0 B20R3.671153 CC(=O)Nc1cc2ccccc2c3ccccc31 Amb24072658 [0,0,0,0,0,0|2,0,0]=2 1 B20R3.671153 NC(=O)Cc1cc2ccccc2c3ccccc31 Amb20411499 [0,0,0,0,0,0|2,0,0]=2 2 B20R3.671153 NC(=S)Nc1cc2ccccc2c3c1cccc3 Amb2407101 [0,0,0,0,0,0|1,0,0]=1 3 B20R3.671153 OC(=O)Cc1cc2ccccc2c3ccccc31 Amb20411498 [0,0,0,0,0,0|3,0,0]=3 4 B19R3.142008 N#CCc1cc2ccccc2c3ccccc31 Amb20411496 [1,0,0,0,0,0|1,0,2]=4 5 B21R3.9534009 COC(=O)Cc1cc2ccccc2c3ccccc31 Amb20411500 [0,1,0,0,0,0|3,0,0]=4 6 B21R4.439372 CC=1Cc2c3ccccc3c4ccccc4c2C1 Amb22729525 [0,0,0,1,0,0|3,0,0]=4 7 B21R4.439372 Cn1nc2c(n1)c3ccccc3c4c2cccc4 Amb10561724 [0,0,0,1,0,0|2,0,1]=4 8 B19R3.631815 CC(=O)NC1c2ccccc2-c3ccccc31 Amb22339489 [0,0,0,0,1,0|2,0,1]=4 9 B19R3.631815 NC(=O)Cn1c2ccccc2c3c1cccc3 Amb11037425 [0,0,0,0,1,0|3,0,0]=4 10 B19R3.657184 FC(F)c1cc2ccccc2c3ccccc31 Amb20669798 [0,0,0,0,1,0|2,0,1]=4 11 B19R3.657184 NC(=S)c1cc2ccccc2c3ccccc31 Amb22048236 [0,0,0,0,1,0|1,0,0]=2 12 B19R3.657184 OC(=O)c1cc2ccccc2c3c1nccc3 Amb1119751 [0,0,0,0,1,0|3,0,0]=4 13 B19R3.657184 OC(=O)c1cc2ccccc2c3ccccc13 Amb17777297 [0,0,0,0,1,0|2,0,0]=3 14 B19R3.657184 [O-][N+](=O)c1cc2ccccc2c3ccccc13 Amb22733255 [0,0,0,0,1,0|3,0,0]=4 15 B21R3.7888781 CC(=O)OCc1cc2ccccc2c3ccccc31 Amb20411495 [0,0,0,0,0,1|3,0,0]=4 16 B18R2.4115 NC(=S)NNc1ccccc1c2ccccc2 Amb2407077 [1,0,1,0,0,0|2,0,0]=4 17 B18R3.159486 C#Cc1cc2ccccc2c3ccccc31 Amb22230199 [2,0,0,0,0,0|1,0,1]=4 18 B18R3.159486 C=Cc1cc2ccccc2c3c1cccc3 Amb17621274 [2,0,0,0,0,0|1,0,0]=3 19 B18R3.159486 ClCc1cc2ccccc2c3c1cccc3 Amb17610986 [2,0,0,0,0,0|1,0,1]=4 20 B18R3.159486 I[Zn]c1cc2ccccc2c3ccccc31 Amb22000448 [2,0,0,0,0,0|2,0,0]=4 21 B18R3.159486 O=Cc1[n]c2ccccc2c3ccccc31 Amb23591046 [2,0,0,0,0,0|2,0,0]=4 22 B18R3.159486 OCc1cc2ccccc2c3ccccc31 Amb20411494 [2,0,0,0,0,0|1,0,1]=4 23 B20R2.10722 NC(=N)NC(=N)Nc1ccccc1-c2ccccc2 Amb19737287 [0,1,1,0,0,0|1,0,0]=3 24 B20R3.5966 OC(=O)c1cc2ccccc2c3cc(Br)ccc31 Amb22394976 [0,1,0,0,1,0|2,0,0]=4 25 B22R3.19456 NC(=O)N\N=C/1\C(=O)c2ccccc2c3c1cccc3 Amb10561782 [0,1,0,0,0,1|1,0,0]=3 26 B22R3.19456 NC(=O)N\N=C\1/C(=O)c2ccccc2c3c1cccc3 Amb10561728 [0,1,0,0,0,1|1,0,0]=3 27 B22R3.19456 NC(=S)N\N=C/1\C(=O)c2ccccc2c3c1cccc3 Amb16755564 [0,1,0,0,0,1|1,0,0]=3 28 B22R3.19456 NC(=S)N\N=C\1/C(=O)c2ccccc2-c3ccccc31 Amb19815146 [0,1,0,0,0,1|1,0,0]=3 29 B20R3.11933 Cc1nc(c([nH]1)c2ccccc2)c3ccccc3 Amb1771871 [0,0,1,1,0,0|1,0,0]=3 30 B20R3.11933 Cc1nc(c(s1)c2ccccc2)c3ccccc3 Amb1255193 [0,0,1,1,0,0|2,0,0]=4 31 B20R3.11933 Clc1nc(c([nH]1)c2ccccc2)c3ccccc3 Amb13777385 [0,0,1,1,0,0|1,0,0]=3 32 B20R3.11933 N=C1NC(=C(S1)c2ccccc2)c3ccccc3 Amb19918582 [0,0,1,1,0,0|1,0,0]=3 33 B20R3.11933 Nc1cc(-c2ccccc2)[n]([n]1)-c3ccccc3 Amb22458365 [0,0,1,1,0,0|2,0,0]=4 34 B20R3.11933 Nc1nc([n+](s1)c2ccccc2)c3ccccc3 