0 B14R2.966 CNC(=O)c1ccc2c(c1)CCO2 CSC011236672 [0,0,0,0,0,0|3,0,0]=3 1 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 CSC000159858 [0,0,0,0,0,0|3,0,0]=3 2 B14R2.966 COC(=O)c1ccc2[nH]ncc2c1 CSC011347493 [0,0,0,0,0,0|3,0,0]=3 3 B14R2.966 COC(=O)c1ccc2c(c1)CCO2 CSC011242901 [0,0,0,0,0,0|2,0,0]=2 4 B14R2.966 COC(=O)c1ccc2c(c1)OCO2 CSC000148850 [0,0,0,0,0,0|2,0,0]=2 5 B14R2.966 COC(=O)c1ccc2cc[nH]c2n1 CSC009881502 [0,0,0,0,0,0|1,0,2]=3 6 B14R2.966 COC(=O)c1ccc2cn[nH]c2c1 CSC011195960 [0,0,0,0,0,0|1,0,1]=2 7 B14R2.966 COC(=O)c1ccc2nccn2c1 CSC000067816 [0,0,0,0,0,0|3,0,1]=4 8 B14R2.966 COC(=O)c1cnc2[nH]ccc2c1 CSC000088913 [0,0,0,0,0,0|3,0,1]=4 9 B14R2.966 NNC(=O)c1ccc2c(c1)OCO2 CSC000184025 [0,0,0,0,0,0|4,0,0]=4 10 B13R2.430 NC(=O)c1ccc2c(c1)CCO2 CSC011236878 [1,0,0,0,0,0|3,0,0]=4 11 B13R2.430 NC(=O)c1ccc2cc[nH]c2c1 CSC011409218 [1,0,0,0,0,0|1,0,2]=4 12 B15R2.1350 CCNC(=O)c1ccc2c(c1)OCO2 CSC000160143 [0,1,0,0,0,0|3,0,0]=4 13 B15R2.1350 CCOC(=O)c1ccc2[nH]ccc2c1 CSC011216568 [0,1,0,0,0,0|2,0,1]=4 14 B15R2.1350 CCOC(=O)c1ccc2[nH]ncc2c1 CSC011220630 [0,1,0,0,0,0|3,0,0]=4 15 B15R2.1350 CCOC(=O)c1ccc2c(c1)OCO2 CSC000170217 [0,1,0,0,0,0|2,0,0]=3 16 B15R2.1350 CCOC(=O)c1ccc2cc[nH]c2c1 CSC011294816 [0,1,0,0,0,0|0,0,2]=3 17 B15R2.1350 CCOC(=O)c1ccc2cn[nH]c2c1 CSC011195961 [0,1,0,0,0,0|1,0,1]=3 18 B15R2.1350 CCOC(=O)c1ccc2ncsc2c1 CSC000170763 [0,1,0,0,0,0|2,0,1]=4 19 B15R2.19098 COC(=O)c1ccc2ccn(c2c1)C CSC000043376 [0,1,0,0,0,0|0,0,2]=3 20 B15R2.19280 COC(=O)c1ccc2c(c1)CC(O2)C CSC009854162 [0,1,0,0,0,0|2,0,0]=3 21 B15R2.19280 COC(=O)c1ccc2c(c1)NC(=O)C2 CSC011934335 [0,1,0,0,0,0|0,0,1]=2 22 B15R2.19280 COC(=O)c1ccc2oc(=O)[nH]c2c1 CSC000117463 [0,1,0,0,0,0|1,0,1]=3 23 B15R2.19280 COC(=O)c1ccc2oc(nc2c1)C CSC000068869 [0,1,0,0,0,0|1,0,2]=4 24 B15R2.79412 COC(=O)c1ccc2n(cnc2c1)C CSC000015510 [0,1,0,0,0,0|1,0,2]=4 25 B13R1.49 COC(=O)c1ccc(c(c1)C#N)F CSC000082614 [0,0,1,0,0,0|3,0,0]=4 26 B13R1.49 COC(=O)c1ccc(c(c1)OC)Br CSC009816954 [0,0,1,0,0,0|2,0,0]=3 27 B13R1.49 COC(=O)c1ccc(c(c1)OC)C CSC000216661 [0,0,1,0,0,0|1,0,0]=2 28 B13R1.49 COC(=O)c1ccc(c(c1)OC)Cl CSC012340335 [0,0,1,0,0,0|2,0,0]=3 29 B13R1.139 CCCc1ccc(cc1)C(=O)OC CSC011528880 [0,0,1,0,0,0|1,0,0]=2 30 B13R1.139 CCOc1ccc(cc1)C(=O)CC CSC000170456 [0,0,1,0,0,0|3,0,0]=4 31 B13R1.139 CCOc1ccc(cc1)C(=O)OC CSC000148975 [0,0,1,0,0,0|2,0,0]=3 32 B13R1.374 CCOc1cccc(c1)C(=O)NN CSC000034564 [0,0,1,0,0,0|3,0,0]=4 33 B13R1.374 CCOc1cccc(c1)C(=O)OC CSC000171667 [0,0,1,0,0,0|1,0,0]=2 34 B13R1.374 COC(=O)c1cccc(c1)CC#N CSC015953673 [0,0,1,0,0,0|2,0,1]=4 35 B13R1.374 COCc1cccc(c1)C(=O)OC