,0,0,0|2,0,0]=4 97 B13R1.337 CN(CCNCc1ccccc1)C 1P003T8R [1,0,1,0,0,0|1,0,0]=3 98 B13R1.337 CN(CCNCc1ccccn1)C 1P001508 [1,0,1,0,0,0|2,0,0]=4 99 B13R1.337 CN(CCNCc1cccnc1)C 1P009BRU [1,0,1,0,0,0|2,0,0]=4 100 B13R1.337 CN(CCNCc1ccncc1)C 1P01ABX1 [1,0,1,0,0,0|2,0,0]=4 101 B13R1.337 C[C@@H](CCOCc1ccccc1)N 1P0293R4 [1,0,1,0,0,0|2,0,0]=4 102 B13R1.337 C[C@@H](CCOCc1ccccc1)O 1P008PC2 [1,0,1,0,0,0|2,0,0]=4 103 B13R1.713 CNC(c1ccccc1)CN(C)C 1P00G9QH [1,0,1,0,0,0|1,0,0]=3 104 B13R1.713 NCC(c1ccccc1)CN(C)C 1P01BEAZ [1,0,1,0,0,0|2,0,0]=4 105 B13R1.713 NCC(c1ccccc1)CN(C)C 1P028IK4 [1,0,1,0,0,0|2,0,0]=4 106 B13R2.3 C1CCC(CC1)c2ccccc2 1P00354D [2,0,0,0,0,0|2,0,0]=4 107 B13R2.3 C1CCC(CN1)c2ccccc2 1P0077WQ [2,0,0,0,0,0|1,0,0]=3 108 B13R2.3 C1CCC(CN1)c2ccccc2 1P00APMM [2,0,0,0,0,0|1,0,0]=3 109 B13R2.3 C1CCC(CN1)c2ccccn2 1P0074KB [2,0,0,0,0,0|2,0,0]=4 110 B13R2.3 C1CCC(CN1)c2ccccn2 1P01AM5C [2,0,0,0,0,0|2,0,0]=4 111 B13R2.3 C1CCC(CN1)c2cccnc2 1P002FDR [2,0,0,0,0,0|2,0,0]=4 112 B13R2.3 C1CCC(CN1)c2cccnc2 1P00BXDH [2,0,0,0,0,0|2,0,0]=4 113 B13R2.3 C1CCC(CN1)c2ccncc2 1P01C4NY [2,0,0,0,0,0|2,0,0]=4 114 B13R2.3 C1CCC(NC1)c2ccccc2 1P003ICF [2,0,0,0,0,0|2,0,0]=4 115 B13R2.3 C1CCC(NC1)c2ccccc2 1P01ACBD [2,0,0,0,0,0|2,0,0]=4 116 B13R2.3 C1CC[C@@H](CN1)c2ccccc2 1P00D9LO [2,0,0,0,0,0|1,0,0]=3 117 B13R2.3 C1CC[C@@H](CN1)c2ccccc2 1P00DK7G [2,0,0,0,0,0|1,0,0]=3 118 B13R2.3 C1CC[C@@H](NC1)c2ccccc2 1P00EDF4 [2,0,0,0,0,0|2,0,0]=4 119 B13R2.3 C1CC[C@@H](NC1)c2ccccc2 1P020M4G [2,0,0,0,0,0|2,0,0]=4 120 B13R2.3 C1CC[C@H](CN1)c2ccccc2 1P00EB70 [2,0,0,0,0,0|1,0,0]=3 121 B13R2.3 C1CC[C@H](NC1)c2ccccc2 1P001O2Q [2,0,0,0,0,0|2,0,0]=4 122 B13R2.3 C1CC[C@H](NC1)c2ccccc2 1P00FCUH [2,0,0,0,0,0|2,0,0]=4 123 B13R2.3 C1CNC(CN1)c2cccnc2 1P00827Z [2,0,0,0,0,0|2,0,0]=4 124 B13R2.3 C1CNC(CN1)c2cccnc2 1P009A0Q [2,0,0,0,0,0|2,0,0]=4 125 B13R2.3 C1CNC(CN1)c2cccnc2 1P028XTI [2,0,0,0,0,0|2,0,0]=4 126 B13R2.3 C1COC(CN1)c2ccccn2 1P000692 [2,0,0,0,0,0|1,0,0]=3 127 B13R2.3 C1COC(CN1)c2ccccn2 1P021VH2 [2,0,0,0,0,0|1,0,0]=3 128 B13R2.3 C1COC(CN1)c2cccnc2 1P021VH1 [2,0,0,0,0,0|1,0,0]=3 129 B13R2.3 N1CCC=C(C1)c2ccccc2 1P01BA7X [2,0,0,0,0,0|1,0,1]=4 130 B13R2.3 N1CCNC(C1)c2ccccc2 1P003ICE [2,0,0,0,0,0|1,0,0]=3 131 B13R2.3 N1CCNC(C1)c2ccccc2 1P00GSPM [2,0,0,0,0,0|1,0,0]=3 132 B13R2.3 N1CCNC(C1)c2ccncc2 1P00HCNE [2,0,0,0,0,0|2,0,0]=4 133 B13R2.3 N1CCOC(C1)c2ccccc2 1P00C2J0 [2,0,0,0,0,0|0,0,0]=2 134 B13R2.3 N1CCOC(C1)c2ccncc2 1P000691 [2,0,0,0,0,0|1,0,0]=3 135 B13R2.3 N1CCOC(C1)c2ccncc2 1P01KZIV [2,0,0,0,0,0|1,0,0]=3 136 B13R2.3 N1CCO[C@@H](C1)c2ccccc2 1P0017W2 [2,0,0,0,0,0|0,0,0]=2 137 B13R2.3 N1CCO[C@@H](C1)c2ccccc2 1P00BDGD [2,0,0,0,0,0|0,0,0]=2 138 B13R2.3 N1CCO[C@H](C1)c2ccccc2 1P005WLK [2,0,0,0,0,0|0,0,0]=2 139 B13R2.3 N1CCSC(C1)c2ccccc2 1P005R8C [2,0,0,0,0,0|0,1,0]=3 140 B13R2.3 N1CCSC(C1)c2ccccc2 1P00GH1C [2,0,0,0,0,0|0,1,0]=3 141 B13R2.3 O1CCC(OC1)c2ccccc2 1P003MFR [2,0,0,0,0,0|2,0,0]=4 142 B13R2.3 O1CCNC(C1)c2ccccc2 1P0019JE [2,0,0,0,0,0|2,0,0]=4 143 B13R2.3 O1CCNC(C1)c2ccccc2 1P0096NQ [2,0,0,0,0,0|2,0,0]=4 144 B13R2.3 O1CCN[C@@H](C1)c2ccccc2 1P001TLN [2,0,0,0,0,0|2,0,0]=4 145 B13R2.3 O1CCN[C@@H](C1)c2ccccc2 1P005JTV [2,0,0,0,0,0|2,0,0]=4 146 B13R2.3 O1CCN[C@H](C1)c2ccccc2 1P006BFW [2,0,0,0,0,0|2,0,0]=4 147 B13R2.3 O1CCN[C@H](C1)c2ccccc2 1P00ABFC [2,0,0,0,0,0|2,0,0]=4 148 B13R2.3 S1CCNC(C1)c2ccccc2 1P009BJG [2,0,0,0,0,0|2,0,0]=4 149 B13R2.3 S1CCNC(C1)c2ccccc2 1P028IZA [2,0,0,0,0,0|2,0,0]=4 150 B15R1.48 CC(N(CC#C)C)Cc1ccc(cc1)F 1P01XCWR [0,1,1,0,0,0|1,0,1]=4 151 