Amb1286455 [0,0,1,1,0,0|2,0,0]=4 35 B20R3.11933 Nc1nc(c(o1)c2ccccc2)c3ccccc3 Amb1150995 [0,0,1,1,0,0|1,0,0]=3 36 B20R3.11933 Nc1nc(c(s1)c2ccccc2)c3ccccc3 Amb1254110 [0,0,1,1,0,0|1,0,0]=3 37 B20R3.11933 Nc1nc(c(s1)c2ccccc2)c3cccnc3 Amb17320959 [0,0,1,1,0,0|2,0,0]=4 38 B20R3.11933 O=C1NC(=C(N1)c2ccccc2)c3ccccc3 Amb20001463 [0,0,1,1,0,0|1,0,0]=3 39 B20R3.11933 O=C1NC(=C(O1)c2ccccc2)c3ccccc3 Amb19204314 [0,0,1,1,0,0|2,0,0]=4 40 B20R3.11933 O=c1oc(c([nH]1)c2ccccc2)c3ccccc3 Amb1152235 [0,0,1,1,0,0|2,0,0]=4 41 B20R3.11933 Oc1[n]c(c(o1)-c2ccccc2)-c3ccccc3 Amb22653380 [0,0,1,1,0,0|2,0,0]=4 42 B20R3.11933 S=C1NC(=C(N1)c2ccccc2)c3ccccc3 Amb19650900 [0,0,1,1,0,0|1,0,0]=3 43 B20R3.11933 S=C1NC(=C(O1)c2ccccc2)c3ccccc3 Amb19394423 [0,0,1,1,0,0|2,0,0]=4 44 B20R3.11933 S=C1NC(=C(S1)c2ccccc2)c3ccccc3 Amb22482069 [0,0,1,1,0,0|2,0,0]=4 45 B20R3.11933 S=C1NN(C(=N1)c2ccccc2)c3ccccc3 Amb19813291 [0,0,1,1,0,0|2,0,0]=4 46 B20R3.11933 S=c1nc(n([nH]1)c2ccccc2)c3ccccc3 Amb1043258 [0,0,1,1,0,0|2,0,0]=4 47 B20R3.11933 S=c1oc(c([nH]1)c2ccccc2)c3ccccc3 Amb1159082 [0,0,1,1,0,0|2,0,0]=4 48 B20R3.8685 Nc1[n]c2cccc(c2c(N)[n]1)-c3ccccc3 Amb22442550 [0,0,1,1,0,0|1,0,1]=4 49 B20R3.15842 NC(=N)N1Cc2ccccc2-c3ccccc3C1 Amb22464080 [0,0,1,1,0,0|0,0,2]=4 50 B20R3.651490 NC(=S)NN=C1c2ccccc2c3c1cccc3 Amb1011385 [0,0,1,1,0,0|2,0,0]=4 51 B20R4.41588 C1C=Cc2c1c3ccccc3c4ccccc42 Amb22730738 [1,0,0,1,0,0|2,0,0]=4 52 B20R4.41588 c1[n]c2c([s]1)c3ccccc3c4ccccc42 Amb24310353 [1,0,0,1,0,0|1,0,0]=3 53 B20R4.41588 c1c[n]2c([n]1)c3ccccc3c4ccccc24 Amb22301512 [1,0,0,1,0,0|2,0,0]=4 54 B20R4.41588 c1ccc2c(c1)c3ccccc3c4c2n[nH]n4 Amb10561730 [1,0,0,1,0,0|1,0,1]=4 55 B20R4.41588 c1ccc2c(c1)c3ccccc3c4c2ocn4 Amb2223009 [1,0,0,1,0,0|1,0,0]=3 56 B22R4.230959 Cc1c[n]c2c([n]1)c3ccccc3c4ccccc42 Amb22002348 [0,0,0,1,0,1|1,0,1]=4 57 B22R4.230959 Oc1nnc2c(n1)c3ccccc3c4c2cccc4 Amb10561729 [0,0,0,1,0,1|1,0,1]=4 58 B18R2.4111 NC(=N)N(Cc1ccccc1)c2ccccc2 Amb22440559 [0,0,1,0,1,0|1,0,1]=4 59 B18R2.4111 OC(=O)\C(=C/c1ccccc1)\c2ccccc2 Amb1208859 [0,0,1,0,1,0|2,0,0]=4 60 B18R2.4111 OC(=O)\C(=C\c1ccccc1)\c2ccccc2 Amb1933695 [0,0,1,0,1,0|2,0,0]=4 61 B18R2.7184 NC(=N)NC(c1ccccc1)c2ccccc2 Amb22464027 [0,0,1,0,1,0|0,0,1]=3 62 B18R2.7184 NC(=N)SC(c1ccccc1)c2ccccc2 Amb17621801 [0,0,1,0,1,0|1,0,1]=4 63 B18R2.7184 NC(=S)NN(c1ccccc1)c2ccccc2 Amb2419058 [0,0,1,0,1,0|2,0,0]=4 64 B18R3.68117 O=CNC1c2ccccc2c3c1cccc3 Amb2234009 [1,0,0,0,1,0|1,0,1]=4 65 B18R3.993175 NC(=O)C1c2ccccc2-c3ccccc31 Amb22754361 [0,0,0,0,2,0|1,0,1]=4 66 B20R2.2591 NC(=N)NC(Nc1ccccc1)=Nc2ccccc2 Amb22466935 [0,0,1,0,0,1|1,0,0]=3 67 B20R2.10559 NC(=N)NCC(Cc1ccccc1)c2ccccc2 Amb25022889 [0,0,1,0,0,1|0,0,2]=4 68 B22R3.16170584 NC(=O)CSC1=Cc2ccccc2Cc3ccccc31 Amb22455688 [0,0,0,0,0,2|2,0,0]=4