0 B6R0.3 C(C(=O)C(Cl)Cl)Cl A2Z00096114 [0,0,0,0,0,0|4,0,0]=4 1 B6R0.3 CC(C(=O)NC)N A2Z00049855 [0,0,0,0,0,0|2,0,0]=2 2 B6R0.3 CC(C)C(=O)CO A2Z00049695 [0,0,0,0,0,0|2,0,0]=2 3 B6R0.3 CC(C)C(C#N)N A2Z00094740 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.3 COC(=O)C(=N)N A2Z00096235 [0,0,0,0,0,0|2,0,1]=3 5 B5R0.1 CC(C)CCBr A2Z00093551 [1,0,0,0,0,0|2,0,1]=4 6 B5R0.1 CC(C)C[N+]#[C-] A2Z00050390 [1,0,0,0,0,0|1,0,2]=4 7 B5R0.3 C(C(=O)C=O)O A2Z00050060 [1,0,0,0,0,0|3,0,0]=4 8 B5R0.3 CCN(CC)N A2Z00049169 [1,0,0,0,0,0|3,0,0]=4 9 B5R0.3 COC(=O)C#N A2Z00050483 [1,0,0,0,0,0|1,0,1]=3 10 B5R0.3 COC(=O)C=C A2Z00093487 [1,0,0,0,0,0|0,0,2]=3 11 B5R0.3 COC(=O)CI A2Z00098171 [1,0,0,0,0,0|1,0,0]=2 12 B5R0.5 CC(=O)N(C)N A2Z00094878 [1,0,0,0,0,0|2,0,0]=3 13 B5R0.5 CC(C(=O)C)Cl A2Z00093500 [1,0,0,0,0,0|1,0,0]=2 14 B5R0.5 CC(C(=O)N)Cl A2Z00098040 [1,0,0,0,0,0|2,0,0]=3 15 B5R0.5 CN(C)C(=O)Cl A2Z00096010 [1,0,0,0,0,0|2,0,0]=3 16 B7R0.5 CC(C)C(CCN)O A2Z00049172 [0,1,0,0,0,0|1,0,2]=4 17 B7R0.5 CCOC(=O)C(=S)N A2Z00085493 [0,1,0,0,0,0|2,0,1]=4 18 B7R0.5 CCOC(=O)C(C)Br A2Z00093565 [0,1,0,0,0,0|1,0,0]=2 19 B7R0.10 CCC(C(=O)OC)Br A2Z00096125 [0,1,0,0,0,0|1,0,0]=2 20 B7R0.10 CCC(C(=O)OC)N A2Z00098004 [0,1,0,0,0,0|1,0,0]=2 21 B7R0.10 COC(=O)C(CO)N A2Z00085507 [0,1,0,0,0,0|1,0,0]=2 22 B7R0.10 COC(=O)C(CS)N A2Z00096121 [0,1,0,0,0,0|1,0,0]=2 23 B7R0.14 CC(C)(C(=O)OC)N A2Z00050180 [0,1,0,0,0,0|0,0,0]=1 24 B7R0.15 CC(C(OC)OC)O A2Z00096673 [0,1,0,0,0,0|1,0,2]=4 25 B7R0.16 BN(C(C)C)C(C)C A2Z00095533 [0,1,0,0,0,0|3,0,0]=4 26 B7R0.16 CC(C)C(=C)C(=O)O A2Z00049593 [0,1,0,0,0,0|3,0,0]=4 27 B7R0.2 CC(=O)CC(=O)OC A2Z00093511 [0,0,0,0,0,1|1,0,1]=3 28 B7R0.2 CC(C)NC(=O)CCl A2Z00099276 [0,0,0,0,0,1|2,0,0]=3 29 B7R0.2 COC(=O)CC(=O)Cl A2Z00050191 [0,0,0,0,0,1|2,0,1]=4 30 B4R0.1 C(C(=O)Cl)Cl A2Z00093506 [2,0,0,0,0,0|2,0,0]=4 31 B4R0.1 CC(=O)CO A2Z00094832 [2,0,0,0,0,0|1,0,0]=3 32 B4R0.1 CC(C)CBr A2Z00038648 [2,0,0,0,0,0|1,0,1]=4 