B15R1.646 CCN(C(=O)C(c1ccccc1)O)CC 1P00C3YF [0,1,1,0,0,0|1,0,1]=4 152 B15R1.646 CCN([C@@H]([C@H](c1ccccc1)O)C)CC 1P01C466 [0,1,1,0,0,0|0,0,0]=2 153 B15R1.101 CCCCCC(c1ccc(cc1)O)CC 1P003AUR [0,1,1,0,0,0|2,0,0]=4 154 B15R1.3402 CCCCCC(c1ccccc1O)CC 1P001ZV8 [0,1,1,0,0,0|2,0,0]=4 155 B15R1.452 CCN(CCNCc1ccccc1)CC 1P00B5PS [0,1,1,0,0,0|1,0,0]=3 156 B15R1.452 OCC(CCOCc1ccccc1)CO 1P005SZ9 [0,1,1,0,0,0|2,0,0]=4 157 B15R1.778 CCOC(=O)CCOCc1ccccc1 1P00HS3T [0,1,1,0,0,0|2,0,0]=4 158 B15R2.27 CC1CC(N)CC(C1)c2ccccc2 1P019ZBT [1,1,0,0,0,0|2,0,0]=4 159 B15R2.27 CC1CC(N)CC(C1)c2ccccc2 1P01BCOI [1,1,0,0,0,0|2,0,0]=4 160 B15R2.28 CN1CCO[C@@H](C1)c2ccc(cc2)Br 1P01FJ3X [1,1,0,0,0,0|0,0,0]=2 161 B15R2.28 CN1CCO[C@H](C1)c2ccc(cc2)Br 1P01ELOY [1,1,0,0,0,0|0,0,0]=2 162 B15R2.28 NC1CCOC(C1)c2ccc(cc2)F 1P01A7EF [1,1,0,0,0,0|2,0,0]=4 163 B15R2.28 OC1CCOC(C1)c2ccc(cc2)C 1P01A3BW [1,1,0,0,0,0|2,0,0]=4 164 B15R2.30 NC1CCOC(C1)c2cccc(c2)F 1P028KDQ [1,1,0,0,0,0|2,0,0]=4 165 B15R2.30 N[C@@H]1CCO[C@H](C1)c2cccc(c2)Cl 1P028XOH [1,1,0,0,0,0|2,0,0]=4 166 B15R2.30 O=C1CCOC(C1)c2cccc(c2)F 1P028WX5 [1,1,0,0,0,0|2,0,0]=4 167 B15R2.30 O[C@@H]1CCO[C@@H](C1)c2cccc(c2)F 1P028END [1,1,0,0,0,0|2,0,0]=4 168 B15R2.94 CN1CC(NCC1=O)c2ccccc2 1P01ALLN [1,1,0,0,0,0|1,0,1]=4 169 B15R2.94 CN1CC(NCC1=O)c2ccccc2 1P027WEP [1,1,0,0,0,0|1,0,1]=4 170 B15R2.1113 CN1CCNC(C1)(C)c2ccccc2 1P0292P4 [1,1,0,0,0,0|1,0,0]=3 171 B15R2.1113 N[C@H]1CCO[C@@](C1)(C)c2ccccc2 1P027UJX [1,1,0,0,0,0|2,0,0]=4 172 B15R2.1113 O=C1CCOC(C1)(C)c2ccccc2 1P027UUM [1,1,0,0,0,0|2,0,0]=4 173 B15R2.1113 OC1CCOC(C1)(C)c2ccccc2 1P0292YK [1,1,0,0,0,0|2,0,0]=4 174 B15R2.21 CCC1NCCOC1c2ccccc2 1P00I3ZD [1,1,0,0,0,0|0,0,0]=2 175 B15R2.21 CNC1CCCCC1c2ccccc2 1P01C375 [1,1,0,0,0,0|2,0,0]=4 176 B15R2.21 