0 B7R0.3 CCCNC(=O)CCl BBS-00006591 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.3 CCCOC(=O)CCl BBS-00032534 [0,0,0,0,0,0|1,1,2]=4 2 B7R0.3 NCC(=O)OCCCl BBS-00032179 [0,0,0,0,0,0|2,1,1]=4 3 B6R0.1 CCNC(=O)CBr BBS-00032048 [1,0,0,0,0,0|2,0,1]=4 4 B6R0.1 CCOC(=O)CN BBS-00028667 [1,0,0,0,0,0|1,1,1]=4 5 B6R0.1 CCOC(=O)CS BBS-00028808 [1,0,0,0,0,0|1,1,1]=4 6 B6R0.1 CNC(=O)CC#N BBS-00019732 [1,0,0,0,0,0|2,0,1]=4 7 B6R0.1 CNCC(=O)NC BBS-00025000 [1,0,0,0,0,0|2,0,1]=4 8 B6R0.1 CNCC(=O)OC BBS-00020136 [1,0,0,0,0,0|2,0,1]=4 9 B6R0.1 COC(=O)CCN BBS-00022916 [1,0,0,0,0,0|2,0,1]=4 10 B6R0.4 C=CCNC(N)=S BBS-00020598 [1,0,0,0,0,0|2,1,0]=4 11 B6R0.4 C=CCSC(N)=[NH2+] BBS-00033196 [1,0,0,0,0,0|2,0,0]=3 12 B6R0.6 CC\C=C\CCC BBS-00038759 [1,0,0,0,0,0|1,0,2]=4 13 B6R0.6 CC\C=C\CCO BBS-00032560 [1,0,0,0,0,0|2,0,1]=4 14 B8R0.1 C=CCNC(=O)CC#N BBS-00006384 [0,1,0,0,0,0|1,0,1]=3 15 B8R0.9 COC(=O)CCC(=O)Cl BBS-00025939 [0,1,0,0,0,0|3,0,0]=4 16 B8R1.1 CSC1=NC(=O)CS1 BBS-00029580 [0,0,0,1,0,0|3,0,0]=4 17 B8R1.1 O=C1CC[C@H](CO)N1 BBS-00032709 [0,0,0,1,0,0|2,0,1]=4 18 B8R1.1 O=CC1CCC(=O)N1 BBS-00025921 [0,0,0,1,0,0|2,0,0]=3 19 B8R1.3 CC1=NNC(=O)CC1 BBS-00008246 [0,0,0,1,0,0|2,0,1]=4 20 B8R1.3 CC1CCC(=O)CC1 BBS-00038787 [0,0,0,1,0,0|1,0,2]=4 21 B8R1.3 O=C1CNC(=O)CN1 BBS-00016505 [0,0,0,1,0,0|3,0,0]=4 22 B8R1.5 CC1=CC=CNC1=O BBS-00002968 [0,0,0,1,0,0|1,0,2]=4 23 B8R1.22 O=C1CCCCCN1 BBS-00024238 [0,0,0,1,0,0|1,0,2]=4 24 B8R1.22 O=C1CCCNCC1 BBS-00032325 [0,0,0,1,0,0|2,0,1]=4 25 B8R1.50 CN1C(=O)CNC1=O BBS-00030354 [0,0,0,1,0,0|3,0,0]=4 26 B8R1.50 CN1C(=O)CSC1=S BBS-00036233 [0,0,0,1,0,0|2,1,0]=4 27 B5R0.1 CC(=O)\C=C/[O-] BBS-00032493 [2,0,0,0,0,0|1,0,1]=4 28 B5R0.2 C=CCN=C=O BBS-00026322 [2,0,0,0,0,0|1,0,1]=4 29 B5R0.2 CCSCCO BBS-00015661 [2,0,0,0,0,0|1,0,1]=4 30 B5R0.3 C=CC(=O)OC BBS-00004387 [2,0,0,0,0,0|1,0,0]=3 31 B5R0.3 CCC(=O)NN BBS-00028086 [2,0,0,0,0,0|2,0,0]=4 32 B5R0.3 