33 B4R0.1 CCC(=O)N A2Z00097941 [2,0,0,0,0,0|1,0,0]=3 34 B4R0.1 COC(=O)Cl A2Z00093492 [2,0,0,0,0,0|1,0,0]=3 35 B4R0.1 C[C@@H](CO)N A2Z00045067 [2,0,0,0,0,0|1,0,1]=4 36 B6R0.2 CC(C)NC(C)C A2Z00095976 [1,1,0,0,0,0|2,0,0]=4 37 B6R0.4 CC(=O)\C=C\OC A2Z00096533 [1,1,0,0,0,0|1,0,1]=4 38 B6R0.4 CC(C)OCCN A2Z00047141 [1,1,0,0,0,0|2,0,0]=4 39 B6R0.4 CCCNC(C)C A2Z00048056 [1,1,0,0,0,0|1,0,1]=4 40 B6R0.5 CC(C)(C)CNC A2Z00049170 [1,1,0,0,0,0|1,0,1]=4 41 B6R0.8 COS(=O)(=O)OC A2Z00093525 [1,1,0,0,0,0|2,0,0]=4 42 B6R0.7 C(=O)(C(F)(F)F)O A2Z00096362 [1,1,0,0,0,0|2,0,0]=4 43 B6R0.7 CC(C)(C(=O)N)Br A2Z00070347 [1,1,0,0,0,0|1,0,0]=3 44 B6R0.7 CC(C)C(C)(C)N A2Z00047867 [1,1,0,0,0,0|1,0,1]=4 45 B6R0.7 CC(C)S(=O)(=O)N A2Z00094821 [1,1,0,0,0,0|1,0,1]=4 46 B8R0.5 CC(C)NC(=O)CC#N A2Z00098320 [0,1,0,0,0,1|1,0,1]=4 47 B8R0.5 CC(C)NC(=O)CCBr A2Z00098002 [0,1,0,0,0,1|1,0,0]=3 48 B8R0.19 CCC(C)NC(=O)CCl A2Z00067385 [0,1,0,0,0,1|2,0,0]=4 49 B8R0.19 CCC(CC(=O)OC)N A2Z00050344 [0,1,0,0,0,1|1,0,0]=3 50 B8R0.19 COC(=O)CC(CN)N A2Z00050464 [0,1,0,0,0,1|1,0,0]=3 51 B8R0.23 CC(C)OC(=O)C(C)Br A2Z00038719 [0,1,0,0,0,1|1,0,0]=3 52 B8R0.24 CC(C)(C)NC(=O)CCl A2Z00083442 [0,1,0,0,0,1|2,0,0]=4 53 B8R0.24 CC(C)(C)OC(=O)CBr A2Z00096128 [0,1,0,0,0,1|2,0,0]=4 54 B8R0.3 CCOC(=O)C(C)CCl A2Z00095050 [0,2,0,0,0,0|0,0,0]=2 55 B8R0.8 CC(C(=O)NCCO)Cl A2Z00094592 [0,2,0,0,0,0|2,0,0]=4 56 B8R0.12 CC(C)S(=O)(=O)CCO A2Z00048068 [0,2,0,0,0,0|2,0,0]=4 57 B8R0.14 CC(C)(C)C(=O)CC#N A2Z00094180 [0,2,0,0,0,0|1,0,1]=4 58 B8R0.14 CCOC(=O)C(C)(C)Br A2Z00093578 [0,2,0,0,0,0|0,0,0]=2 59 B8R1.40 C1CC1NC(=O)CN A2Z00044968 [0,0,0,1,0,1|2,0,0]=4 60 B8R1.51 CC1(CC(=O)OC1)C A2Z00096652 [0,0,0,1,0,1|0,0,0]=2 61 B8R1.51 CC1(CCC(=O)C1)C A2Z00096352 [0,0,0,1,0,1|1,0,0]=3 62 B8R1.5 CC1CCCCC1=O A2Z00038642 [0,1,0,1,0,0|1,0,0]=3 63 B8R1.19 CC1(C(=O)CCN1)C A2Z00050354 [0,1,0,1,0,0|1,0,0]=3 64 B8R2.38 C1C2C1C(=O)NC2 A2Z00050425 [0,0,0,2,0,0|1,0,0]=3