0 B7R0.16 CC(C)[C@@H](N)C(O)=O BCP10545 [0,0,0,0,0,0|1,0,1]=2 1 B7R0.16 C[C]([C](C(=O)O)N)O BCP16820 [0,0,0,0,0,0|2,0,2]=4 2 B7R0.16 N[C@@H]([C@@H](O)C)C(O)=O BCP08009 [0,0,0,0,0,0|2,0,1]=3 3 B7R0.16 O=C(C([O-])=O)C(C)C BCP18017 [0,0,0,0,0,0|0,0,1]=1 4 B6R0.2 CC(C)CC(N)=O BCP05941 [1,0,0,0,0,0|1,0,1]=3 5 B6R0.2 CC(C)NC(C)=O BCP19527 [1,0,0,0,0,0|2,0,0]=3 6 B6R0.2 CC(\C=C([O-])C)=O BCP15074 [1,0,0,0,0,0|2,0,1]=4 7 B6R0.2 C[C@@H](N)CC(O)=O BCP11586 [1,0,0,0,0,0|1,0,1]=3 8 B6R0.2 C[C@@H](N)CC(O)=O BCP16924 [1,0,0,0,0,0|1,0,1]=3 9 B6R0.2 OB(CC(C)C)O BCP12813 [1,0,0,0,0,0|1,0,2]=4 10 B6R0.3 CC[C@@H](N)C(O)=O BCP17075 [1,0,0,0,0,0|1,0,1]=3 11 B6R0.3 CC[C](N)C(O)=O BCP04716 [1,0,0,0,0,0|1,0,1]=3 12 B6R0.3 C[C@@H](CC)C(O)=O BCP18859 [1,0,0,0,0,0|1,0,1]=3 13 B6R0.3 C\C=C(C)\C(O)=O BCP18945 [1,0,0,0,0,0|1,0,1]=3 14 B6R0.3 NC(CC)C(N)=O BCP08675 [1,0,0,0,0,0|2,0,1]=4 15 B6R0.3 N[C](CO)C(O)=O BCP06311 [1,0,0,0,0,0|2,0,1]=4 16 B6R0.3 O=C(NN)C(N)=O BCP15450 [1,0,0,0,0,0|3,0,0]=4 17 B8R0.2 CC([C@H](N)C(OC)=O)C BCP11286 [0,1,0,0,0,0|1,0,1]=3 18 B8R0.2 CCC(C)C(C([O-])=O)=O BCP13101 [0,1,0,0,0,0|0,0,1]=2 19 B8R0.27 CC(C)(C)C(C(O)=O)=O BCP18772 [0,1,0,0,0,0|0,0,0]=1 20 B8R0.27 NC(C(C)(C)C)C(=O)O BCP15485 [0,1,0,0,0,0|1,0,1]=3 21 B8R0.27 N[C@@H](C(O)=O)C(C)(S)C BCP17247 [0,1,0,0,0,0|1,0,1]=3 22 B8R0.27 N[C](C(O)=O)C(C)(C)C BCP04717 [0,1,0,0,0,0|1,0,1]=3 23 B8R0.37 NC(C(C)C)(C)C(N)=O BCP14288 [0,1,0,0,0,0|2,0,1]=4 24 B8R1.54 O=C(O)[C@@H](N)C1CC1 BCP11588 [0,0,0,1,0,0|1,0,1]=3 25 B8R1.77 CC1(C[C]1C(N)=O)C BCP16588 [0,0,0,1,0,0|2,0,1]=4 26 B8R0.23 CC(C)[C@@H](CC(=O)O)N BCP11719 [0,0,0,0,0,1|1,0,1]=3 27 B8R0.23 O=C(O)C(CC(O)=O)=O BCP16299 [0,0,0,0,0,1|2,0,1]=4 28 B8R0.23 O=C([C](C)N)OC(C)C BCP16773 [0,0,0,0,0,1|2,0,1]=4 29 B5R0.1 CC(C)N=C=O BCP15287 [2,0,0,0,0,0|1,0,1]=4 30 B5R0.1 OC(CCO)=O BCP05902 [2,0,0,0,0,0|1,0,1]=4 31 B5R0.1 OC(CCS)=O BCP16636 [2,0,0,0,0,0|1,0,1]=4 32 B5R0.3 O=C(CBr)CC BCP08723 [2,0,0,0,0,0|1,0,1]=4 33 B5R0.5 C=C(Cl)C(O)=O BCP13841 [2,0,0,0,0,0|1,0,1]=4 34 B5R0.5 CC(C)C(C)O BCP29487 [2,0,0,0,0,0|1,0,1]=4 35 B5R0.5 CC(C)C(N)=N BCP07536 [2,0,0,0,0,0|2,0,0]=4 36 B5R0.5 C[C@@H](Cl)C(O)=O BCP14313 [2,0,0,0,0,0|1,0,0]=3 37 B5R0.5 C[C](Cl)C(O)=O BCP11281 [2,0,0,0,0,0|1,0,1]=4 38 B5R0.5 