0 B12R1.32 CCOC(=O)Cc1ccccn1 AB00728 [1,0,0,0,0,0|2,0,0]=3 1 B12R1.32 CCOC(=O)Cc1cnccn1 AB62539 [1,0,0,0,0,0|3,0,0]=4 2 B12R1.32 CCOC(=O)Cc1ncccn1 PB14776 [1,0,0,0,0,0|3,0,0]=4 3 B12R1.32 CN(CCN)Cc1ccccc1 MB02567 [1,0,0,0,0,0|3,0,0]=4 4 B14R1.433 CC(C)(C)OC(=O)Nc1ccccc1 AB01955 [0,1,0,0,0,0|2,0,0]=3 5 B14R1.433 CC(C)(C)OC(=O)Nc1ccccn1 AB14184 [0,1,0,0,0,0|3,0,0]=4 6 B14R1.433 CC(C)(C)OC(=O)Nc1cccnc1 AB11052 [0,1,0,0,0,0|3,0,0]=4 7 B14R1.433 CC(C)(C)OC(=O)Nc1ccncc1 AB11054 [0,1,0,0,0,0|3,0,0]=4 8 B14R1.433 c1ccc(cc1)CC(=O)CC(F)(F)F AB70560 [0,1,0,0,0,0|2,0,0]=3 9 B14R1.549 CN(C)\C=C(/Cc1ccccc1)\C=O CB12063 [0,1,0,0,0,0|1,0,1]=3 10 B14R2.19 c1ccc(cc1)CN2CCC(C2)Br MB09781 [0,0,0,1,0,0|3,0,0]=4 11 B14R2.19 c1ccc(cc1)CN2CCC(C2)O AB01084 [0,0,0,1,0,0|3,0,0]=4 12 B14R2.19 c1ccc(cc1)CN2CC[C@@H](C2)N AB03132 [0,0,0,1,0,0|3,0,0]=4 13 B14R2.19 c1ccc(cc1)CN2CC[C@@H](C2)O AB02885 [0,0,0,1,0,0|3,0,0]=4 14 B14R2.19 c1ccc(cc1)CN2CC[C@H](C2)N AB03115 [0,0,0,1,0,0|3,0,0]=4 15 B14R2.19 c1ccc(cc1)CN2CC[C@H](C2)O AB02881 [0,0,0,1,0,0|3,0,0]=4 16 B12R1.43 C[C@@H](C(=O)Nc1ccccc1)O AB72181 [0,0,0,0,1,0|2,0,0]=3 17 B11R1.28 CNCCCc1ccccc1 AB10671 [2,0,0,0,0,0|1,0,1]=4 18 B11R1.28 c1ccc(cc1)CCCCN AB00942 [2,0,0,0,0,0|1,0,1]=4 19 B11R1.28 c1ccc(cc1)CCCCN AB13248 [2,0,0,0,0,0|1,0,1]=4 20 B11R1.28 c1ccc(cc1)COCCN AB05315 [2,0,0,0,0,0|2,0,0]=4 21 B11R1.40 COC(=N)Cc1ccccc1 AB01554 [2,0,0,0,0,0|2,0,0]=4 22 B11R1.40 COC(=O)Cc1ccccn1 PB18397 [2,0,0,0,0,0|2,0,0]=4 23 B11R1.40 COC(=O)Cc1cccnc1 PB30559 [2,0,0,0,0,0|2,0,0]=4 24 B11R1.40 COC(=O)Cc1ccncc1 PB12720 [2,0,0,0,0,0|2,0,0]=4 25 B11R1.40 c1ccc(cc1)CC(=O)C=O AB50241 [2,0,0,0,0,0|1,0,1]=4 26 B13R1.19 CCOC(=O)Cc1ccc(cn1)Br PB32861 [1,1,0,0,0,0|2,0,0]=4 27 B13R1.19 CCOC(=O)Cc1ccc(cn1)C AB62474 [1,1,0,0,0,0|2,0,0]=4 28 B13R1.19 CCOC(=O)Cc1ccc(cn1)Cl AB62485 [1,1,0,0,0,0|2,0,0]=4 29 B13R1.19 CCOC(=O)Cc1ccc(cn1)I PB37907 [1,1,0,0,0,0|2,0,0]=4 30 B13R1.19 