CSC000198944 [0,0,1,0,0,0|2,0,0]=3 36 B13R1.3088 CCC(=O)c1ccc(c(c1)F)OC CSC011220448 [0,0,1,0,0,0|3,0,0]=4 37 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC CSC000206220 [0,0,1,0,0,0|3,0,0]=4 38 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC CSC000198141 [0,0,1,0,0,0|3,0,0]=4 39 B13R1.3088 COC(=O)c1ccc(c(c1)Br)OC CSC000189012 [0,0,1,0,0,0|2,0,0]=3 40 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)C#N CSC009861381 [0,0,1,0,0,0|2,0,1]=4 41 B13R1.3088 COC(=O)c1ccc(c(c1)F)CO CSC000094453 [0,0,1,0,0,0|2,0,0]=3 42 B13R1.3088 COC(=O)c1ccc(c(c1)F)OC CSC000198256 [0,0,1,0,0,0|2,0,0]=3 43 B13R1.3088 COC(=O)c1ccc(c(c1)I)OC CSC011216211 [0,0,1,0,0,0|2,0,0]=3 44 B13R1.3088 COC(=O)c1ccc(c(c1)O)OC CSC011215032 [0,0,1,0,0,0|2,0,0]=3 45 B13R2.531 COC(=O)c1cc2n(n1)CCC2 CSC011073974 [0,0,0,0,1,0|3,0,0]=4 46 B13R2.1095 COC(=O)c1n[nH]c2c1CCC2 CSC000014258 [0,0,0,0,1,0|3,0,0]=4 47 B15R2.1601 CNC(=O)c1ccc2c(c1)CCCC2 CSC000206194 [0,0,0,0,0,1|2,0,0]=3 48 B15R2.1601 COC(=O)c1ccc2c(c1)CCCN2 CSC011261796 [0,0,0,0,0,1|1,0,0]=2 49 B15R2.1601 COC(=O)c1ccc2c(c1)OCCO2 CSC000149866 [0,0,0,0,0,1|1,0,0]=2 50 B15R2.1601 COC(=O)c1ccc2ncccc2c1 CSC011217999 [0,0,0,0,0,1|1,0,2]=4 51 B15R2.1601 COC(=O)c1ccc2nccnc2c1 CSC000148277 [0,0,0,0,0,1|0,0,3]=4 52 B15R2.4343 CCC(=O)Oc1ccc2cn[nH]c2c1 CSC011010878 [0,0,0,0,0,1|2,0,1]=4 53 B15R2.4343 COC(=O)Cc1ccc2c(c1)OCO2 CSC000027945 [0,0,0,0,0,1|2,0,0]=3 54 B15R2.4343 NCC(=O)Nc1ccc2c(c1)CCC2 CSC000168306 [0,0,0,0,0,1|3,0,0]=4 55 B12R1.56 CNc1cc(ccc1C)[N+](=O)[O-] CSC011708256 [1,0,1,0,0,0|1,0,1]=4 56 B12R1.367 CNC(=O)c1ccc(c(c1)C)C CSC000159929 [1,0,1,0,0,0|1,0,0]=3 57 B12R1.367 CNC(=O)c1ccc(c(c1)C)N CSC000739472 [1,0,1,0,0,0|2,0,0]=4 58 B12R1.367 CNC(=O)c1ccc(c(c1)N)C CSC000737617 [1,0,1,0,0,0|1,0,0]=3 59 B12R1.367 COC(=O)c1ccc(=O)n(c1)C CSC000054066 [1,0,1,0,0,0|2,0,0]=4 60 B12R1.367 COC(=O)c1ccc(c(c1)Br)Cl CSC012356255 [1,0,1,0,0,0|2,0,0]=4 61 B12R1.367 COC(=O)c1ccc(c(c1)Br)F CSC000722584 [1,0,1,0,0,0|2,0,0]=4 62 B12R1.367 COC(=O)c1ccc(c(c1)Br)I CSC011294788 [1,0,1,0,0,0|2,0,0]=4 63 B12R1.367 COC(=O)c1ccc(c(c1)C)Br CSC011215878 [1,0,1,0,0,0|1,0,0]=3 64 B12R1.367 COC(=O)c1ccc(c(c1)C)C CSC000149473 [1,0,1,0,0,0|0,0,0]=2 65 B12R1.367 COC(=O)c1ccc(c(c1)C)Cl CSC011217186 [1,0,1,0,0,0|1,0,0]=3 66 B12R1.367 COC(=O)c1ccc(c(c1)C)F CSC000698631 [1,0,1,0,0,0|1,0,0]=3 67 B12R1.367 COC(=O)c1ccc(c(c1)C)O CSC011997373 [1,0,1,0,0,0|1,0,0]=3 68 B12R1.367 COC(=O)c1ccc(c(c1)Cl)Br CSC012359697 [1,0,1,0,0,0|2,0,0]=4 69 B12R1.367 COC(=O)c1ccc(c(c1)Cl)C CSC011219533 [1,0,1,0,0,0|1,0,0]=3 70 B12R1.367 