O=C(C)C([O-])=O BCP13503 [2,0,0,0,0,0|0,0,1]=3 39 B7R0.2 C[C@@H](O)CC(OC)=O BCP15245 [1,1,0,0,0,0|1,0,1]=4 40 B7R0.2 O=C(O)C[C@@H](N)CC BCP07772 [1,1,0,0,0,0|1,0,1]=4 41 B7R0.2 O=C(OC)C=C(C)C BCP10333 [1,1,0,0,0,0|0,0,1]=3 42 B7R0.2 O=C(OC)\C=C(N)C BCP15340 [1,1,0,0,0,0|1,0,1]=4 43 B7R0.5 CNC[C@H](N)C(O)=O BCP26260 [1,1,0,0,0,0|1,0,1]=4 44 B7R0.5 COC[C](C(O)=O)N BCP11642 [1,1,0,0,0,0|1,0,1]=4 45 B7R0.5 N[C@@H](COC)C(O)=O BCP14284 [1,1,0,0,0,0|1,0,1]=4 46 B7R0.5 O=C(O)[C@@H](CCN)N BCP11565 [1,1,0,0,0,0|1,0,1]=4 47 B7R0.5 O=C(O)[C](CNC)N BCP09610 [1,1,0,0,0,0|1,0,1]=4 48 B7R0.5 O=C(OCC)C(Cl)=O BCP20422 [1,1,0,0,0,0|1,0,0]=3 49 B7R0.10 O=C(OC)[C@@H](C)CO BCP07508 [1,1,0,0,0,0|2,0,0]=4 50 B7R0.10 O[C@@H](CO)C(CO)=O BCP10464 [1,1,0,0,0,0|1,0,1]=4 51 B7R0.13 N[C@](C(O)=O)(CC)C BCP11781 [1,1,0,0,0,0|1,0,1]=4 52 B7R0.14 CC(C)(C)C(CBr)=O BCP19288 [1,1,0,0,0,0|1,0,1]=4 53 B9R0.42 O=C(C(C)C)CC(OC)=O BCP13418 [0,1,0,0,0,1|0,0,0]=2 54 B9R0.79 CC(C)[C@@H](O)[C](N)C(O)=O BCP09537 [0,1,0,0,0,1|0,0,2]=4 55 B9R0.79 N[C@@H](C(O)=O)[C@@H](O)C(C)C BCP09538 [0,1,0,0,0,1|0,0,2]=4 56 B9R0.25 N[C@@H](C(C)(C)C)C(OC)=O BCP20355 [0,2,0,0,0,0|1,0,1]=4 57 B7R1.2 O=C1OC[C@@H](C)O1 BCP12993 [1,0,0,1,0,0|1,0,0]=3 58 B7R1.12 O=C(O)[C@@H]1[C@@H](C1)F BCP07708 [1,0,0,1,0,0|1,0,1]=4 59 B7R1.20 O=C(O)CC1CC1 BCP05386 [1,0,0,1,0,0|0,0,1]=3 60 B7R1.4 C=C1CCOC1=O BCP18620 [1,0,0,1,0,0|1,0,0]=3 61 B7R1.4 N[C@H]1CCOC1=O BCP20062 [1,0,0,1,0,0|1,0,1]=4 62 B7R1.4 O=C1OCC[C@@H]1N BCP19716 [1,0,0,1,0,0|1,0,1]=4 63 B7R1.19 CC1(CC1)C(O)=O BCP16042 [1,0,0,1,0,0|1,0,1]=4 64 B7R1.19 NC1(CC1)C(O)=O BCP05245 [1,0,0,1,0,0|1,0,1]=4 65 B7R1.22 BrCC(C1CC1)=O BCP05144 [1,0,0,1,0,0|1,0,1]=4 66 B9R1.69 O=C1C(N)CCC(N1)=O BCP16250 [0,0,0,1,0,1|2,0,0]=4 67 B9R1.69 O=C1CCC(C(N1)=O)N BCP05827 [0,0,0,1,0,1|2,0,0]=4 68 B9R1.69 O=C1CCC(C(N1)=O)N BCP13299 [0,0,0,1,0,1|2,0,0]=4 69 B9R1.112 O=C(O)C(N)CC1CC1 BCP15435 [0,0,0,1,0,1|1,0,1]=4 70 B9R1.112 O=C(O)[C@@H](N)CC1CC1 BCP07233 [0,0,0,1,0,1|1,0,1]=4 71 B9R1.112 O=C(O)[C](N)CC1CC1 BCP18435 [0,0,0,1,0,1|1,0,1]=4 72 B9R1.138 O=C1OCC(C)(C)[C@@H]1O BCP10328 [0,1,0,1,0,0|0,0,2]=4 73 B9R0.7 O=C(C(S)C)NCC(O)=O BCP13354 [0,0,0,0,0,2|1,0,0]=3 74 B9R0.53 CC(C)C[C](N)CC(O)=O BCP11737 [0,0,0,0,0,2|1,0,1]=4