0 B5R0.5 CC(C)C(C)O 2102-1-03 [0,0,0,0,0,0|0,1,0]=1 1 B4R0.1 CC(N)C#N 3137-1-0B [1,0,0,0,0,0|2,0,1]=4 2 B4R0.1 CC(N)CF 3130-7-09 [1,0,0,0,0,0|2,0,0]=3 3 B4R0.1 CNC(C)=S 7167-1-41 [1,0,0,0,0,0|1,0,2]=4 4 B6R0.3 CNC(C)C(C)C 3131-1-0B [0,1,0,0,0,0|1,0,0]=2 5 B6R0.7 C[C@H](N)C(C)(C)O 4156-1-63 [0,1,0,0,0,0|1,0,0]=2 6 B6R1.4 N[C@@H]1CC[C@@H]1O 4256-5-Z2 [0,0,0,1,0,0|1,1,0]=3 7 B6R1.11 CC(O)C1CO1 2109-1-08 [0,0,0,1,0,0|1,1,0]=3 8 B6R0.2 CC(=O)OC(C)Cl 2123-5-21 [0,0,0,0,0,1|1,1,1]=4 9 B6R0.2 C[C@@H](N)CN(C)C 3132-5-R0 [0,0,0,0,0,1|2,0,0]=3 10 B6R0.2 C[C@H](N)CN(C)C 3132-5-S0 [0,0,0,0,0,1|2,0,0]=3 11 B5R0.1 C=CCC(C)N 3230-5-0A [1,1,0,0,0,0|1,0,1]=4 12 B5R0.3 CC(CO)CBr 2101-9-0B [1,1,0,0,0,0|0,1,0]=3 13 B5R0.3 CN[C@@H](C)CO 4156-5-S1 [1,1,0,0,0,0|0,1,0]=3 14 B5R0.3 NCC(Br)CBr 3130-9-00 [1,1,0,0,0,0|2,0,0]=4 15 B5R0.4 CC(C)(Br)C=O 2115-9-03 [1,1,0,0,0,0|0,1,1]=4 16 B5R0.4 CC(C)(F)CI 1100-K-75 [1,1,0,0,0,0|1,0,0]=3 17 B5R0.4 CC(C)(S)CN 7161-5-00 [1,1,0,0,0,0|1,0,0]=3 18 B7R0.2 CC(C)CC(=O)CBr 2117-9-09 [0,1,0,0,0,1|0,1,1]=4 19 B7R0.2 CC(C)CC(N)C#N 3137-1-17 [0,1,0,0,0,1|1,0,1]=4 20 B7R0.2 CC(C)NC(=O)CBr 4148-9-0A [0,1,0,0,0,1|0,1,1]=4 21 B7R0.5 CCCC(C)C(C)=O 2117-1-0J [0,2,0,0,0,0|0,1,1]=4 22 B7R0.10 CN[C@H](C)C(=O)OC 4158-5-RJ [0,2,0,0,0,0|0,1,1]=4 23 B7R0.10 COC(=O)[C@H](C)CO 2129-1-RC [0,2,0,0,0,0|0,1,1]=4 24 B7R0.10 OC(CCl)C(O)CCl 2104-5-01 [0,2,0,0,0,0|1,1,0]=4 25 B7R0.14 C[C@@H](CO)C(C)(C)O 2103-1-S2 [0,2,0,0,0,0|0,1,0]=3 26 B5R1.2 CC1CCN1 3H31-5-4U [1,0,0,1,0,0|1,0,0]=3 27 B5R1.2 IC1CCC1 1200-H-02 [1,0,0,1,0,0|1,0,0]=3 28 B5R1.2 SC1COC1 6H61-1-01 [1,0,0,1,0,0|1,0,0]=3 29 B5R1.3 ICC1CO1 2109-H-01 [1,0,0,1,0,0|1,1,0]=4 30 B7R1.2 CC1CCC(C)N1 3H31-5-0R [0,0,0,1,0,1|1,0,0]=3 31 B7R1.2 CN1CC[C@@H](N)C1 3H30-1-R1 [0,0,0,1,0,1|2,0,0]=4 32 B7R1.2 CN1CC[C@H](N)C1 3H30-1-S0 [0,0,0,1,0,1|2,0,0]=4 33 B7R1.2 