COC(=O)c1ccc(c(c1)Cl)F CSC011997363 [1,0,1,0,0,0|2,0,0]=4 71 B12R1.367 COC(=O)c1ccc(c(c1)Cl)I CSC012356344 [1,0,1,0,0,0|2,0,0]=4 72 B12R1.367 COC(=O)c1ccc(c(c1)Cl)N CSC000704683 [1,0,1,0,0,0|2,0,0]=4 73 B12R1.367 COC(=O)c1ccc(c(c1)F)Br CSC000703229 [1,0,1,0,0,0|2,0,0]=4 74 B12R1.367 COC(=O)c1ccc(c(c1)F)C CSC000216653 [1,0,1,0,0,0|1,0,0]=3 75 B12R1.367 COC(=O)c1ccc(c(c1)F)Cl CSC011216032 [1,0,1,0,0,0|2,0,0]=4 76 B12R1.367 COC(=O)c1ccc(c(c1)F)F CSC000194019 [1,0,1,0,0,0|2,0,0]=4 77 B12R1.367 COC(=O)c1ccc(c(c1)F)I CSC000062896 [1,0,1,0,0,0|2,0,0]=4 78 B12R1.367 COC(=O)c1ccc(c(c1)I)C CSC011218856 [1,0,1,0,0,0|1,0,0]=3 79 B12R1.367 COC(=O)c1ccc(c(c1)I)Cl CSC011294800 [1,0,1,0,0,0|2,0,0]=4 80 B12R1.367 COC(=O)c1ccc(c(c1)I)F CSC012361652 [1,0,1,0,0,0|2,0,0]=4 81 B12R1.367 COC(=O)c1ccc(c(c1)N)Br CSC011450966 [1,0,1,0,0,0|1,0,0]=3 82 B12R1.367 COC(=O)c1ccc(c(c1)N)I CSC011290891 [1,0,1,0,0,0|1,0,0]=3 83 B12R1.367 COC(=O)c1ccc(c(c1)O)Br CSC011934688 [1,0,1,0,0,0|2,0,0]=4 84 B12R1.367 COC(=O)c1ccc(c(c1)O)C CSC000736511 [1,0,1,0,0,0|1,0,0]=3 85 B12R1.367 COC(=O)c1ccn(c(=O)c1)C CSC011315524 [1,0,1,0,0,0|2,0,0]=4 86 B12R1.367 Cc1ccc(cc1C)C(=O)NN CSC000189846 [1,0,1,0,0,0|2,0,0]=4 87 B12R1.435 CCc1cccc(n1)C(=O)OC CSC009857250 [1,0,1,0,0,0|1,0,0]=3 88 B12R1.435 CNC(=O)c1cccc(c1)OC CSC000159855 [1,0,1,0,0,0|2,0,0]=4 89 B12R1.435 COC(=O)c1cc(ccn1)OC CSC000066548 [1,0,1,0,0,0|2,0,0]=4 90 B12R1.435 COC(=O)c1cccc(c1)C#N CSC000151112 [1,0,1,0,0,0|1,0,1]=4 91 B12R1.435 COC(=O)c1cccc(c1)OC CSC000148714 [1,0,1,0,0,0|1,0,0]=3 92 B12R1.435 COC(=O)c1cccc(c1)SC CSC009884918 [1,0,1,0,0,0|1,0,0]=3 93 B12R1.5 CCC(=O)c1ccc(cc1)OC CSC000170455 [1,0,1,0,0,0|2,0,0]=4 94 B12R1.5 CCc1ccc(cc1)C(=O)OC CSC000149224 [1,0,1,0,0,0|0,0,0]=2 95 B12R1.5 CNC(=O)c1ccc(cc1)CO CSC000159720 [1,0,1,0,0,0|2,0,0]=4 96 B12R1.5 CNC(=O)c1ccc(cc1)OC CSC000159827 [1,0,1,0,0,0|2,0,0]=4 97 B12R1.5 CNc1ccc(cc1)C(=O)OC CSC000220287 [1,0,1,0,0,0|1,0,0]=3 98 B12R1.5 COC(=O)c1ccc(cc1)C#N CSC000148855 [1,0,1,0,0,0|0,0,2]=4 99 B12R1.5 COC(=O)c1ccc(cc1)C=C CSC000061247 [1,0,1,0,0,0|0,0,2]=4 100 B12R1.5 COC(=O)c1ccc(cc1)CO CSC000151488 [1,0,1,0,0,0|1,0,0]=3 101 B12R1.5 COC(=O)c1ccc(cc1)OC CSC000150779 [1,0,1,0,0,0|1,0,0]=3 102 B12R1.5 COC(=O)c1ccc(cc1)SC CSC000175311 [1,0,1,0,0,0|1,0,0]=3 103 B12R1.5 COC(=O)c1ccc(nc1)OC CSC000181318 [1,0,1,0,0,0|2,0,0]=4 104 B12R1.279 CCNc1cccc(c1)[N+](=O)[O-] CSC011211226 [1,0,1,0,0,0|1,0,1]=4 105 B12R1.279 CCOc1cccc(c1)C(=O)N CSC000027222 [1,0,1,0,0,0|2,0,0]=4 106 B12R1.48 COc1ccc(cc1C)C(=O)C CSC000693588 [1,0,1,0,0,0|2,0,0]=4 107 B12R2.44 COc1ccc2c(c1)OCO2 