CNC(=O)CBr BBS-00025180 [2,0,0,0,0,0|2,0,0]=4 33 B5R0.3 CNC(=O)NC BBS-00036243 [2,0,0,0,0,0|2,0,0]=4 34 B5R0.3 COC(=O)CN BBS-00028749 [2,0,0,0,0,0|1,1,0]=4 35 B5R0.3 C\N=C(/N)SC BBS-00029621 [2,0,0,0,0,0|2,0,0]=4 36 B5R0.3 O=C(CCl)CCl BBS-00020931 [2,0,0,0,0,0|2,0,0]=4 37 B7R0.2 COC(=O)CC(=N)N BBS-00021120 [1,1,0,0,0,0|2,0,0]=4 38 B7R0.5 CCOC(=O)C(C)Br BBS-00029301 [1,1,0,0,0,0|0,1,1]=4 39 B7R0.5 CCOC(=O)C(C)N BBS-00028471 [1,1,0,0,0,0|0,1,1]=4 40 B7R0.7 CCCC(=O)CCC BBS-00038797 [1,1,0,0,0,0|0,0,2]=4 41 B7R0.7 CCNC(=O)CC#N BBS-00038381 [1,1,0,0,0,0|1,0,1]=4 42 B7R0.7 CCNC(=O)CCN BBS-00032030 [1,1,0,0,0,0|1,0,1]=4 43 B7R0.7 CCOC(=O)CCN BBS-00027448 [1,1,0,0,0,0|0,1,1]=4 44 B7R0.7 CCOC(=O)CNC BBS-00025572 [1,1,0,0,0,0|0,1,1]=4 45 B7R0.7 CCOC(=O)CNN BBS-00024783 [1,1,0,0,0,0|2,0,0]=4 46 B7R0.6 CC(=O)CCC(C)=O BBS-00004255 [1,1,0,0,0,0|1,0,1]=4 47 B7R0.6 CC(=O)NCC(=O)O BBS-00027759 [1,1,0,0,0,0|2,0,0]=4 48 B9R0.1 CCC(=O)NCCC(=O)O BBS-00021059 [0,2,0,0,0,0|1,0,1]=4 49 B9R0.46 C=CCNCCC(=O)OC BBS-00024386 [0,2,0,0,0,0|2,0,0]=4 50 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O BBS-00034097 [0,2,0,0,0,0|2,0,0]=4 51 B7R1.1 CNC1=NC=CS1 BBS-00038724 [1,0,0,1,0,0|2,0,0]=4 52 B7R1.1 ClCC1=NC=CS1 BBS-00032836 [1,0,0,1,0,0|2,0,0]=4 53 B7R1.1 NCC1=CC=CS1 BBS-00003607 [1,0,0,1,0,0|2,0,0]=4 54 B7R1.2 NC1=CC(=O)CC1 BBS-00025192 [1,0,0,1,0,0|1,0,1]=4 55 B7R1.2 O=C1CCC(=O)N1 BBS-00004334 [1,0,0,1,0,0|2,0,0]=4 56 B7R1.3 O=C1C=COCC1 BBS-00032488 [1,0,0,1,0,0|1,0,1]=4 57 B7R1.3 O=C1CCCCN1 BBS-00039482 [1,0,0,1,0,0|1,0,1]=4 58 B7R1.3 O=C1CCSCC1 BBS-00036766 [1,0,0,1,0,0|1,0,1]=4 59 B7R1.4 NC1CCSC1=O BBS-00038427 [1,0,0,1,0,0|1,0,1]=4 60 B9R1.27 CCN1C(=O)CNC1=O BBS-00017718 [0,1,0,1,0,0|2,0,0]=4 61 B9R1.27 CCN1C(=O)CSC1=S BBS-00033086 [0,1,0,1,0,0|1,1,0]=4 62 B9R1.11 NCC(=O)C1=CC=CS1 BBS-00025037 [0,1,0,1,0,0|1,0,1]=4 63 B9R1.11 O=C(CBr)C1=CC=CS1 BBS-00021215 [0,1,0,1,0,0|1,0,1]=4