0 B6R0.2 CC(C)CC(N)=O BCP05941 [0,0,0,0,0,0|2,0,0]=2 1 B6R0.2 CC(C)NC(C)=O BCP19527 [0,0,0,0,0,0|1,0,0]=1 2 B6R0.2 CC(CC(N)=O)=O BCP19964 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.2 CC(OC(C)=O)=O BCP20665 [0,0,0,0,0,0|1,0,1]=2 4 B6R0.2 CC(\C=C([O-])C)=O BCP15074 [0,0,0,0,0,0|2,0,1]=3 5 B6R0.2 C[C@@H](N)CC(O)=O BCP11586 [0,0,0,0,0,0|3,0,0]=3 6 B6R0.2 C[C@@H](N)CC(O)=O BCP16924 [0,0,0,0,0,0|3,0,0]=3 7 B6R0.2 OB(CC(C)C)O BCP12813 [0,0,0,0,0,0|3,0,1]=4 8 B5R0.1 CC(C)N=C=O BCP15287 [1,0,0,0,0,0|1,0,1]=3 9 B5R0.1 CC(OCCl)=O BCP16170 [1,0,0,0,0,0|1,0,0]=2 10 B5R0.1 C[C@@H](N)COC BCP19342 [1,0,0,0,0,0|3,0,0]=4 11 B5R0.1 NC(SCC)=N BCP20133 [1,0,0,0,0,0|2,1,0]=4 12 B5R0.1 NNCC(C)C BCP06610 [1,0,0,0,0,0|3,0,0]=4 13 B5R0.1 O=C(Cl)CCBr BCP20557 [1,0,0,0,0,0|3,0,0]=4 14 B5R0.1 O=C(Cl)CCCl BCP09962 [1,0,0,0,0,0|3,0,0]=4 15 B5R0.1 OC(CCO)=O BCP05902 [1,0,0,0,0,0|3,0,0]=4 16 B5R0.1 OC(CCS)=O BCP16636 [1,0,0,0,0,0|3,0,0]=4 17 B5R0.1 [S-]C(OCC)=S BCP29024 [1,0,0,0,0,0|1,1,0]=3 18 B7R0.2 CC(CN(C)C)CCl BCP09620 [0,1,0,0,0,0|3,0,0]=4 19 B7R0.2 CC(N)CC(C)CC BCP07039 [0,1,0,0,0,0|2,0,1]=4 20 B7R0.2 CC(N)CC(C)CC BCP18792 [0,1,0,0,0,0|2,0,1]=4 21 B7R0.2 C[C@@H](O)CC(OC)=O BCP15245 [0,1,0,0,0,0|2,0,0]=3 22 B7R0.2 C[C](O)CC(OC)=O BCP12973 [0,1,0,0,0,0|2,0,1]=4 23 B7R0.2 O=C(O)C[C@@H](N)CC BCP07772 [0,1,0,0,0,0|3,0,0]=4 24 B7R0.2 O=C(OC)C=C(C)C BCP10333 [0,1,0,0,0,0|1,0,1]=3 25 B7R0.2 O=C(OC)\C=C(N)C BCP15340 [0,1,0,0,0,0|2,0,1]=4 26 B7R0.9 CC(C)CS(=O)(Cl)=O BCP07920 [0,1,0,0,0,0|3,0,0]=4 27 B7R0.16 CC(C)[C@@H](N)C(O)=O BCP10545 [0,1,0,0,0,0|2,0,0]=3 28 B7R0.16 N[C@@H]([C@@H](O)C)C(O)=O BCP08009 [0,1,0,0,0,0|3,0,0]=4 29 B7R0.16 O=C(C([O-])=O)C(C)C BCP18017 [0,1,0,0,0,0|2,0,0]=3 30 B7R1.2 O=C1NCC(O)C1 BCP07569 [0,0,0,1,0,0|3,0,0]=4 31 B7R1.2 O=C1OC[C@@H](C)O1 BCP12993 [0,0,0,1,0,0|1,0,0]=2 32 B7R1.12 O=C(O)[C@@H]1[C@@H](C1)F BCP07708 [0,0,0,1,0,0|3,0,0]=4 33 B7R1.20 O=C(O)CC1CC1 BCP05386 [0,0,0,1,0,0|2,0,0]=3 34 B5R0.5 CC(C)C(C)O BCP29487 [0,0,0,0,1,0|0,0,2]=3 35 B5R0.5 CC(C)C(N)=N BCP07536 [0,0,0,0,1,0|2,0,0]=3 36 B5R0.5 C[C@@H](Cl)C(O)=O BCP14313 [0,0,0,0,1,0|2,0,0]=3 37 B5R0.5 C[C@@H](N)C(C)C BCP06945 [0,0,0,0,1,0|1,0,1]=3 38 B5R0.5 C[C](Cl)C(O)=O BCP11281 [0,0,0,0,1,0|2,0,1]=4 39 B5R0.5 O=C(C)C([O-])=O BCP13503 [0,0,0,0,1,0|2,0,1]=4 40 B4R0.1 CC(C)[Mg]Cl BCP10965 [2,0,0,0,0,0|2,0,0]=4 41 B4R0.1 CC(CBr)=O BCP06577 [2,0,0,0,0,0|1,0,0]=3 42 B4R0.1 CN(C)NC BCP16365 [2,0,0,0,0,0|2,0,0]=4 43 B4R0.1 C[C@@H](O)CC BCP06774 [2,0,0,0,0,0|0,0,2]=4 44 B4R0.1 O=C(O)CCl BCP20585 [2,0,0,0,0,0|2,0,0]=4 45 B6R0.1 O=C(C#N)OCC BCP04941 [1,1,0,0,0,0|0,0,1]=3 46 B6R0.1 O=C(C=C)OCC BCP06341 [1,1,0,0,0,0|0,0,1]=3 47 B6R0.1 O=C(OC)CCO BCP16887 [1,1,0,0,0,0|2,0,0]=4 48 B6R0.1 O=C(OC)CCS BCP16637 [1,1,0,0,0,0|2,0,0]=4 49 B6R0.1 O=C(OCC)CBr BCP04940 [1,1,0,0,0,0|0,0,0]=2 50 B6R0.1 OC[C@@H](C)COC BCP11697 [1,1,0,0,0,0|2,0,0]=4 51 B6R0.3 CC[C@@H](N)C(O)=O BCP17075 [1,1,0,0,0,0|2,0,0]=4 52 B6R0.3 CC[C](N)C(O)=O BCP04716 [1,1,0,0,0,0|2,0,0]=4 53 B6R0.3 C[C@@H](CC)C(O)=O BCP18859 [1,1,0,0,0,0|2,0,0]=4 54 B6R0.3 NC(CC)C(N)=O BCP08675 [1,1,0,0,0,0|2,0,0]=4 55 B6R0.4 CC(C)CCCO BCP06801 [1,1,0,0,0,0|1,0,1]=4 56 B6R0.4 OC(CSCC)=O BCP05241 [1,1,0,0,0,0|1,1,0]=4 57 B6R0.7 CC(S(N)=O)(C)C BCP14651 [0,1,0,0,1,0|2,0,0]=4 58 B6R0.7 CC([C@](N)=O)(C)C BCP01233 [0,1,0,0,1,0|1,0,0]=3 59 B8R0.23 CC(C)[C@@H](CC(=O)O)N BCP11719 [0,1,0,0,0,1|2,0,0]=4 60 B8R0.23 O=C([C](C)N)OC(C)C BCP16773 [0,1,0,0,0,1|1,0,1]=4 61 B8R0.29 O=C(O)CNC(C)(C)C BCP01461 [0,1,0,0,0,1|2,0,0]=4 62 B8R0.2 CC([C@H](N)C(OC)=O)C BCP11286 [0,2,0,0,0,0|1,0,0]=3 63 B8R0.2 CCC(C)C(C([O-])=O)=O BCP13101 [0,2,0,0,0,0|2,0,0]=4 64 B8R0.5 O=C(OC(C)C)OCCl BCP13081 [0,2,0,0,0,0|0,0,0]=2 65 B8R0.5 O=C(OC(C)C)\C=CI BCP15356 [0,2,0,0,0,0|0,0,1]=3 66 B8R0.19 O=C(OC)CC(O)CCl BCP13432 [0,2,0,0,0,0|2,0,0]=4 67 B8R0.27 CC(C)(C)C(C(O)=O)=O BCP18772 [0,2,0,0,0,0|2,0,0]=4 68 B8R0.27 NC(C(C)(C)C)C(=O)O BCP15485 [0,2,0,0,0,0|2,0,0]=4 69 B8R0.27 N[C@@H](C(O)=O)C(C)(S)C BCP17247 [0,2,0,0,0,0|2,0,0]=4 70 B8R0.27 N[C](C(O)=O)C(C)(C)C BCP04717 [0,2,0,0,0,0|2,0,0]=4 71 B8R0.37 NC(C(C)C)(C)C(N)=O BCP14288 [0,2,0,0,0,0|2,0,0]=4 72 B6R1.2 CC1CCCO1 BCP16203 [1,0,0,1,0,0|0,0,1]=3 73 B6R1.2 NC1=NCCC1 BCP11252 [1,0,0,1,0,0|2,0,0]=4 74 B6R1.2 O=C1COCC1 BCP14176 [1,0,0,1,0,0|2,0,0]=4 75 B6R1.2 O=C1NCCC1 BCP15175 [1,0,0,1,0,0|1,0,0]=3 76 B6R1.2 O=C1OCC=C1 BCP15247 [1,0,0,1,0,0|0,0,2]=4 77 B6R1.2 O=C1SCCN1 BCP16484 [1,0,0,1,0,0|1,1,0]=4 78 B8R1.3 O=C1NCC(C)CC1 BCP14293 [0,0,0,1,0,1|1,0,0]=3 79 B8R1.35 [*]C(OC[C@@H]1OC1)=O BCP12886 [0,0,0,1,0,1|2,0,0]=4 80 B8R1.77 CC1(C[C]1C(N)=O)C BCP16588 [0,0,0,1,0,1|2,0,0]=4 81 B8R1.4 CN1CCNC(=O)C1 BCP17253 [0,1,0,1,0,0|2,0,0]=4 82 B8R1.4 C[C@@H]1O[C](C)CNC1 BCP10396 [0,1,0,1,0,0|1,0,1]=4 83 B8R1.4 O=C1CC(N)CCN1 BCP07513 [0,1,0,1,0,0|2,0,0]=4 84 B8R1.4 OC1CCNC(=O)C1 BCP11689 [0,1,0,1,0,0|2,0,0]=4 85 B8R1.34 O=C(O)CC1CCC1 BCP15064 [0,1,0,1,0,0|2,0,0]=4 86 B8R1.54 O=C(O)[C@@H](N)C1CC1 BCP11588 [0,1,0,1,0,0|2,0,0]=4