CSC000005814 [2,0,0,0,0,0|2,0,0]=4 108 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)Cl CSC012360565 [0,1,1,0,0,0|2,0,0]=4 109 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)F CSC011997385 [0,1,1,0,0,0|2,0,0]=4 110 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)O CSC000038551 [0,1,1,0,0,0|2,0,0]=4 111 B14R1.748 COC(=O)c1ccc(c(c1)[N+](=O)[O-])C CSC000151315 [0,1,1,0,0,0|1,0,1]=4 112 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)OC CSC000159905 [0,1,1,0,0,0|2,0,0]=4 113 B14R1.2283 COC(=O)c1cc(c(cc1F)N)OC CSC009964904 [0,1,1,0,0,0|2,0,0]=4 114 B14R1.25 CCCc1ccc(cc1)C(=O)OCC CSC011528881 [0,1,1,0,0,0|1,0,0]=3 115 B14R1.25 CCOC(=O)c1ccc(cc1)OCC CSC000170315 [0,1,1,0,0,0|2,0,0]=4 116 B14R1.65 CCC(=O)c1ccc(cc1)OCCO CSC000193577 [0,1,1,0,0,0|2,0,0]=4 117 B14R1.65 CCCCc1ccc(cc1)C(=O)OC CSC000216683 [0,1,1,0,0,0|1,0,0]=3 118 B14R1.65 CCCOc1ccc(cc1)C(=O)CC CSC000170458 [0,1,1,0,0,0|2,0,0]=4 119 B14R1.65 CCCOc1ccc(cc1)C(=O)NC CSC000159887 [0,1,1,0,0,0|2,0,0]=4 120 B14R1.65 CCCOc1ccc(cc1)C(=O)NC CSC000159887 [0,1,1,0,0,0|2,0,0]=4 121 B14R1.65 COC(=O)c1ccc(cc1)OCC=C CSC000172099 [0,1,1,0,0,0|1,0,1]=4 122 B14R1.65 COC(=O)c1ccc(cc1)OCCO CSC011216607 [0,1,1,0,0,0|1,0,0]=3 123 B14R1.717 COC(=O)c1ccc(cc1)OC(C)C CSC000148098 [0,1,1,0,0,0|2,0,0]=4 124 B14R1.718 COC(=O)c1ccc(cc1)C(=O)NN CSC000016285 [0,1,1,0,0,0|1,0,1]=4 125 B14R1.471 CCOC(=O)c1cccc(c1)COC CSC011212799 [0,1,1,0,0,0|2,0,0]=4 126 B14R1.733 CCC(=O)c1cccc(c1)NC(=O)C CSC009862755 [0,1,1,0,0,0|1,0,1]=4 127 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C CSC000154571 [0,1,1,0,0,0|1,0,1]=4 128 B14R1.733 COC(=O)c1cccc(c1)NC(=O)C CSC000149867 [0,1,1,0,0,0|0,0,1]=3 129 B14R1.733 COC(=O)c1cccc(c1)OC(F)F CSC000148711 [0,1,1,0,0,0|2,0,0]=4 130 B14R1.733 COC(=O)c1ccnc(c1)NC(=O)C CSC000137391 [0,1,1,0,0,0|1,0,1]=4 131 B14R1.734 COC(=O)c1cccc(c1)C(=O)OC CSC000028157 [0,1,1,0,0,0|2,0,0]=4 132 B14R1.780 COC(=O)c1cccc(c1)OCC#N CSC000006301 [0,1,1,0,0,0|1,0,1]=4 133 B14R1.780 COC(=O)c1cccc(c1)OCCO CSC000047857 [0,1,1,0,0,0|1,0,0]=3 134 B14R1.3213 CCOc1cc(cc(c1)C(=O)OC)Br CSC010223199 [0,1,1,0,0,0|1,0,0]=3 135 B14R1.3326 CCOc1cccc(c1)C(=O)N(C)C CSC000046484 [0,1,1,0,0,0|2,0,0]=4 136 B14R1.628 CCOC(=O)c1ccc(c(c1)F)OC CSC011206296 [0,1,1,0,0,0|2,0,0]=4 137 B14R1.628 CCOC(=O)c1ccc(c(c1)I)OC CSC012360133 [0,1,1,0,0,0|2,0,0]=4 138 B14R1.12512 COC(=O)c1cc(c(c(c1)C)OC)C CSC009864815 [0,1,1,0,0,0|2,0,0]=4 139 B16R2.767 CCNC(=O)c1ccc2c(c1)CCCC2 CSC000203941 [0,1,0,0,0,1|2,0,0]=4 140 B16R2.767 CCNC(=O)c1ccc2c(c1)OCCO2 CSC000160226 [0,1,0,0,0,1|2,0,0]=4 141 B16R2.1205 