CCOC(=O)Cc1ccc(cn1)N PB35666 [1,1,0,0,0,0|2,0,0]=4 31 B13R1.19 CCOC(=O)Cc1ccc(cn1)O PB13946 [1,1,0,0,0,0|2,0,0]=4 32 B13R1.20 CCOC(=O)Cc1cc(ccn1)Br AB56161 [1,1,0,0,0,0|2,0,0]=4 33 B13R1.20 CCOC(=O)Cc1cc(ccn1)Cl AB62486 [1,1,0,0,0,0|2,0,0]=4 34 B13R1.20 CCOC(=O)Cc1cc(ccn1)F AB73183 [1,1,0,0,0,0|2,0,0]=4 35 B13R1.20 CCOC(=O)Cc1cc(cnc1)F PB16652 [1,1,0,0,0,0|2,0,0]=4 36 B13R1.20 CCOC(=O)Cc1cccc(n1)Br AB56168 [1,1,0,0,0,0|2,0,0]=4 37 B13R1.20 CCOC(=O)Cc1cccc(n1)C AB62471 [1,1,0,0,0,0|2,0,0]=4 38 B13R1.20 CCOC(=O)Cc1cccc(n1)N AB51555 [1,1,0,0,0,0|2,0,0]=4 39 B13R1.20 CCOC(=O)Cc1ccnc(c1)F AB72863 [1,1,0,0,0,0|2,0,0]=4 40 B13R1.47 CCOC(=O)C(c1ccccn1)N PB12827 [1,1,0,0,0,0|2,0,0]=4 41 B13R1.470 CCOC(=O)Cc1c(cccn1)C AB62477 [1,1,0,0,0,0|2,0,0]=4 42 B13R1.470 CCOC(=O)Cc1c(cccn1)N AB64428 [1,1,0,0,0,0|2,0,0]=4 43 B13R1.470 CCOC(=O)Cc1ccccc1Cl AB50422 [1,1,0,0,0,0|1,0,0]=3 44 B13R1.470 CCOC(=O)Cc1ccccc1N AB06648 [1,1,0,0,0,0|1,0,0]=3 45 B13R1.470 CCOC(=O)Cc1ccccc1N AB26285 [1,1,0,0,0,0|1,0,0]=3 46 B13R1.470 CCOC(=O)Cc1cccnc1Cl PB27136 [1,1,0,0,0,0|2,0,0]=4 47 B13R1.470 CCOC(=O)Cc1ccncc1N AB64424 [1,1,0,0,0,0|2,0,0]=4 48 B13R1.45 CN(C)CCC(c1ccccc1)O AB03278 [1,1,0,0,0,0|1,0,1]=4 49 B13R1.3523 CC(C)(COCc1ccccc1)O AB84932 [1,1,0,0,0,0|1,0,0]=3 50 B13R1.3523 C[Si](C)(C)CNCc1ccccc1 AB01086 [1,1,0,0,0,0|1,1,0]=4 51 B13R1.353 CC(C)(C)C(=O)Nc1ccccn1 AB06089 [0,1,0,0,1,0|2,0,0]=4 52 B13R1.353 CC(C)(C)C(=O)Nc1cccnc1 AB07935 [0,1,0,0,1,0|2,0,0]=4 53 B13R1.353 CC(C)(C)C(=O)Nc1ccncc1 AB07936 [0,1,0,0,1,0|2,0,0]=4 54 B15R1.741 CC(C#C)NC(=O)OCc1ccccc1 AB85627 [0,1,0,0,0,1|1,0,1]=4 55 B15R1.741 C[C@@H](C#C)NC(=O)OCc1ccccc1 AB85632 [0,1,0,0,0,1|1,0,1]=4 56 B15R1.741 C[C@H](C#C)NC(=O)OCc1ccccc1 AB85629 [0,1,0,0,0,1|1,0,1]=4 57 B15R1.3465 CC(C)(C)OC(=O)NCc1ccccn1 AB32204 [0,1,0,0,0,1|2,0,0]=4 58 B15R1.3465 CC(C)(C)OC(=O)NCc1cccnc1 AB25205 [0,1,0,0,0,1|2,0,0]=4 59 B15R1.31838 CC(C)(C)OC(=O)NC1=CC=CNC=C1 PB35475 [0,1,0,0,0,1|2,0,0]=4 60 B15R1.3977 CC(C)(C)NC(=O)C(c1ccccc1)N AB07805 [0,2,0,0,0,0|1,0,0]=3 61 B15R1.913 CC(C)(C)OC(=O)Nc1ccc(cc1)N CB10155 [0,2,0,0,0,0|2,0,0]=4 62 B15R1.8303 CC(C)(C)OC(=O)Nc1cccc(c1)Cl AB30559 [0,2,0,0,0,0|2,0,0]=4 63 B15R1.8303 CC(C)(C)OC(=O)Nc1cccc(c1)I MB06550 [0,2,0,0,0,0|2,0,0]=4 64 B13R2.64 c1ccc(cc1)CC2CCCN2 AB09388 [1,0,0,1,0,0|1,0,1]=4 65 B13R2.135 c1ccc2c(c1)C(C(=O)N2)CN AB28484 [1,0,0,1,0,0|2,0,0]=4 66 B13R2.163 c1ccc2c(c1)CCNC(=O)C2 MB01179 [1,0,0,1,0,0|1,0,0]=3 67 B13R2.163 c1ccc2c(c1)CCNC(=O)N2 AB65832 [1,0,0,1,0,0|2,0,0]=4 68 B13R2.328 CC1CC(=O)Nc2c1cccc2 MB08925 [1,0,0,1,0,0|1,0,0]=3 69 B13R2.328 CN1CC(=O)Nc2c1cccc2 MB12301 [1,0,0,1,0,0|2,0,0]=4 70 B13R2.3122 CC1(CCNc2c1cccc2)C MB10115 [1,0,0,1,0,0|1,0,1]=4 71 B13R2.3122 CC1(CNCc2c1cccc2)C MB05480 [1,0,0,1,0,0|1,0,0]=3 72 B13R2.3122 CC1(c2ccccc2CCN1)C AB62583 [1,0,0,1,0,0|1,0,1]=4 73 B13R2.359 CC1(c2ccccc2NC1=O)C MB00789 [0,0,0,1,1,0|1,0,0]=3 74 B13R2.369 CC1C(=O)Nc2ccccc2N1 PB10143 [0,0,0,1,1,0|2,0,0]=4 75 B13R2.369 CC1Cc2ccccc2NC1=O MB08929 [0,0,0,1,1,0|1,0,0]=3 76 B13R2.12159 CC1(c2ccccc2C(=O)N1)C PB38777 [0,0,0,1,1,0|1,0,0]=3 77 B13R2.12159 CC1(c2ccccc2C(=O)O1)C AB04969 [0,0,0,1,1,0|1,0,0]=3 78 B15R2.325 c1ccc(cc1)CN2CC(CC2=O)N MB08337 [0,0,0,1,0,1|1,0,0]=3 79 B15R2.31 C[C@@H]1CN(CCN1)Cc2ccccc2 AB14251 [0,1,0,1,0,0|2,0,0]=4 80 B15R2.15 CN[C@H]1CCN(C1)Cc2ccccc2 AB04576 [0,1,0,1,0,0|2,0,0]=4 81 B15R2.15 c1ccc(cc1)CN2CCC(C2)CN AB25146 [0,1,0,1,0,0|2,0,0]=4 82 B15R2.15 c1ccc(cc1)CN2CCC(C2)CO AB17111 [0,1,0,1,0,0|2,0,0]=4 83 B15R2.15 c1ccc(cc1)CN2CC[C@@H](C2)CO AB50974 [0,1,0,1,0,0|2,0,0]=4 84 B15R2.15 c1ccc(cc1)CN2CC[C@H](C2)CO AB50975 [0,1,0,1,0,0|2,0,0]=4 85 B11R1.16 CCOC(=O)c1cccnc1 AB00748 [1,0,0,0,1,0|2,0,0]=4 86 B11R1.16 CNCC(=O)c1ccccc1 AB16229 [1,0,0,0,1,0|1,0,0]=3 87 B11R1.16 c1ccc(cc1)C(=O)OCCl AB01791 [1,0,0,0,1,0|2,0,0]=4 88 B11R1.36 CN(C)C(=O)c1cccnc1 MB00495 [0,0,0,0,2,0|2,0,0]=4