NCC1CCCCC1c2ccccc2 1P01C25I [1,1,0,0,0,0|2,0,0]=4 177 B15R2.21 NCC1CCCOC1c2ccccc2 1P019WJM [1,1,0,0,0,0|1,0,0]=3 178 B15R2.21 NC[C@@H]1OCCO[C@@H]1c2ccccc2 1P028DNC [1,1,0,0,0,0|1,0,0]=3 179 B15R2.21 OC[C@@H]1CCCC[C@@H]1c2ccccc2 1P01C473 [1,1,0,0,0,0|2,0,0]=4 180 B15R2.308 CC1CCCNC1c2ccc(cc2)C 1P01AKGZ [1,1,0,0,0,0|2,0,0]=4 181 B15R2.308 CC1NCCOC1c2ccc(cc2)C 1P019F9N [1,1,0,0,0,0|0,0,0]=2 182 B15R2.308 C[C@@H]1CCCN[C@@H]1c2ccc(cc2)C 1P028H85 [1,1,0,0,0,0|2,0,0]=4 183 B15R2.308 N[C@@H]1CCCO[C@H]1c2ccc(cc2)Cl 1P01BSOX [1,1,0,0,0,0|2,0,0]=4 184 B15R2.367 CC1NCCOC1(O)c2ccccc2 1P0282PH [1,1,0,0,0,0|0,0,0]=2 185 B15R2.389 CC1NC(C)COC1c2ccccc2 1P01AHUT [1,1,0,0,0,0|0,0,0]=2 186 B15R2.389 C[C@@H]1NC(=O)CO[C@H]1c2ccccc2 1P01BBQ0 [1,1,0,0,0,0|0,0,1]=3 187 B15R2.465 CC1(C)OCCNC1c2ccccc2 1P028IHG [1,1,0,0,0,0|2,0,0]=4 188 B15R2.465 CC1(O)CCCCC1c2ccccc2 1P01BHOB [1,1,0,0,0,0|2,0,0]=4 189 B17R2.63787 CCN1CCOC(C1C)(O)c2ccccc2 1P003LSC [0,2,0,0,0,0|0,0,0]=2 190 B15R2.38 CN1CCNCC1Cc2ccccc2 1P01BA6V [0,0,1,1,0,0|1,0,0]=3 191 B15R2.1356 NCCN(C1Cc2c(C1)cccc2)C 1P028D34 [0,0,1,1,0,0|1,0,0]=3 192 B15R2.1 CNC1CCC(CC1)c2ccccc2 1P019VFT [0,0,1,1,0,0|1,0,0]=3 193 B15R2.1 CNC1CCN(CC1)c2ccccc2 1P01A57L [0,0,1,1,0,0|2,0,0]=4 194 B15R2.1 CNC1CCN(CC1)c2ccccc2 1P01BHQK [0,0,1,1,0,0|2,0,0]=4 195 B15R2.1 CN[C@@H]1CC[C@H](CC1)c2ccccc2 1P01BBVE [0,0,1,1,0,0|1,0,0]=3 196 B15R2.66 CNCC1CCN(C1)c2ccccc2 1P00J1II [0,0,1,1,0,0|2,0,0]=4 197 B15R2.548 CC1NCC(OCC1)c2ccccc2 1P01EJMW [0,0,1,1,0,0|2,0,0]=4 198 B15R2.2169 C1CCCC(NCC1)c2ccccc2 1P01FKLH [0,0,1,1,0,0|2,0,0]=4 199 B15R2.4980 CCC1(OCCNC1)c2ccccc2 1P0290TY [0,0,1,1,0,0|0,0,0]=2 200 B15R2.4980 ICC1(OCCOC1)c2ccccc2 1P01FIN2 [0,0,1,1,0,0|2,0,0]=4 201 B15R2.4980 NCC1(CCCCO1)c2ccccc2 1P01FKAK [0,0,1,1,0,0|2,0,0]=4 202 B15R2.4980 NCC1(OCCOC1)c2ccccc2 1P01FK6A [0,0,1,1,0,0|2,0,0]=4 203 B15R2.4980 OCC1(CCCNC1)c2ccccc2 1P01BEOT [0,0,1,1,0,0|2,0,0]=4 204 B15R2.4980 OCC1(CCCNC1)c2ccccc2 1P01C0ZF [0,0,1,1,0,0|2,0,0]=4 205 B15R2.79765 CNC(C1OCCc2c1cccc2)C 1P0292NG [0,0,1,1,0,0|0,0,0]=2 206 B15R2.29 CN1CCC(CC1)Nc2ccccc2 1P003SO3 [0,0,1,1,0,0|2,0,0]=4 207 B15R2.29 CN1CCN(CC1)Cc2ccccc2 1P003EGS [0,0,1,1,0,0|1,0,0]=3 208 B15R2.29 NN1CCN(CC1)Cc2ccccc2 1P00CAC9 [0,0,1,1,0,0|2,0,0]=4 209 B15R2.122 OC[C@@H]1C[C@H]1COCc2ccccc2 1P00AA4J [0,0,1,1,0,0|2,0,0]=4 210 B15R2.283 O=C1CCC(C1)OCc2ccccc2 1P01DZ6Z [0,0,1,1,0,0|2,0,0]=4 211 B15R2.283 OC1CCC(C1)OCc2ccccc2 1P00IGOM [0,0,1,1,0,0|2,0,0]=4 212 B15R2.283 O[C@@H]1CC[C@H](C1)OCc2ccccc2 1P01JPS2 [0,0,1,1,0,0|2,0,0]=4 213 B15R2.283 O[C@H]1CC[C@H](C1)OCc2ccccc2 1P00ILQP [0,0,1,1,0,0|2,0,0]=4 214 B15R2.342 O=C1CCC1COCc2ccccc2 1P00I5X2 [0,0,1,1,0,0|2,0,0]=4 215 B15R2.342 OC1CCC1COCc2ccccc2 1P01JURJ [0,0,1,1,0,0|2,0,0]=4 216 B15R2.1995 BrCC1CC(C1)OCc2ccccc2 1P001850 [0,0,1,1,0,0|2,0,0]=4 217 B15R2.1995 ICC1CC(C1)OCc2ccccc2 1P028MMJ [0,0,1,1,0,0|2,0,0]=4 218 B15R2.1995 NCC1CC(C1)OCc2ccccc2 1P00HXB7 [0,0,1,1,0,0|2,0,0]=4 219 B15R2.1995 OCC1CC(C1)OCc2ccccc2 1P01KX48 [0,0,1,1,0,0|2,0,0]=4 220 B15R2.1995 OC[C@@H]1C[C@@H](C1)OCc2ccccc2 1P00J3QS [0,0,1,1,0,0|2,0,0]=4 221 B15R2.7945 NC1(CCOCc2ccccc2)CC1 1P019THL [0,0,1,1,0,0|2,0,0]=4 222 B15R3.1728 c1ccc(cc1)[C@H]2NC[C@@H]3[C@H]2CC3 1P028HKQ [0,0,0,1,1,0|2,0,0]=4 223 B13R1.718 BrCC(COCc1ccccc1)C 1P00H2K4 [0,0,1,0,1,0|2,0,0]=4 224 B13R1.718 CCC(=O)COCc1ccccc1 1P01EV3V [0,0,1,0,1,0|2,0,0]=4 225 B13R1.718 NCC(COCc1ccccc1)C 1P019XFL [0,0,1,0,1,0|2,0,0]=4 226 B13R1.718 NCC(COCc1ccccc1)C 1P01A7YT [0,0,1,0,1,0|2,0,0]=4 227 B13R1.718 OCC(COCc1ccccc1)C 