CNC(=O)c1ccc2c(c1)NC(=O)CO2 CSC000194216 [0,1,0,0,0,1|1,0,1]=4 142 B16R2.1205 COC(=O)c1ccc2c(c1)NC(=O)CN2 CSC000060008 [0,1,0,0,0,1|0,0,1]=3 143 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)CCCC2 CSC000206156 [0,1,0,0,0,1|2,0,0]=4 144 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)OCCO2 CSC000159690 [0,1,0,0,0,1|2,0,0]=4 145 B16R2.33799 COC(=O)c1ccc2c(c1)OCC(=O)N2 CSC000193743 [0,1,0,0,0,1|1,0,1]=4 146 B16R2.33941 COC(=O)c1cc2c([nH]c1=O)CCCC2 CSC000071019 [0,1,0,0,0,1|2,0,0]=4 147 B16R2.33941 COC(=O)c1cc2c(cc1N)CCCC2 CSC000724758 [0,1,0,0,0,1|1,0,0]=3 148 B16R2.173132 COC(=O)c1ccc2c(c1)CCCC2=O CSC010203626 [0,1,0,0,0,1|1,0,0]=3 149 B16R2.2151 CCCC(=O)Nc1ccc2c(c1)CCC2 CSC000154641 [0,1,0,0,0,1|2,0,0]=4 150 B16R2.2151 CNCC(=O)Nc1ccc2c(c1)CCC2 CSC000167993 [0,1,0,0,0,1|2,0,0]=4 151 B16R2.2151 COCC(=O)Nc1ccc2c(c1)CCN2 CSC011833629 [0,1,0,0,0,1|2,0,0]=4 152 B16R2.2151 COCC(=O)Nc1ccc2c(c1)OCO2 CSC000157636 [0,1,0,0,0,1|2,0,0]=4 153 B16R2.2151 COCC(=O)Nc1ccc2c(c1)OCO2 CSC000157636 [0,1,0,0,0,1|2,0,0]=4 154 B16R2.2151 COCC(=O)Nc1ccc2nc[nH]c2c1 CSC000056315 [0,1,0,0,0,1|1,0,1]=4 155 B16R2.2151 NCCC(=O)Nc1ccc2c(c1)CCC2 CSC011208869 [0,1,0,0,0,1|2,0,0]=4 156 B16R2.6257 CC(N)C(=O)Nc1ccc2c(c1)CCC2 CSC000218350 [0,1,0,0,0,1|2,0,0]=4 157 B16R2.6257 C[C@@H](N)C(=O)Nc1ccc2c(c1)CCC2 CSC011505335 [0,1,0,0,0,1|2,0,0]=4 158 B16R2.6257 C[C@H](N)C(=O)Nc1ccc2c(c1)CCC2 CSC011422198 [0,1,0,0,0,1|2,0,0]=4 159 B16R2.34363 CN1CCc2c1cc(cc2)NC(=O)CN CSC010910649 [0,1,0,0,0,1|2,0,0]=4 160 B16R2.2122 C=CCOC(=O)c1ccc2cc[nH]c2c1 CSC000047512 [0,2,0,0,0,0|0,0,2]=4 161 B16R2.2122 NCCNC(=O)c1ccc2c(c1)CCC2 CSC011209309 [0,2,0,0,0,0|2,0,0]=4 162 B16R2.2122 O=C(OCC#C)c1ccc2cc[nH]c2c1 CSC000047511 [0,2,0,0,0,0|0,0,2]=4 163 B16R2.11587 CC(C)OC(=O)c1ccc2c(c1)OCO2 CSC000170218 [0,2,0,0,0,0|2,0,0]=4 164 B16R2.29707 CCOC(=O)c1ccc2oc(=O)[nH]c2c1 CSC010534111 [0,2,0,0,0,0|1,0,1]=4 165 B14R2.10782 COC(=O)c1cccc2c1NCC2 CSC000097324 [0,0,1,1,0,0|2,0,0]=4 166 B14R2.10782 COC(=O)c1cccc2c1OCO2 CSC000054161 [0,0,1,1,0,0|2,0,0]=4 167 B14R2.10782 COC(=O)c1cccc2c1cc[nH]2 CSC011218648 [0,0,1,1,0,0|0,0,2]=4 168 B14R2.10782 COC(=O)c1cccc2c1cn[nH]2 CSC000062817 [0,0,1,1,0,0|1,0,1]=4 169 B14R1.3405 COC(=O)Cc1ccc(c(c1)OC)O CSC000074908 [0,0,1,0,0,1|2,0,0]=4 170 B14R1.24 CCOc1ccc(cc1)CC(=O)OC CSC000148214 [0,0,1,0,0,1|2,0,0]=4 171 B14R1.470 CCOc1cccc(c1)NC(=O)CC CSC000243814 [0,0,1,0,0,1|2,0,0]=4 172 B14R1.3276 CCC(=O)Nc1ccc(c(c1)N)OC CSC011323234 [0,0,1,0,0,1|2,0,0]=4 173 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)OC CSC000205493 [0,0,1,0,0,1|2,0,0]=4 