0 B5R0.1 COCC(=N)N 4091089 [0,0,0,0,0,0|4,0,0]=4 1 B4R0.1 N=C(N)CF 4088189 [1,0,0,0,0,0|3,0,0]=4 2 B4R0.2 CCCNN 4088315 [1,0,0,0,0,0|3,0,0]=4 3 B6R0.1 CCOC(C)CN 4089019 [0,1,0,0,0,0|1,1,1]=4 4 B6R0.2 CC(=O)CC(C)N 4022442 [0,1,0,0,0,0|1,0,0]=2 5 B6R0.2 CC(=O)CC(C)N 4089784 [0,1,0,0,0,0|1,0,0]=2 6 B6R0.2 CC(C)CC(=N)N 4089840 [0,1,0,0,0,0|3,0,0]=4 7 B6R0.3 CN[C@@H](C)C(N)=O 4077652 [0,1,0,0,0,0|3,0,0]=4 8 B6R0.3 CN[C@H](C)C(N)=O 4076581 [0,1,0,0,0,0|3,0,0]=4 9 B6R0.4 CCCCC(=N)N 4090419 [0,1,0,0,0,0|3,0,0]=4 10 B6R0.4 CNCCC(=O)O 4088781 [0,1,0,0,0,0|2,0,0]=3 11 B6R0.4 CNCCC(N)=O 4090391 [0,1,0,0,0,0|2,0,0]=3 12 B6R1.3 CCNC1CC1 4026907 [0,0,0,1,0,0|2,0,1]=4 13 B5R0.3 C=C(CC)CN 4074283 [1,1,0,0,0,0|1,0,0]=3 14 B5R0.3 CCC(C)NC 4039876 [1,1,0,0,0,0|1,0,1]=4 15 B5R0.3 CCC(C)NC 4089297 [1,1,0,0,0,0|1,0,1]=4 16 B5R0.3 CNC(=O)CN 4089909 [1,1,0,0,0,0|1,0,0]=3 17 B5R0.5 CC(O)C(=N)N 4089130 [1,1,0,0,0,0|2,0,0]=4 18 B5R0.5 C[C@@H](O)C(=N)N 4060246 [1,1,0,0,0,0|2,0,0]=4 19 B5R0.5 C[C@H](O)C(=N)N 4057094 [1,1,0,0,0,0|2,0,0]=4 20 B7R0.2 CNC(C)CC(=O)O 4090195 [0,2,0,0,0,0|2,0,0]=4 21 B7R0.3 CCC(=O)NCCN 4028425 [0,2,0,0,0,0|1,0,0]=3 22 B7R0.3 CNC(=O)CCCN 4089383 [0,2,0,0,0,0|1,0,0]=3 23 B7R0.3 CNCCC(=O)NC 4088709 [0,2,0,0,0,0|1,0,0]=3 24 B7R0.5 CN(C)C(=O)CCN 4090962 [0,2,0,0,0,0|2,0,0]=4 25 B7R0.5 CNCC(C)C(=O)O 4088272 [0,2,0,0,0,0|2,0,0]=4 26 B7R0.10 CCC(N)C(=O)NC 4090715 [0,2,0,0,0,0|1,0,0]=3 27 B7R0.10 CNC(=O)C(C)CN 4089454 [0,2,0,0,0,0|2,0,0]=4 28 B7R0.10 CNC(=O)[C@@H](C)NC 4058453 [0,2,0,0,0,0|2,0,0]=4 29 B7R0.10 CNC(=O)[C@H](C)NC 4051973 [0,2,0,0,0,0|2,0,0]=4 30 B7R0.10 CN[C@@H](C)C(=O)OC 4063702 [0,2,0,0,0,0|2,0,0]=4 31 B7R0.10 CN[C@H](C)C(=O)OC 4068255 [0,2,0,0,0,0|2,0,0]=4 32 B7R0.8 CS(=O)(=O)NCCN 4090991 [0,2,0,0,0,0|2,0,0]=4 33 B5R1.4 C[C@@H]1C[C@H]1N 4110616 [1,0,0,1,0,0|1,0,1]=4 34 B5R1.1 C1CNOC1 4089053 [1,0,0,1,0,0|1,1,0]=4 35 B7R1.4 NC1CCNC1=O 4019954 [0,1,0,1,0,0|1,0,0]=3 36 B7R1.4 N[C@@H]1CCNC1=O 4101224 [0,1,0,1,0,0|1,0,0]=3 37 B7R1.4 N[C@H]1CCNC1=O 4107612 [0,1,0,1,0,0|1,0,0]=3