0 B8R1.18 CC1=CC(=O)NC1=O PH010527 [0,0,0,0,0,0|2,0,1]=3 1 B8R1.18 CN1N=C(NC1=O)Br CDS021279 [0,0,0,0,0,0|3,0,0]=3 2 B8R1.18 O=C1NC(=O)C(N1)O CDS005149 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.18 O=C1NC(=S)NC1=O S763624 [0,0,0,0,0,0|3,1,0]=4 4 B7R1.2 CC1COC(=O)N1 CBR01603 [1,0,0,0,0,0|2,0,1]=4 5 B7R1.2 C[C@H]1COC(=O)N1 ANV00127 [1,0,0,0,0,0|2,0,1]=4 6 B7R1.2 O=C1C=C(CC1)Cl PH014653 [1,0,0,0,0,0|3,0,0]=4 7 B7R1.2 O=C1C=C(CO1)Br SYX00384 [1,0,0,0,0,0|3,0,0]=4 8 B7R1.2 O=C1C=CC(=O)O1 S453374 [1,0,0,0,0,0|2,0,1]=4 9 B7R1.4 CN1CCNC1=O CDS006142 [1,0,0,0,0,0|1,0,1]=3 10 B7R1.4 NC1CCOC1=O CDS012715 [1,0,0,0,0,0|2,0,1]=4 11 B7R1.4 NC1CCSC1=O S784036 [1,0,0,0,0,0|2,0,1]=4 12 B7R1.4 NN1CCOC1=O S462624 [1,0,0,0,0,0|1,0,1]=3 13 B7R1.4 N[C@H]1CCNC1=O CDS010107 [1,0,0,0,0,0|1,0,1]=3 14 B7R1.4 O=C1NCC[C@@H]1O CDS004995 [1,0,0,0,0,0|2,0,1]=4 15 B9R1.22 CNC1CC(=O)NC1=O PH018276 [0,1,0,0,0,0|1,0,0]=2 16 B9R1.22 O=C1NC(=O)[C@@H](N1)CO PH011479 [0,1,0,0,0,0|3,0,0]=4 17 B9R1.37 CC1=C(N(C(=O)N1)C)C CBR02435 [0,1,0,0,0,0|2,0,1]=4 18 B9R1.37 CC1C(=O)CC(=O)C1=O PH004761 [0,1,0,0,0,0|3,0,0]=4 19 B9R1.37 CC1NC(=O)N(C1=O)C CBR02204 [0,1,0,0,0,0|3,0,0]=4 20 B9R1.37 CN1C(=O)NC(=O)C1=O CBR02185 [0,1,0,0,0,0|1,0,1]=3 21 B9R1.37 CN1CC(=O)N(C1=S)C S986208 [0,1,0,0,0,0|1,1,0]=3 22 B9R1.37 O=C1CN(C(=O)N1Br)Br T308021 [0,1,0,0,0,0|1,0,0]=2 23 B9R1.37 O=C1OC(=O)C(C1Br)Br L132004 [0,1,0,0,0,0|3,0,0]=4 24 B9R1.38 N1C(=O)CC(C1=O)(C)C S950858 [0,1,0,0,0,0|2,0,0]=3 25 B7R0.2 CN(C)CC(=O)NN CDS000357 [0,0,1,0,0,0|3,0,0]=4 26 B7R0.2 CNC(=O)NC(=O)C S411868 [0,0,1,0,0,0|1,0,0]=2 27 B7R0.2 COC(=O)NC(=O)N S876178 [0,0,1,0,0,0|3,0,0]=4 28 B7R0.2 NC(=O)NC(=O)CCl PH011412 [0,0,1,0,0,0|3,0,0]=4 29 B7R0.5 CCOC(=O)N(C)N PH007944 [0,0,1,0,0,0|2,0,1]=4 30 B7R0.7 CCOC(=O)CNN CDS009912 [0,0,1,0,0,0|2,0,1]=4 31 B9R2.25 O=C1OC(=O)C2C1O2 