174 B14R2.781 NC(=O)c1ccc2c(c1)CCCC2 CSC000206392 [1,0,0,0,0,1|2,0,0]=4 175 B16R2.5347 CCC(=O)Nc1ccc2c(c1)CCCN2 CSC011718258 [0,0,0,0,0,2|2,0,0]=4 176 B16R2.5347 CCC(=O)Nc1ccc2c(c1)CNCC2 CSC011944909 [0,0,0,0,0,2|1,0,0]=3 177 B16R2.5347 CCC(=O)Nc1ccc2c(c1)OCCO2 CSC000152681 [0,0,0,0,0,2|2,0,0]=4 178 B16R2.5347 CNC(=O)Cc1ccc2c(c1)OCCO2 CSC046155238 [0,0,0,0,0,2|2,0,0]=4 179 B16R2.5347 COC(=O)Cc1ccc2c(c1)OCCO2 CSC000001069 [0,0,0,0,0,2|1,0,0]=3 180 B16R2.171832 CNC(=O)c1ccc2c(c1)CCNCC2 CSC056714724 [0,0,0,0,0,2|1,0,0]=3 181 B16R2.171832 CNC(=O)c1ccc2c(c1)OCCCO2 CSC000190639 [0,0,0,0,0,2|2,0,0]=4 182 B16R2.1357 COC(=O)NCc1ccc2c(c1)OCO2 CSC000188958 [0,0,0,0,0,2|2,0,0]=4 183 B11R1.21 Cc1ccc(cc1C)C(=O)N CSC000162321 [2,0,1,0,0,0|1,0,0]=4 184 B11R1.189 CCSc1cccc(c1)OC CSC000031258 [2,0,1,0,0,0|1,0,0]=4 185 B11R1.22 CNC(=O)c1ccc(cc1)C CSC000159850 [2,0,1,0,0,0|1,0,0]=4 186 B11R1.22 COC(=O)c1ccc(cc1)Cl CSC000150334 [2,0,1,0,0,0|1,0,0]=4 187 B11R1.22 COC(=O)c1ccc(cc1)F CSC000150329 [2,0,1,0,0,0|1,0,0]=4 188 B11R1.22 COC(=O)c1ccc(nc1)C CSC000740734 [2,0,1,0,0,0|1,0,0]=4 189 B11R1.23 CNC(=O)c1cccc(c1)C CSC000159928 [2,0,1,0,0,0|1,0,0]=4 190 B11R1.23 COC(=O)c1cccc(c1)Br CSC000148679 [2,0,1,0,0,0|1,0,0]=4 191 B11R1.23 COC(=O)c1cccc(c1)C CSC000149472 [2,0,1,0,0,0|0,0,0]=3 192 B11R1.23 COC(=O)c1cccc(c1)Cl CSC000150768 [2,0,1,0,0,0|1,0,0]=4 193 B11R1.23 COC(=O)c1cccc(c1)F CSC000148988 [2,0,1,0,0,0|1,0,0]=4 194 B11R1.23 COC(=O)c1cccc(c1)I CSC000148848 [2,0,1,0,0,0|1,0,0]=4 195 B11R1.23 COC(=O)c1cccc(c1)O CSC000150331 [2,0,1,0,0,0|1,0,0]=4 196 B11R1.23 COC(=O)c1cccc(n1)C CSC000741576 [2,0,1,0,0,0|1,0,0]=4 197 B11R1.23 COC(=O)c1ccnc(c1)C CSC012001301 [2,0,1,0,0,0|1,0,0]=4 198 B11R1.3 CCc1ccc(cc1)C(=O)N CSC000162293 [2,0,1,0,0,0|1,0,0]=4 199 B11R1.83 CCCc1ccc(cc1)OC CSC000034192 [2,0,1,0,0,0|1,0,0]=4 200 B11R1.83 COc1ccc(cc1)CCO CSC011219623 [2,0,1,0,0,0|1,0,0]=4 201 B13R1.3091 COc1cc(ccc1SC)C(=O)C CSC000056233 [1,1,1,0,0,0|1,0,0]=4 202 B13R1.466 CCNC(=O)c1ccc(c(c1)C)C CSC000160207 [1,1,1,0,0,0|1,0,0]=4 203 B13R1.466 CCNC(=O)c1ccc(c(c1)N)C CSC000740560 [1,1,1,0,0,0|1,0,0]=4 204 B13R1.466 CCOC(=O)c1ccc(c(c1)Br)C CSC012359631 [1,1,1,0,0,0|1,0,0]=4 205 B13R1.466 CCOC(=O)c1ccc(c(c1)C)Br CSC012229600 [1,1,1,0,0,0|1,0,0]=4 206 B13R1.466 CCOC(=O)c1ccc(c(c1)C)C CSC000170501 [1,1,1,0,0,0|0,0,0]=3 207 B13R1.466 CCOC(=O)c1ccc(c(c1)I)C CSC011809547 [1,1,1,0,0,0|1,0,0]=4 208 B13R1.510 CN(C)C(=O)c1ccc(c(c1)N)C CSC000740206 [1,1,1,0,0,0|1,0,0]=4 209 B13R1.1808 COC(=O)c1ccc(c(c1Cl)N)Cl CSC010996465 [1,1,1,0,0,0|1,0,0]=4 210 B13R1.1808 