1P00H6F1 [0,0,1,0,1,0|2,0,0]=4 228 B13R2.10 CC1CNC(C1)c2ccccc2 1P01BAOI [1,0,0,0,1,0|2,0,0]=4 229 B13R2.10 CC1COC(O1)c2ccccc2 1P00I5D9 [1,0,0,0,1,0|2,0,0]=4 230 B13R2.10 CC1NCC(C1)c2ccccc2 1P005YSV [1,0,0,0,1,0|2,0,0]=4 231 B13R2.10 C[C@H]1CCC(N1)c2ccccc2 1P00IL8R [1,0,0,0,1,0|2,0,0]=4 232 B13R2.10 NC1COC(C1)c2ccccc2 1P028IWX [1,0,0,0,1,0|2,0,0]=4 233 B13R2.10 N[C@@H]1CC[C@@H](C1)c2ccccc2 1P01C2M4 [1,0,0,0,1,0|2,0,0]=4 234 B13R2.10 O=C1CCC(C1)c2ccccc2 1P003A7Y [1,0,0,0,1,0|2,0,0]=4 235 B13R2.10 O=C1COC(C1)c2ccccc2 1P027Y9B [1,0,0,0,1,0|2,0,0]=4 236 B13R2.10 OC1CCC(C1)c2ccccc2 1P006WTX [1,0,0,0,1,0|2,0,0]=4 237 B13R2.10 OC1COC(C1)c2ccccc2 1P01A012 [1,0,0,0,1,0|2,0,0]=4 238 B13R2.13 CN1CCNC(C1)c2cccs2 1P008H12 [1,0,0,0,1,0|2,0,0]=4 239 B13R2.15 CC1CCNC1c2ccccc2 1P00DKMF [1,0,0,0,1,0|2,0,0]=4 240 B13R2.15 CN1CCCC1c2cccnc2 1P00BCUZ [1,0,0,0,1,0|2,0,0]=4 241 B13R2.15 CN1CCC[C@@H]1c2cccnc2 1P002R6P [1,0,0,0,1,0|2,0,0]=4 242 B13R2.15 CN1CCC[C@H]1c2cccnc2 1P002SVQ [1,0,0,0,1,0|2,0,0]=4 243 B13R2.15 CN1CCC[C@H]1c2cccnc2 1P00EBYG [1,0,0,0,1,0|2,0,0]=4 244 B13R2.15 CN1CCC[C@H]1c2cccnc2 1P018QAW [1,0,0,0,1,0|2,0,0]=4 245 B13R2.15 N[C@@H]1CCO[C@H]1c2ccccc2 1P01BZ2R [1,0,0,0,1,0|2,0,0]=4 246 B13R2.373 CC1C(=O)CC1c2ccccc2 1P01A1L5 [0,0,0,0,2,0|2,0,0]=4 247 B13R2.373 CC1C(N)CC1c2ccccc2 1P01A0WZ [0,0,0,0,2,0|2,0,0]=4 248 B15R1.826 OCCN(C(=O)OCc1ccccc1)C 1P00601L [0,0,1,0,0,1|1,0,1]=4 249 B15R2.31 CC1CCCC(C1)Nc2ccccc2 1P01AY2I [1,0,0,0,0,1|2,0,0]=4 250 B15R2.31 CN1CCNC(C1)Cc2ccccc2 1P0013ZW [1,0,0,0,0,1|1,0,0]=3 251 B15R2.31 CN1CCN[C@@H](C1)Cc2ccccc2 1P01DMU9 [1,0,0,0,0,1|1,0,0]=3 252 B15R2.31 CN1CCN[C@H](C1)Cc2ccccc2 1P00H3M7 [1,0,0,0,0,1|1,0,0]=3 253 B15R2.543 CN1CCCNC(C1)c2ccccc2 1P01B9PA [1,0,0,0,0,1|1,0,0]=3