0 B6R0.2 CC(C)CC(N)=O BCP05941 [1,0,0,0,0,0|2,0,0]=3 1 B6R0.2 CC(C)NC(C)=O BCP19527 [1,0,0,0,0,0|3,0,0]=4 2 B6R0.2 CC(CC(N)=O)=O BCP19964 [1,0,0,0,0,0|3,0,0]=4 3 B6R0.2 C[C@@H](N)CC(O)=O BCP11586 [1,0,0,0,0,0|2,0,0]=3 4 B6R0.2 C[C@@H](N)CC(O)=O BCP16924 [1,0,0,0,0,0|2,0,0]=3 5 B6R0.2 OB(CC(C)C)O BCP12813 [1,0,0,0,0,0|2,0,1]=4 6 B6R0.2 OC(CC(O)=O)=O BCP05571 [1,0,0,0,0,0|3,0,0]=4 7 B6R0.5 C[N+](C)(C)CC=C BCP14578 [1,0,0,0,0,0|1,0,0]=2 8 B6R0.5 NC(CCO)(C)C BCP10686 [1,0,0,0,0,0|2,0,1]=4 9 B8R0.27 CC(C)(C)C(C(O)=O)=O BCP18772 [0,1,0,0,0,0|1,0,1]=3 10 B8R0.27 NC(C(C)(C)C)C(=O)O BCP15485 [0,1,0,0,0,0|1,0,0]=2 11 B8R0.27 N[C@@H](C(O)=O)C(C)(S)C BCP17247 [0,1,0,0,0,0|2,0,0]=3 12 B8R0.27 N[C](C(O)=O)C(C)(C)C BCP04717 [0,1,0,0,0,0|1,0,1]=3 13 B8R1.77 CC1(C[C]1C(N)=O)C BCP16588 [0,0,0,1,0,0|2,0,1]=4 14 B8R1.77 O=C(C1C(F)(F)C1)O BCP19593 [0,0,0,1,0,0|3,0,0]=4 15 B6R0.7 CC(S(N)=O)(C)C BCP14651 [0,0,0,0,1,0|3,0,0]=4 16 B6R0.7 CC([C@](N)=O)(C)C BCP01233 [0,0,0,0,1,0|2,0,0]=3 17 B8R0.29 O=C(O)CNC(C)(C)C BCP01461 [0,0,0,0,0,1|1,0,0]=2 18 B5R0.1 OC(CCO)=O BCP05902 [2,0,0,0,0,0|2,0,0]=4 19 B5R0.1 OC(CCS)=O BCP16636 [2,0,0,0,0,0|2,0,0]=4 20 B5R0.4 CC(C)(C)CN BCP11254 [2,0,0,0,0,0|2,0,0]=4 21 B7R0.2 C[C@@H](O)CC(OC)=O BCP15245 [1,1,0,0,0,0|2,0,0]=4 22 B7R0.2 C[C](O)CC(OC)=O BCP12973 [1,1,0,0,0,0|2,0,0]=4 23 B7R0.2 O=C(O)C[C@@H](N)CC BCP07772 [1,1,0,0,0,0|2,0,0]=4 24 B7R0.2 O=C(OC)C=C(C)C BCP10333 [1,1,0,0,0,0|1,0,1]=4 25 B7R0.16 CC(C)[C@@H](N)C(O)=O BCP10545 [1,1,0,0,0,0|1,0,0]=3 26 B7R0.16 N[C@@H]([C@@H](O)C)C(O)=O BCP08009 [1,1,0,0,0,0|2,0,0]=4 27 B7R0.8 C[Si](C)(C)C\C=C\O BCP10915 [1,1,0,0,0,0|1,0,0]=3 28 B7R0.13 C[C@](CO)(N)C(O)=O BCP10469 [0,1,0,0,1,0|2,0,0]=4 29 B7R0.13 NCC(C(=O)N)(C)C BCP04929 [0,1,0,0,1,0|2,0,0]=4 30 B7R0.13 N[C@](C(O)=O)(CC)C BCP11781 [0,1,0,0,1,0|2,0,0]=4 31 B7R0.13 O=C(O)C(C)(C)ON BCP12073 [0,1,0,0,1,0|2,0,0]=4 32 B9R0.25 N[C@@H](C(C)(C)C)C(OC)=O BCP20355 [0,2,0,0,0,0|1,0,0]=3 33 B7R1.2 O=C1OC[C@@H](C)O1 BCP12993 [1,0,0,1,0,0|2,0,0]=4 34 B7R1.12 O=C(O)[C@@H]1[C@@H](C1)F BCP07708 [1,0,0,1,0,0|2,0,0]=4 35 B7R1.20 O=C(O)CC1CC1 BCP05386 [1,0,0,1,0,0|1,0,0]=3 36 B7R1.19 CC1(CC1)C(O)=O BCP16042 [0,0,0,1,1,0|1,0,0]=3 37 B7R1.19 NC1(CC1)C(O)=O BCP05245 [0,0,0,1,1,0|2,0,0]=4 38 B9R1.10 CC1(CCC(CC1)=O)C BCP07623 [0,0,0,1,0,1|2,0,0]=4 39 B9R1.66 O=C1CCCC(C)(C)C1 BCP15134 [0,1,0,1,0,0|2,0,0]=4 40 B9R1.138 O=C1OCC(C)(C)[C@@H]1O BCP10328 [0,1,0,1,0,0|1,0,0]=3 41 B9R1.128 SCC1(CC1)CC(O)=O BCP07650 [0,1,0,1,0,0|1,0,0]=3 42 B5R0.5 C[C@@H](Cl)C(O)=O BCP14313 [1,0,0,0,1,0|2,0,0]=4 43 B5R0.5 C[C](Cl)C(O)=O BCP11281 [1,0,0,0,1,0|2,0,0]=4 44 B9R0.56 C[N+](C)(C)NCCC([O-])=O BCP04503 [0,0,0,0,0,2|0,0,1]=3