COC(=O)c1ccc(c(c1F)C)Br CSC010172522 [1,1,1,0,0,0|1,0,0]=4 211 B13R1.82 COC(=O)c1cccc(c1C)OC CSC009849072 [1,1,1,0,0,0|1,0,0]=4 212 B13R1.82 COC(=O)c1cccc(c1O)OC CSC000148165 [1,1,1,0,0,0|1,0,0]=4 213 B13R1.314 COC(=O)c1cc(cc(c1)OC)Br CSC010233337 [1,1,1,0,0,0|1,0,0]=4 214 B13R1.460 CCOC(=O)c1cccc(c1)OC CSC000170202 [1,1,1,0,0,0|1,0,0]=4 215 B13R1.543 COC(=O)c1cccc(c1)C(=O)C CSC000092496 [1,1,1,0,0,0|0,0,1]=4 216 B13R1.543 COC(=O)c1cccc(c1)N(C)C CSC000148937 [1,1,1,0,0,0|0,0,0]=3 217 B13R1.2431 COC(=O)c1cc(ccc1Br)OC CSC000151459 [1,1,1,0,0,0|1,0,0]=4 218 B13R1.2431 COC(=O)c1cc(ccc1O)OC CSC000151008 [1,1,1,0,0,0|1,0,0]=4 219 B13R1.95 COC(=O)c1ccc(cc1Br)OC CSC009815674 [1,1,1,0,0,0|1,0,0]=4 220 B13R1.95 COC(=O)c1ccc(cc1C)OC CSC011997376 [1,1,1,0,0,0|1,0,0]=4 221 B13R1.95 COC(=O)c1ccc(cc1F)OC CSC000198241 [1,1,1,0,0,0|1,0,0]=4 222 B13R1.452 CCOC(=O)c1ccc(cc1)CC CSC000170419 [1,1,1,0,0,0|0,0,0]=3 223 B13R1.452 CCOC(=O)c1ccc(cc1)OC CSC000170088 [1,1,1,0,0,0|1,0,0]=4 224 B13R1.537 COC(=O)c1ccc(cc1)C(=O)C CSC000033754 [1,1,1,0,0,0|0,0,1]=4 225 B13R1.537 COC(=O)c1ccc(cc1)C(C)C CSC000148701 [1,1,1,0,0,0|0,0,0]=3 226 B13R1.537 COC(=O)c1ccc(cc1)C(F)F CSC000059331 [1,1,1,0,0,0|1,0,0]=4 227 B13R1.537 COC(=O)c1ccc(cc1)N(C)C CSC000148938 [1,1,1,0,0,0|1,0,0]=4 228 B13R1.74 CC(=O)c1ccc(cc1)OCCO CSC000193542 [1,1,1,0,0,0|1,0,0]=4 229 B13R1.568 CC(=O)c1cccc(c1)OCCO CSC011214353 [1,1,1,0,0,0|1,0,0]=4 230 B13R1.568 CCCOc1cccc(c1)C(=O)C CSC000171660 [1,1,1,0,0,0|1,0,0]=4 231 B13R1.587 CC(=O)Nc1cccc(c1)C(=O)C CSC000155543 [1,1,1,0,0,0|0,0,1]=4 232 B15R1.3769 COC(=O)Cc1ccc(c(c1)OC)OC CSC000149162 [0,1,1,0,0,1|1,0,0]=4 233 B15R1.104 CCC(=O)Nc1ccc(cc1)OCCN CSC011279039 [0,1,1,0,0,1|1,0,0]=4 234 B15R1.104 CCCOc1ccc(cc1)CC(=O)OC CSC000006314 [0,1,1,0,0,1|1,0,0]=4 235 B15R1.1038 CCNCc1cccc(c1)NC(=O)CC CSC011323425 [0,1,1,0,0,1|1,0,0]=4 236 B15R1.9453 CCOc1cccc(c1)NC(=O)COC CSC011407393 [0,1,1,0,0,1|1,0,0]=4 237 B15R1.1279 COCC(=O)Nc1ccc(c(c1)N)OC CSC011443596 [0,1,1,0,0,1|1,0,0]=4 238 B15R1.383 COC(=O)c1cc(c(c(c1)OC)C)OC CSC000151322 [0,2,1,0,0,0|1,0,0]=4 239 B15R1.991 COC(=O)c1ccc(c(c1)NC(=O)C)Cl CSC000154479 [0,2,1,0,0,0|1,0,0]=4 240 B15R1.1827 COC(=O)c1cc(c(cc1Br)OC)OC CSC009990419 [0,2,1,0,0,0|1,0,0]=4 241 B15R1.1827 COC(=O)c1cc(c(cc1I)OC)OC CSC000058957 [0,2,1,0,0,0|1,0,0]=4 242 B15R1.105 CCOC(=O)c1ccc(nc1)NCCN CSC011214598 [0,2,1,0,0,0|1,0,0]=4 243 B15R1.557 CCCCOc1ccc(cc1)C(=O)OC CSC000149894 [0,2,1,0,0,0|1,0,0]=4 244 B15R1.557 COC(=O)c1ccc(cc1)CSCCO CSC011203141 [0,2,1,0,0,0|1,0,0]=4 245 B15R1.557 COC(=O)c1ccc(cc1)OCCCO CSC011308758 [0,2,1,0,0,0|1,0,0]=4 