0 B8R1.7 CC(=O)C1=CC=CO1 HY-W015912 [0,0,0,0,0,0|1,1,2]=4 1 B8R1.7 CC(=O)C1=CC=CS1 HY-20585 [0,0,0,0,0,0|1,0,2]=3 2 B8R1.7 CC(=O)C1=CSC=C1 HY-W007361 [0,0,0,0,0,0|3,0,1]=4 3 B8R1.7 CC(=O)C1=NC=CS1 HY-Y0045 [0,0,0,0,0,0|0,0,2]=2 4 B8R1.7 NC(=O)[C@@H]1CCCN1 HY-20582 [0,0,0,0,0,0|2,0,2]=4 5 B8R1.7 NC(=O)[C@@H]1CCCN1 HY-W017413 [0,0,0,0,0,0|2,0,2]=4 6 B8R1.7 NC(=O)[C@H]1CCCN1 HY-W012921 [0,0,0,0,0,0|2,0,2]=4 7 B8R1.7 O=C(O)C1=CC=NS1 HY-W042027 [0,0,0,0,0,0|3,0,1]=4 8 B8R1.7 O=C(O)C1=CCCC1 HY-W005540 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.7 O=C(O)C1=CSC=N1 HY-59320 [0,0,0,0,0,0|3,0,1]=4 10 B8R1.7 O=C(O)C1=NNC=C1 HY-W002328 [0,0,0,0,0,0|3,0,1]=4 11 B8R1.7 O=C(O)C1CCCN1 HY-W012908 [0,0,0,0,0,0|2,0,2]=4 12 B8R1.7 O=C(O)[C@@H]1CCCN1 HY-WAA0253 [0,0,0,0,0,0|2,0,2]=4 13 B8R1.7 O=C(O)[C@@H]1CCCN1 HY-Y0252 [0,0,0,0,0,0|2,0,2]=4 14 B8R1.7 O=C(O)[C@@H]1CCCN1 HY-Y0252R [0,0,0,0,0,0|2,0,2]=4 15 B8R1.7 O=C(O)[C@H]1CCCN1 HY-75087 [0,0,0,0,0,0|2,0,2]=4 16 B8R1.7 O=C(O)[C@H]1CCCO1 HY-W005223 [0,0,0,0,0,0|2,1,1]=4 17 B7R1.1 O=CC1=CC=CS1 HY-W012941 [1,0,0,0,0,0|1,0,2]=4 18 B7R1.1 O=CC1=CN=CS1 HY-69015 [1,0,0,0,0,0|2,0,1]=4 19 B7R1.1 O=CC1=CNC=N1 HY-59303 [1,0,0,0,0,0|2,0,1]=4 20 B7R1.1 O=CC1=NC=CN1 HY-W007321 [1,0,0,0,0,0|1,0,2]=4 21 B9R1.11 COC(=O)[C@@H]1CCCN1 HY-76134 [0,1,0,0,0,0|1,0,2]=4 22 B9R1.11 O=C(NO)C1=CCCC1 HY-117554 [0,1,0,0,0,0|3,0,0]=4 23 B9R1.35 CC(=O)C1=CC=C(C)S1 HY-W002097 [0,1,0,0,0,0|1,0,2]=4 24 B7R0.4 CCC\C=C\C(=O)O HY-W010531 [0,0,1,0,0,0|3,0,0]=4 25 B7R0.4 O=C(O)COCCS HY-140730 [0,0,1,0,0,0|2,0,1]=4 26 B7R0.5 CCCC(=O)C(=O)O HY-113098 [0,0,1,0,0,0|2,1,0]=4 27 B7R0.5 CCOC(=O)C(C)=O HY-Y1362 [0,0,1,0,0,0|1,1,0]=3 28 B7R0.5 CC\C=C(/C)C(=O)O HY-W010533 [0,0,1,0,0,0|3,0,0]=4 29 B7R0.15 COC(OC)C(C)=O HY-Y0872 [0,0,1,0,0,0|1,1,1]=4 30 B7R1.18 O=C(O)[C@@H]1CCN1 HY-W050044 [0,0,0,0,1,0|1,0,2]=4 31 B7R1.18 O=C(O)[C@H]1CCN1 HY-W017755 [0,0,0,0,1,0|1,0,2]=4 32 B9R1.6 CC(=O)C1=CN=CC=N1 HY-W007692 [0,0,0,0,0,1|1,0,2]=4 33 B9R1.6 O=C(O)C1=CCCNC1 HY-100809 [0,0,0,0,0,1|2,0,1]=4 34 B9R1.6 O=C(O)C1=CCCNC1 HY-N2482A [0,0,0,0,0,1|2,0,1]=4 35 B9R1.6 O=C(O)C1=CCNCC1 HY-100810 [0,0,0,0,0,1|3,0,0]=4 36 B9R1.13 O=[N+]([O-])NC1=NCCN1 HY-W111370 [0,0,0,0,0,1|3,0,0]=4 37 B6R0.4 CC\C=C\C(=O)O HY-W061674 [1,0,1,0,0,0|2,0,0]=4 38 B6R0.6 CCC\C=C\C=O HY-128429 [1,0,1,0,0,0|2,0,0]=4 39 B6R0.3 CC(=O)\C(C)=N\O HY-Y0413 [1,0,1,0,0,0|1,0,0]=3 40 B6R0.3 CCC(=O)C(=O)O HY-W007926 [1,0,1,0,0,0|1,1,0]=4 41 B6R0.3 CCC(=O)C(=O)O HY-W007926R [1,0,1,0,0,0|1,1,0]=4 42 B6R0.3 CCC(=O)C(C)=O HY-W012998 [1,0,1,0,0,0|0,1,0]=3 43 B6R0.3 CON(C)C(C)=O HY-W001095 [1,0,1,0,0,0|1,1,0]=4 44 B6R0.3 C\C=C(/C)C(=O)O HY-W012999 [1,0,1,0,0,0|2,0,0]=4 45 B6R1.2 N=C1CCCS1 HY-W015798 [2,0,0,0,0,0|2,0,0]=4 46 B6R1.2 O=C1NCCN1 HY-W031536 [2,0,0,0,0,0|1,0,1]=4 47 B6R1.2 SC1=NCCN1 HY-W010593 [2,0,0,0,0,0|1,1,0]=4 48 B8R0.3 CCCC(=O)C(=O)OC HY-W127546 [0,1,1,0,0,0|1,1,0]=4 49 B8R1.5 O=C1CCCCC1=O HY-W007347 [0,0,1,1,0,0|1,1,0]=4 50 B6R1.11 O=C(O)C1CC1 HY-Y0001 [0,0,0,0,2,0|1,0,1]=4