S34747 [0,0,0,1,0,0|3,0,0]=4 32 B9R1.34 CC1=NC(=O)CC(=O)N1 S216828 [0,0,0,0,0,1|3,0,0]=4 33 B9R1.34 N1C(=O)NC(=O)C=C1Cl S783242 [0,0,0,0,0,1|2,0,1]=4 34 B9R1.34 N1C(=O)NC(=O)CC1C S533564 [0,0,0,0,0,1|2,0,0]=3 35 B9R1.34 NC1=CC(=O)NC(=S)N1 OTV000203 [0,0,0,0,0,1|1,1,1]=4 36 B9R1.34 O=C1CC(=O)NC(=S)[N-]1 S564508 [0,0,0,0,0,1|2,1,0]=4 37 B9R1.69 CC1CNC(=O)NC1=O S412295 [0,0,0,0,0,1|2,0,0]=3 38 B9R1.69 CN1CC(=O)NCC1=O PH008413 [0,0,0,0,0,1|1,0,0]=2 39 B9R1.69 CN1CCC(=O)NC1=S S859176 [0,0,0,0,0,1|1,1,0]=3 40 B9R1.69 N1C(=O)NN=C(C1=O)Br S948837 [0,0,0,0,0,1|3,0,0]=4 41 B9R1.69 N1NC(=O)C(=CC1=O)C S540862 [0,0,0,0,0,1|2,0,1]=4 42 B9R1.69 O=C1NCC(C(=O)N1)Br S776858 [0,0,0,0,0,1|2,0,0]=3 43 B6R0.1 CNCC(=O)NC CBR00235 [1,0,1,0,0,0|1,0,1]=4 44 B6R0.2 CC(=O)SC(=O)C R425621 [1,0,1,0,0,0|2,0,0]=4 45 B6R0.2 CC(=S)CC(=O)N S704164 [1,0,1,0,0,0|1,1,0]=4 46 B6R0.2 N=C(N)NC(=O)N S414786 [1,0,1,0,0,0|2,0,0]=4 47 B6R0.2 N=C(N)NC(=O)N S414980 [1,0,1,0,0,0|2,0,0]=4 48 B6R0.2 NC(=O)CC(=O)O S937436 [1,0,1,0,0,0|2,0,0]=4 49 B6R0.4 C=CCNC(=N)N S815497 [1,0,1,0,0,0|2,0,0]=4 50 B6R0.4 C=CCNC(=O)C EME00415 [1,0,1,0,0,0|2,0,0]=4 51 B6R0.4 CCNCC(=O)N S877379 [1,0,1,0,0,0|1,0,1]=4 52 B6R0.4 CCNCC(=O)N S986194 [1,0,1,0,0,0|1,0,1]=4 53 B6R0.4 NC(=O)NCCCl CDS000493 [1,0,1,0,0,0|1,0,1]=4 54 B6R0.3 CCC(N)C(=O)N S784044 [1,0,1,0,0,0|1,0,1]=4 55 B6R0.3 CNC(=O)[C@H](C)N CDS020776 [1,0,1,0,0,0|1,0,1]=4 56 B6R1.2 NN1C=CC=C1 CDS000078 [2,0,0,0,0,0|1,0,1]=4 57 B6R1.2 O=C1CC=CC1 CDS003851 [2,0,0,0,0,0|2,0,0]=4 58 B6R1.2 O=C1NC=CN1 CBR02030 [2,0,0,0,0,0|0,0,1]=3 59 B6R1.2 O=C1NCCS1 CDS011623 [2,0,0,0,0,0|1,0,1]=4 60 B8R0.5 CCOC(=O)NC(=O)C S357308 [0,1,1,0,0,0|2,0,0]=4 61 B8R0.19 COC(=O)NC(=O)CCl PH010166 [0,1,1,0,0,0|2,0,0]=4 62 B8R0.23 NC(=O)CC(Br)C(=O)O PH007627 [0,1,1,0,0,0|2,0,0]=4 63 B8R0.23 NC(CC(=O)[O-])C(=O)[O-] S518085 [0,1,1,0,0,0|2,0,0]=4 