246 B15R1.944 COC(=O)c1ccc(cc1)CNC(C)C CSC000217745 [0,2,1,0,0,0|1,0,0]=4 247 B15R1.944 COC(=O)c1ccc(cc1)OCC(=O)N CSC000148697 [0,2,1,0,0,0|0,0,1]=4 248 B15R1.944 COC(=O)c1ccc(cc1)OCC(C)C CSC000148100 [0,2,1,0,0,0|1,0,0]=4 249 B15R1.969 COC(=O)c1cccc(c1C)NC(=O)C CSC000187762 [0,2,1,0,0,0|0,0,1]=4 250 B15R1.926 COC(=O)c1cc(ccc1C)NC(=O)C CSC009995301 [0,2,1,0,0,0|0,0,1]=4 251 B15R1.926 COC(=O)c1cc(ccc1Cl)NC(=O)C CSC000189210 [0,2,1,0,0,0|0,0,1]=4 252 B15R1.934 COC(=O)c1cc(cc(c1)OC(C)C)Br CSC010126265 [0,2,1,0,0,0|1,0,0]=4 253 B15R1.5445 CCCOc1cc(cc(c1)C(=O)OC)Br CSC010138849 [0,2,1,0,0,0|1,0,0]=4 254 B15R1.12147 COC(=O)c1cc(ccc1Br)NCCO CSC017397762 [0,2,1,0,0,0|0,0,0]=3 255 B17R2.2159 CCCC(=O)Nc1ccc2c(c1)CNCC2 CSC005800850 [0,1,0,0,0,2|1,0,0]=4 256 B17R2.2159 CCNC(=O)Nc1ccc2c(c1)CNCC2 CSC005800855 [0,1,0,0,0,2|1,0,0]=4 257 B17R2.2159 COCC(=O)Nc1ccc2c(c1)CCCN2 CSC005665597 [0,1,0,0,0,2|1,0,0]=4 258 B17R2.2159 COCC(=O)Nc1ccc2c(c1)CNCC2 CSC005800849 [0,1,0,0,0,2|0,0,0]=3 259 B17R2.2159 COCC(=O)Nc1ccc2c(c1)OCCO2 CSC000251795 [0,1,0,0,0,2|1,0,0]=4 260 B17R2.9167 CC(C)C(=O)Nc1ccc2c(c1)CNCC2 CSC005800851 [0,1,0,0,0,2|1,0,0]=4 261 B17R2.18982 COC(=O)C(C)Sc1ccc2c(c1)CCC2 CSC011212693 [0,1,0,0,0,2|1,0,0]=4 262 B17R2.6194 CCOC(=O)c1ccc2c(c1)NC(=O)CN2 CSC000060009 [0,2,0,0,0,1|0,0,1]=4 263 B17R2.6194 CCOC(=O)c1ccc2c(c1)NC(=O)CS2 CSC000171021 [0,2,0,0,0,1|0,0,1]=4 264 B17R2.58066 COC(=O)c1ccc2c(c1)N(C(=O)CO2)C CSC010187858 [0,2,0,0,0,1|0,0,1]=4 265 B17R2.10085 CCOCC(=O)Nc1ccc2c(c1)CCC2 CSC000253425 [0,2,0,0,0,1|1,0,0]=4 266 B17R2.50529 CN1CCc2c1cc(cc2)NC(=O)CCN CSC010910650 [0,2,0,0,0,1|1,0,0]=4 267 B17R2.50529 CNCC(=O)Nc1ccc2c(c1)N(CC2)C CSC010910651 [0,2,0,0,0,1|1,0,0]=4 268 B17R2.186986 CC(N)C(=O)Nc1ccc2c(c1)N(CC2)C CSC010759112 [0,2,0,0,0,1|1,0,0]=4 269 B17R2.186986 C[C@@H](N)C(=O)Nc1ccc2c(c1)N(CC2)C CSC057654461 [0,2,0,0,0,1|1,0,0]=4 270 B11R1.226 COC(=O)c1cc(c(o1)C)C CSC000082600 [1,0,1,0,1,0|1,0,0]=4 271 B13R1.5 CCC(=O)Nc1ccc(cc1)CC CSC000155795 [1,0,1,0,0,1|1,0,0]=4 272 B13R1.5 CCc1ccc(cc1)CC(=O)NC CSC015209060 [1,0,1,0,0,1|1,0,0]=4 273 B13R1.5 CCc1ccc(cc1)CC(=O)OC CSC011203038 [1,0,1,0,0,1|0,0,0]=3 274 B13R1.5 COC(=O)Cc1ccc(cc1)OC CSC000148849 [1,0,1,0,0,1|1,0,0]=4 275 B13R1.5 COC(=O)Nc1ccc(cc1)OC CSC000216170 [1,0,1,0,0,1|1,0,0]=4 276 B13R1.5 COC(=O)Oc1ccc(cc1)OC CSC000022091 [1,0,1,0,0,1|1,0,0]=4 277 B13R1.2065 COC(=O)c1ccc(cc1OC)C CSC000086699 [0,0,1,0,1,1|1,0,0]=4 278 B13R2.57 COc1ccc2c(c1)OCCO2 CSC009884742 [2,0,0,0,0,1|1,0,0]=4 279 B17R2.364503 CCC(=O)Nc1ccc2c(c1)CNCCO2 CSC007721780 [0,0,0,0,0,3|1,0,0]=4