0 B17R2.193 Cc1nc(c[nH]c1=O)SCc2ccccc2 62a_100000211182_100010363809 [1,0,0,0,0,0|3,0,0]=4 1 B17R2.193 Cc1nc(c[nH]c1=O)SCc2ccccc2 62a_100010363809_100015291786 [1,0,0,0,0,0|3,0,0]=4 2 B17R2.193 O=c1[nH]cc(cc1O)SCc2ccccc2 62a_100000211182_100009814561 [1,0,0,0,0,0|3,0,0]=4 3 B17R2.5360 O=c1[nH]nc(c(=O)[nH]1)NCc2ccccc2 27a_100015324214_100000181694 [1,0,0,0,0,0|3,0,0]=4 4 B17R2.5360 O=c1[nH]nc(c(=O)[nH]1)SCc2ccccc2 62a_100000211182_100000181694 [1,0,0,0,0,0|3,0,0]=4 5 B17R2.5365 Cc1c[nH]c(=O)c(n1)SCc2ccccc2 62a_100000211182_100009858157 [1,0,0,0,0,0|3,0,0]=4 6 B17R2.5365 Cc1c[nH]c(=O)c(n1)SCc2ccccc2 62a_100009858157_100015291786 [1,0,0,0,0,0|3,0,0]=4 7 B17R1.16303 C=C(C)C(=O)CC(=O)NCCc1ccccc1 1458a_100000185857_100000183012 [0,0,1,0,0,0|3,0,0]=4 8 B17R1.16303 C[C@@H](O)C(=O)CC(=O)NCCc1ccccc1 1458a_100000717761_100000183012 [0,0,1,0,0,0|2,0,1]=4 9 B17R1.16303 C[C@H](O)C(=O)CC(=O)NCCc1ccccc1 1458a_217856618621_100000183012 [0,0,1,0,0,0|2,0,1]=4 10 B17R1.16303 O=C(CC(=O)C(O)O)NCCc1ccccc1 1458a_100000233687_100000183012 [0,0,1,0,0,0|2,0,1]=4 11 B16R1.849 C=CC(=O)CC(=O)NCCc1ccccc1 1458a_100000185746_100000183012 [1,0,1,0,0,0|2,0,0]=4 12 B16R1.849 O=C(CO)CC(=O)NCCc1ccccc1 1458a_100000210174_100000183012 [1,0,1,0,0,0|1,0,1]=4 13 B16R2.71 O=c1[nH]ccnc1SCc2ccccc2 62a_100000211182_100000763361 [2,0,0,0,0,0|2,0,0]=4 14 B18R2.249 CC(Cc1c[nH]c(=O)c(c1)O)c2ccccc2 271570a_100000062452_100009814561 [1,1,0,0,0,0|2,0,0]=4 15 B18R2.249 Cc1nc(c[nH]c1=O)CC(C)c2ccccc2 271570a_100000062452_100010363809 [1,1,0,0,0,0|2,0,0]=4 16 B18R2.6540 CC(Cc1n[nH]c(=O)[nH]c1=O)c2ccccc2 271570a_100000062452_100000181694 [1,1,0,0,0,0|2,0,0]=4 17 B18R2.6539 Cc1c[nH]c(=O)c(n1)CC(C)c2ccccc2 271570a_100000062452_100009858157 [1,1,0,0,0,0|2,0,0]=4 18 B20R2.155549 Cc1cn(c(=O)[nH]c1=O)CC(=O)Cc2ccccc2 1458a_100011215684_100015291786 [0,1,0,0,0,1|2,0,0]=4 19 B20R2.155549 O=C(Cc1ccccc1)Cn2cc(c(=O)[nH]c2=O)F 1458a_100011877732_100015291786 [0,1,0,0,0,1|2,0,0]=4 20 B16R2.317 O=c1ccc(cn1Cc2ccccc2)O 271570a_203496583355_200000151737 [1,0,0,0,1,0|2,0,0]=4 21 B16R2.317 O=c1ccc(nn1Cc2ccccc2)O 271570a_203496583355_100010063453 [1,0,0,0,1,0|1,0,0]=3 22 B18R1.10307 C=CC(=O)NCC(=O)N(C)CCc1ccccc1 11a_100000207497_200011222540 [0,0,1,0,0,1|2,0,0]=4 23 B18R1.10307 C=CC(=O)NCC(=O)N(C)CCc1ccccc1 