N[C@@H]1CC[C@H](O)C1 4256-5-40 [0,0,0,1,0,1|1,1,0]=4 34 B7R1.2 N[C@H]1CC[C@@H](O)C1 4256-5-44 [0,0,0,1,0,1|1,1,0]=4 35 B7R1.2 N[C@H]1CC[C@H](O)C1 4256-5-45 [0,0,0,1,0,1|1,1,0]=4 36 B7R1.2 O[C@H]1CC[C@@H](O)C1 2204-1-0D [0,0,0,1,0,1|1,1,0]=4 37 B7R1.12 CC(C)C1ON1C 4H56-1-03P [0,0,0,1,0,1|1,1,0]=4 38 B7R1.16 CC1(C)CC(=O)C1 2217-1-0K [0,0,0,1,0,1|0,1,1]=4 39 B7R1.16 CC1(C)CC(N)C1 3230-5-0E [0,0,0,1,0,1|1,0,0]=3 40 B7R1.16 CC1(C)CC(O)C1 2202-1-0F [0,0,0,1,0,1|0,1,0]=3 41 B7R1.16 CC1(F)CC(N)C1 3230-7-0E [0,0,0,1,0,1|2,0,0]=4 42 B7R1.16 CC1(N)CC(F)C1 3230-7-0G [0,0,0,1,0,1|2,0,0]=4 43 B7R1.16 C[C@]1(N)C[C@@H](O)C1 4256-5-38 [0,0,0,1,0,1|1,1,0]=4 44 B7R1.16 C[C@]1(N)C[C@H](O)C1 4256-5-18 [0,0,0,1,0,1|1,1,0]=4 45 B7R1.16 C[C@]1(O)C[C@@H](N)C1 4256-5-19 [0,0,0,1,0,1|1,1,0]=4 46 B7R1.16 C[C@]1(O)C[C@H](N)C1 4256-5-20 [0,0,0,1,0,1|1,1,0]=4 47 B7R1.4 N[C@@H]1CCC[C@@H]1O 4256-5-30 [0,1,0,1,0,0|1,1,0]=4 48 B7R1.4 N[C@@H]1CNC[C@H]1F 3H33-7-15 [0,1,0,1,0,0|2,0,0]=4 49 B7R1.4 N[C@@H]1COC[C@@H]1O 4H56-5-8A [0,1,0,1,0,0|1,1,0]=4 50 B7R1.4 N[C@@H]1COC[C@H]1O 4H56-5-8E [0,1,0,1,0,0|1,1,0]=4 51 B7R1.4 O[C@@H]1CNC[C@H]1O 4H56-1-820 [0,1,0,1,0,0|1,1,0]=4 52 B7R1.4 O[C@H]1COC[C@@H]1O 2H04-1-S1 [0,1,0,1,0,0|1,1,0]=4 53 B7R1.8 O=C1CCC1CO 2220-1-06 [0,1,0,1,0,0|0,1,1]=4 54 B7R1.17 CC1(C)CCC1=O 2217-1-0L [0,1,0,1,0,0|0,1,1]=4 55 B7R1.17 CC1(C)CCC1O 2202-1-0E [0,1,0,1,0,0|0,1,0]=3 56 B7R1.18 CC(N)C1CCC1 3230-5-0B [0,1,0,1,0,0|1,0,0]=3 57 B7R1.18 CC(O)C1CNC1 4H02-5-0E [0,1,0,1,0,0|0,1,0]=3 58 B7R1.18 FC(F)C1CNC1 3H31-7-Z8 [0,1,0,1,0,0|2,0,0]=4 59 B7R1.19 CC(N)C1(C)CC1 3231-5-0A [0,1,0,1,0,0|1,0,0]=3 60 B7R1.22 NC(CO)C1CC1 4256-5-54 [0,1,0,1,0,0|1,0,0]=3 61 B7R1.22 N[C@@H](CO)C1CC1 4256-5-R2 [0,1,0,1,0,0|1,0,0]=3 62 B7R1.22 N[C@H](CO)C1CC1 4256-5-S2 [0,1,0,1,0,0|1,0,0]=3 63 B7R1.27 CCC1(C)ON1C 4H56-1-03N [0,1,0,1,0,0|1,1,0]=4