0 B7R0.4 C#CCCCN(C)C CS-0966989 [0,0,0,0,0,0|3,0,1]=4 1 B7R0.4 C#CCCNC(C)C CS-0850466 [0,0,0,0,0,0|3,0,1]=4 2 B7R0.4 C=CCCC[C@H](C)O CS-1049849 [0,0,0,0,0,0|3,0,0]=3 3 B6R0.4 C#CCCN(C)C CS-0966990 [1,0,0,0,0,0|2,0,1]=4 4 B6R0.4 CC(C)CCCN CS-0252871 [1,0,0,0,0,0|1,0,1]=3 5 B6R0.4 CNCCC(C)O CS-0459922 [1,0,0,0,0,0|2,0,1]=4 6 B6R0.4 CSCCC(C)O CS-0242060 [1,0,0,0,0,0|1,1,1]=4 7 B6R0.6 CCCCCCO CS-0076046 [1,0,0,0,0,0|1,0,2]=4 8 B8R0.28 CN(C)C\C=C/C(=O)O CS-0164231 [0,1,0,0,0,0|2,0,1]=4 9 B8R1.4 CC1CC(O)CCO1 CS-0051835 [0,0,0,1,0,0|2,0,1]=4 10 B8R1.4 CC1CCNC(=O)C1 CS-0052341 [0,0,0,1,0,0|1,0,0]=2 11 B8R1.4 C[C@@H]1CCC[C@H](N)C1 CS-0309584 [0,0,0,1,0,0|2,0,1]=4 12 B8R1.4 C[C@@H]1C[C@H](O)CCO1 CS-0472514 [0,0,0,1,0,0|2,0,1]=4 13 B8R1.7 CC(N)C1CCOC1 CS-0486993 [0,0,0,1,0,0|2,0,1]=4 14 B8R1.72 CC1(O)CC=CCC1 CS-0998568 [0,0,0,1,0,0|3,0,0]=4 15 B5R0.1 CC(F)CCN CS-0104778 [2,0,0,0,0,0|2,0,0]=4 16 B5R0.1 CCC[C@@H](C)O CS-0198768 [2,0,0,0,0,0|1,0,1]=4 17 B5R0.1 CN(C)CC=O CS-0114075 [2,0,0,0,0,0|1,0,0]=3 18 B5R0.1 C[S+](C)CCCl CS-0660802 [2,0,0,0,0,0|2,0,0]=4 19 B5R0.2 C=CCCCO CS-W011355 [2,0,0,0,0,0|2,0,0]=4 20 B7R0.3 C=CCC[C@@H](O)CCl CS-0374305 [1,1,0,0,0,0|2,0,0]=4 21 B7R0.5 COCC(=O)C(C)C CS-0310664 [1,1,0,0,0,0|0,0,2]=4 22 B7R0.6 CC(=O)NCC(C)O CS-0223956 [1,1,0,0,0,0|2,0,0]=4 23 B7R0.6 CC(C)CC[N+](=O)[O-] CS-0252338 [1,1,0,0,0,0|1,0,0]=3 24 B7R0.6 CC(C)CNC(N)=S CS-0463955 [1,1,0,0,0,0|1,1,0]=4 25 B7R0.6 C[C@H](N)CCC(=O)O CS-0753666 [1,1,0,0,0,0|1,0,0]=3 26 B7R0.1 C=CCCCCCO CS-0185704 [1,1,0,0,0,0|2,0,0]=4 27 B9R0.1 COC(=O)CCCC(C)Br CS-0884141 [0,2,0,0,0,0|2,0,0]=4 28 B9R0.7 CC(C)CC[C@H](N)C(=O)O CS-0154246 [0,2,0,0,0,0|1,0,0]=3 29 B9R0.56 CC(C)(C)OCCC(=O)O CS-0449701 [0,2,0,0,0,0|2,0,0]=4 30 B7R1.2 C[C@@H]1CC(=O)CN1 CS-0656263 [1,0,0,1,0,0|1,0,0]=3 31 B7R1.10 CNC1CC(C)C1 CS-0036338 [1,0,0,1,0,0|1,0,1]=4 32 B7R1.18 C[C@@H](O)C1COC1 CS-0309420 [1,0,0,1,0,0|1,0,1]=4 33 B7R1.4 O=C1NCCC1F CS-0467788 [1,0,0,1,0,0|2,0,0]=4 34 B9R1.48 O=C1CC(O)CCCN1 CS-0568375 [0,1,0,1,0,0|2,0,0]=4 35 B9R1.66 CC1(C)CNCC(=O)N1 CS-0185258 [0,1,0,1,0,0|2,0,0]=4 36 B9R1.2 CCC1CC(=O)CCN1 CS-0443395 [0,1,0,1,0,0|2,0,0]=4 37 B9R1.202 CC1(CO)CCNC1=O CS-0371485 [0,1,0,1,0,0|1,0,0]=3 38 B9R1.35 CC1CCC(C(=O)O)C1 CS-0217541 [0,1,0,1,0,0|1,0,0]=3 39 B9R1.35 CN1CCC(C(=O)O)C1 CS-0058763 [0,1,0,1,0,0|2,0,0]=4 40 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)O1 CS-0035602 [0,1,0,1,0,0|2,0,0]=4 41 B9R1.35 O=C(O)[C@H]1CC[C@H](O)C1 CS-0340668 [0,1,0,1,0,0|2,0,0]=4 42 B9R1.106 CC1(C)C(=O)NC[C@@H]1N CS-0053186 [0,1,0,1,0,0|1,0,0]=3 43 B9R1.10 CC1(C)CC=C(Br)CC1 CS-0195421 [0,1,0,1,0,0|2,0,0]=4