64 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] S600768 [0,1,1,0,0,0|2,0,0]=4 65 B8R0.23 OC(=O)[C@H](O)CC(=O)N PH009423 [0,1,1,0,0,0|2,0,0]=4 66 B8R1.1 NCC1=NNC(=O)N1 CBR02276 [1,1,0,0,0,0|2,0,0]=4 67 B8R1.50 CC1C(=O)COC1=O S839418 [1,1,0,0,0,0|2,0,0]=4 68 B10R1.8 NNC1=CC(=O)NC(=O)N1 CBR01789 [0,1,0,0,0,1|1,0,1]=4 69 B10R1.22 N1C(=O)NC(=O)C(=C1N)N S504386 [0,1,0,0,0,1|1,0,1]=4 70 B10R1.329 O=C1CS(=O)(=O)CC(=O)N1 R305235 [0,1,0,0,0,1|2,0,0]=4 71 B10R1.329 O=C1CS(=O)(=O)NC(=O)N1 PH009509 [0,1,0,0,0,1|2,0,0]=4 72 B10R1.25 CCN1C=CC(=O)NC1=O S787973 [0,1,0,0,0,1|1,0,1]=4 73 B10R1.25 CCN1CCC(=O)NC1=O S932698 [0,1,0,0,0,1|1,0,0]=3 74 B10R1.63 CC1(CNC(=O)NC1=O)Br S571385 [0,1,0,0,0,1|2,0,0]=4 75 B10R1.118 CN1CC(C(=O)NC1=O)Br S859559 [0,1,0,0,0,1|1,0,0]=3 76 B10R1.59 CC(=O)N1CC(=O)NC1=S R429554 [0,2,0,0,0,0|1,1,0]=4 77 B10R1.130 C=CCN1CC(=O)NC1=O PH011349 [0,2,0,0,0,0|1,0,0]=3 78 B10R1.130 O=CNC1CC(=O)OC1=O PH001520 [0,2,0,0,0,0|2,0,0]=4 79 B10R1.256 CCN1C(=O)CN(C1=S)C S981966 [0,2,0,0,0,0|1,1,0]=4 80 B10R1.256 CCN1C(=O)NC(=O)C1=O PH016115 [0,2,0,0,0,0|1,0,1]=4 81 B8R1.4 O=C1CNCC(=O)N1 CDS019497 [0,0,1,1,0,0|1,0,0]=3 82 B8R1.4 O=C1CSCC(=O)N1 R305316 [0,0,1,1,0,0|2,0,0]=4 83 B8R1.4 O=C1NCNC(=O)N1 S347531 [0,0,1,1,0,0|2,0,0]=4 84 B6R1.4 O=C1CCC1=O S869309 [1,0,0,0,1,0|1,0,0]=3 85 B8R0.9 CNC(=O)CNC(=O)C S782807 [0,0,1,0,0,1|1,0,0]=3 86 B8R0.9 COC(=O)CNC(=O)C S785687 [0,0,1,0,0,1|2,0,0]=4 87 B8R0.9 NCC(=O)NCC(=O)O S456829 [0,0,1,0,0,1|2,0,0]=4 88 B8R1.3 CC1=NNC(=O)CC1 R750921 [1,0,0,0,0,1|2,0,0]=4 89 B8R1.3 N1C=C(C=CC1=O)N ANV00289 [1,0,0,0,0,1|1,0,1]=4 90 B8R1.3 N[C@H]1CCC(=O)NC1 CDS013956 [1,0,0,0,0,1|1,0,1]=4 91 B8R1.3 S=C1CNC(=S)CN1 L163740 [1,0,0,0,0,1|0,2,0]=4 92 B10R1.330 O=C1CNC(=O)NC(=O)C1 CDS015044 [0,0,0,0,0,2|2,0,0]=4 93 B10R1.332 CN1CCC(=O)CCC1=O PH018619 [0,0,0,0,0,2|2,0,0]=4