240690a_100000207497_200011222540 [0,0,1,0,0,1|2,0,0]=4 24 B18R1.10307 C=CC(=O)NCC(=O)N(C)CCc1ccccc1 527a_100000207497_200011222540 [0,0,1,0,0,1|2,0,0]=4 25 B18R1.21066 C=C(Br)C(=O)NCC(=O)NCCc1ccccc1 11a_100000747479_100009813364 [0,0,1,0,0,1|2,0,0]=4 26 B18R1.21066 C=C(Br)C(=O)NCC(=O)NCCc1ccccc1 1626a_100000747479_100009813364 [0,0,1,0,0,1|2,0,0]=4 27 B18R1.21066 C=C(C)C(=O)NCC(=O)NCCc1ccccc1 11a_100000106460_100000076187 [0,0,1,0,0,1|2,0,0]=4 28 B18R1.21066 C=C(C)C(=O)NCC(=O)NCCc1ccccc1 11a_100000747479_100000185857 [0,0,1,0,0,1|2,0,0]=4 29 B18R1.21066 C=C(C)C(=O)NCC(=O)NCCc1ccccc1 1626a_100000747479_100000185857 [0,0,1,0,0,1|2,0,0]=4 30 B18R1.21066 C=C(C)C(=O)NCC(=O)NCCc1ccccc1 240690a_100000106460_100000076187 [0,0,1,0,0,1|2,0,0]=4 31 B18R1.21066 C=C(C)C(=O)NCC(=O)NCCc1ccccc1 527a_100000106460_100000076187 [0,0,1,0,0,1|2,0,0]=4 32 B18R1.21066 C=C(Cl)C(=O)NCC(=O)NCCc1ccccc1 11a_100000747479_100000039160 [0,0,1,0,0,1|2,0,0]=4 33 B18R1.21066 C=C(Cl)C(=O)NCC(=O)NCCc1ccccc1 1626a_100000747479_100000039160 [0,0,1,0,0,1|2,0,0]=4 34 B18R1.21066 C=C(F)C(=O)NCC(=O)NCCc1ccccc1 11a_100000747479_100000036797 [0,0,1,0,0,1|2,0,0]=4 35 B18R1.21066 C=C(F)C(=O)NCC(=O)NCCc1ccccc1 1626a_100000747479_100000036797 [0,0,1,0,0,1|2,0,0]=4 36 B18R1.21066 C[C@@H](O)C(=O)NCC(=O)NCCc1ccccc1 240690a_100000747479_100000717761 [0,0,1,0,0,1|1,0,1]=4 37 B18R1.21066 C[C@H](O)C(=O)NCC(=O)NCCc1ccccc1 1626a_100000747479_217856618621 [0,0,1,0,0,1|1,0,1]=4 38 B18R1.21066 C[C@H](O)C(=O)NCC(=O)NCCc1ccccc1 240690a_100000747479_217856618621 [0,0,1,0,0,1|1,0,1]=4 39 B18R1.21066 NC(=O)C(=O)NCC(=O)NCCc1ccccc1 240690a_100000747479_100011215815 [0,0,1,0,0,1|0,0,2]=4 40 B18R1.21066 NC(=O)C(=O)NNC(=O)NCCc1ccccc1 273464a_100000106460_100000211141 [0,0,1,0,0,1|0,0,2]=4 41 B18R1.21066 O=C(CNC(=O)C(O)O)NCCc1ccccc1 240690a_100000747479_100000233687 [0,0,1,0,0,1|1,0,1]=4 42 B18R2.4060 O=c1[nH]nc(c(=O)[nH]1)NCCc2ccccc2 27a_100000106460_100000181694 [1,0,0,0,0,1|2,0,0]=4 43 B18R2.4060 O=c1[nH]nc(c(=O)[nH]1)SCCc2ccccc2 62a_100000765856_100000181694 [1,0,0,0,0,1|2,0,0]=4 44 B18R2.6544 Cc1c[nH]c(=O)c(n1)SCCc2ccccc2 62a_100000765856_100009858157 [1,0,0,0,0,1|2,0,0]=4 45 B18R2.6544 Cc1c[nH]c(=O)c(n1)SCCc2ccccc2 62a_100009858157_100011218657 [1,0,0,0,0,1|2,0,0]=4