0 B13R2.4825 c1cc2c(c(c1)Br)NC(=O)C2=O A2Z00094242 [0,0,0,0,0,0|1,1,1]=3 1 B12R2.18 CC1c2ccccc2NC1=O A2Z00049804 [1,0,0,0,0,0|2,0,0]=3 2 B12R2.18 Cc1c(c2ccccc2[nH]1)Br A2Z00061785 [1,0,0,0,0,0|3,0,0]=4 3 B12R2.18 Cc1c(c2ccccc2[nH]1)I A2Z00061802 [1,0,0,0,0,0|3,0,0]=4 4 B12R2.18 Cc1cc2ccccc2n1C A2Z00049652 [1,0,0,0,0,0|3,0,0]=4 5 B12R2.18 Cn1c2ccccc2[nH]c1=O A2Z00085448 [1,0,0,0,0,0|1,0,0]=2 6 B12R2.196 Cn1ccc2c1cccc2N A2Z00087603 [1,0,0,0,0,0|3,0,0]=4 7 B12R2.202 Cc1cc2c([nH]1)cccc2O A2Z00096183 [1,0,0,0,0,0|3,0,0]=4 8 B12R2.202 Cc1cc2c(cccc2[nH]1)N A2Z00096014 [1,0,0,0,0,0|3,0,0]=4 9 B12R2.202 c1cc(c2c(c1)[nH]c(=O)o2)N A2Z00046404 [1,0,0,0,0,0|2,0,0]=3 10 B12R2.202 c1cc(c2c(c1)oc(=O)[nH]2)N A2Z00070298 [1,0,0,0,0,0|2,0,0]=3 11 B12R2.202 c1cc(c2c(c1)sc(n2)Cl)F A2Z00074054 [1,0,0,0,0,0|2,0,1]=4 12 B12R2.202 c1cc2c(c(c1)Br)NC(=O)C2 A2Z00074262 [1,0,0,0,0,0|1,1,0]=3 13 B12R2.202 c1cc2c(c(c1)Cl)CC(=O)N2 A2Z00095173 [1,0,0,0,0,0|1,1,0]=3 14 B12R2.202 c1cc2c(c(c1)Cl)NC(=O)C2 A2Z00098390 [1,0,0,0,0,0|1,1,0]=3 15 B14R2.4220 c1cc/2c(c(c1)Br)NC(=O)\C2=C/O A2Z00095531 [0,1,0,0,0,0|1,1,0]=3 16 B14R2.4220 c1cc/2c(c(c1)Br)NC(=O)\C2=N/N A2Z00095534 [0,1,0,0,0,0|2,1,0]=4 17 B14R2.8620 Cc1ccc(c2c1NC(=O)C2=O)Cl A2Z00061679 [0,1,0,0,0,0|2,0,1]=4 18 B14R2.9184 Cc1cc(cc2c1NC(=O)C2=O)Br A2Z00058026 [0,1,0,0,0,0|2,0,1]=4 19 B14R2.9184 Cc1cc2c(c(c1)Br)NC(=O)C2=O A2Z00061680 [0,1,0,0,0,0|1,1,1]=4 20 B12R1.371 COC(=O)Cc1ccccc1F A2Z00095983 [0,0,1,0,0,0|3,0,0]=4 21 B14R2.8038 CN1c2cccc(c2OCC1=O)N A2Z00050049 [0,0,0,0,0,1|3,0,0]=4 22 B11R1.159 c1cc(c(c(c1)Br)N)C(=O)O A2Z00097432 [1,0,1,0,0,0|1,1,0]=4 23 B11R1.159 c1cc(c(c(c1)Cl)N)C(=O)O A2Z00061682 [1,0,1,0,0,0|1,1,0]=4 24 B11R1.159 c1cc(c(c(c1)F)Br)C(=O)O A2Z00096365 [1,0,1,0,0,0|2,0,0]=4 25 B11R1.159 c1cc(c(c(c1)F)N)C(=O)O A2Z00097431 [1,0,1,0,0,0|1,0,0]=3 26 B11R1.36 CC(=O)C(c1ccccc1)O A2Z00049601 [1,0,1,0,0,0|2,0,0]=4 27 B11R1.40 c1ccc(cc1)NC(=O)CN A2Z00044283 [1,0,1,0,0,0|2,0,0]=4 28 B11R1.40 c1ccc(cc1)NC(=O)CO A2Z00068359 [1,0,1,0,0,0|1,0,0]=3 29 B11R1.86 Cc1ccccc1NC(=N)N A2Z00074248 [1,0,1,0,0,0|2,0,0]=4 30 B11R1.86 c1ccc(c(c1)CC(=O)O)F A2Z00061208 [1,0,1,0,0,0|1,0,0]=3 31 B11R2.1 c1ccc2c(c1)c(n[nH]2)O A2Z00061517 [2,0,0,0,0,0|2,0,0]=4 32 B11R2.10 c1cc2c([nH]c(=O)o2)nc1 A2Z00069818 [2,0,0,0,0,0|2,0,0]=4 33 B11R2.10 c1ccc2c(c1)[nH]c(n2)Cl A2Z00074312 [2,0,0,0,0,0|1,0,1]=4 34 B13R1.202 C[C@@H](C(=O)Nc1ccccc1F)N A2Z00044984 [0,1,1,0,0,0|2,0,0]=4 35 B13R2.135 CCN1c2ccccc2CC1=O A2Z00074116 [1,1,0,0,0,0|2,0,0]=4 36 B13R2.135 CCn1c2ccccc2oc1=O A2Z00048030 [1,1,0,0,0,0|2,0,0]=4 37 B13R2.359 CC1(c2ccccc2NC1=O)C A2Z00048073 [1,1,0,0,0,0|2,0,0]=4 38 B13R2.3028 CC1c2cc(ccc2NC1=O)Br A2Z00048132 [1,1,0,0,0,0|2,0,0]=4 39 B13R2.3028 CC1c2cc(ccc2NC1=O)N A2Z00047978 [1,1,0,0,0,0|2,0,0]=4 40 B13R2.3028 Cn1c2cc(ccc2oc1=O)N A2Z00046406 [1,1,0,0,0,0|2,0,0]=4 41 B13R2.3028 c1cc2c(cc1Br)C(=O)C(=O)N2 A2Z00097333 [1,1,0,0,0,0|1,0,1]=4 42 B13R2.3028 c1cc2c(cc1Cl)C(=O)C(=O)N2 A2Z00030680 [1,1,0,0,0,0|1,0,1]=4 43 B13R2.3085 CN1c2ccccc2C(=O)C1=O A2Z00077108 [1,1,0,0,0,0|1,0,1]=4 44 B13R2.5190 Cn1c2ccc(cc2oc1=O)N A2Z00046407 [1,1,0,0,0,0|2,0,0]=4 45 B13R2.5397 Cc1cc2c(c(c1)Br)oc(=O)[nH]2 A2Z00049367 [1,1,0,0,0,0|1,1,0]=4 46 B13R2.162 c1cc(c2c(c1)OCC(=O)N2)N A2Z00048053 [0,0,1,1,0,0|2,0,0]=4 47 B13R2.32 CN1c2ccccc2CCC1=O A2Z00049373 [1,0,0,0,0,1|2,0,0]=4 48 B13R2.328 c1ccc2c(c1)c(=O)[nH]c(=O)[nH]2 A2Z00061300 [1,0,0,0,0,1|1,0,1]=4 49 B13R2.328 c1ccc2c(c1)c(cc(=O)[nH]2)O A2Z00061526 [1,0,0,0,0,1|1,0,0]=3