0 B19R2.1351780 CCC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 1458a_100000499738_100000210202 [0,0,0,0,0,0|1,0,2]=3 1 B19R2.1351780 CNC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 11a_106832991635_100000499738 [0,0,0,0,0,0|2,0,2]=4 2 B19R2.1351780 CNC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 1626a_100102657272_100000499738 [0,0,0,0,0,0|2,0,2]=4 3 B19R2.1351780 CNC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 240690a_100102657272_100000499738 [0,0,0,0,0,0|2,0,2]=4 4 B19R2.1351780 CNC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 527a_100102657272_100000499738 [0,0,0,0,0,0|2,0,2]=4 5 B19R2.1351780 Cn1c(=O)c2c(ncn2CC(=O)CF)n(c1=O)C 1458a_100000499738_100015361967 [0,0,0,0,0,0|1,0,2]=3 6 B18R2.84179 CNCCn1cnc2c1c(=O)n(c(=O)n2C)C 2230a_106832991635_100000039610 [1,0,0,0,0,0|2,0,0]=3 7 B18R2.84179 CNCCn1cnc2c1c(=O)n(c(=O)n2C)C 34a_100102657272_100000039610 [1,0,0,0,0,0|2,0,0]=3 8 B18R2.84179 CNCCn1cnc2c1c(=O)n(c(=O)n2C)C 7a_106832991635_100000039610 [1,0,0,0,0,0|2,0,0]=3 9 B18R2.84179 COCCn1cnc2c1c(=O)n(c(=O)n2C)C 34a_100138415774_100000039610 [1,0,0,0,0,0|2,0,0]=3 10 B18R2.84179 CSCCn1cnc2c1c(=O)n(c(=O)n2C)C 62a_100000039610_200000210301 [1,0,0,0,0,0|2,0,0]=3 11 B18R2.84179 CSCCn1cnc2c1c(=O)n(c(=O)n2C)C 62a_200000210301_100000039610 [1,0,0,0,0,0|2,0,0]=3 12 B18R2.84179 Cn1c(=O)c2c(ncn2CCS[13CH3])n(c1=O)C 62a_100000039610_200025704644 [1,0,0,0,0,0|2,0,0]=3 13 B18R2.84179 Cn1c(=O)c2c(ncn2CCS[13CH3])n(c1=O)C 62a_200025704644_100000039610 [1,0,0,0,0,0|2,0,0]=3 14 B18R2.3081300 CC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 1458a_100000499738_200000210301 [1,0,0,0,0,0|0,0,2]=3 15 B18R2.3081300 Cn1c(=O)c2c(ncn2CC(=O)[13CH3])n(c1=O)C 1458a_100000499738_200025704644 [1,0,0,0,0,0|0,0,2]=3 16 B20R2.1073131 C#CCC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 1458a_100000499738_100000184674 [0,1,0,0,0,0|1,0,2]=4 17 B20R2.1073131 C=CCC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 1458a_100000499738_100000210623 [0,1,0,0,0,0|1,0,2]=4 18 B20R2.1073131 CCCC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 1458a_100000499738_100000210303 [0,1,0,0,0,0|1,0,2]=4 19 B20R2.1073131 CCNC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 11a_100015525214_100000499738 [0,1,0,0,0,0|1,0,2]=4 20 B20R2.1073131 CCNC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 240690a_100015525214_100000499738 [0,1,0,0,0,0|1,0,2]=4 21 B20R2.1073131 CCNC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 527a_100015525214_100000499738 [0,1,0,0,0,0|1,0,2]=4 22 B20R2.1073131 Cn1c(=O)c2c(ncn2CC(=O)CC#N)n(c1=O)C 1458a_100000499738_100011214920 [0,1,0,0,0,0|1,0,2]=4 23 B20R2.1073131 Cn1c(=O)c2c(ncn2CC(=O)CCF)n(c1=O)C 1458a_100000499738_100011217306 [0,1,0,0,0,0|1,0,2]=4 24 B20R2.1073131 Cn1c(=O)c2c(ncn2CC(=O)CCO)n(c1=O)C 1458a_100000499738_100000211926 [0,1,0,0,0,0|0,0,2]=3 25 B20R2.25503727 CC(C)C(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 1458a_100000499738_100000210206 [0,1,0,0,0,0|1,0,2]=4 26 B20R2.1326552 CCC(=O)CCn1cnc2c1c(=O)n(c(=O)n2C)C 1458a_100000210414_100000039610 [0,0,0,0,0,1|1,0,2]=4 27 B20R2.1326552 CCN(C)CCn1cnc2c1c(=O)n(c(=O)n2C)C 2230a_100000225621_100000039610 [0,0,0,0,0,1|3,0,0]=4 28 B20R2.1326552 CCN(C)CCn1cnc2c1c(=O)n(c(=O)n2C)C 269982a_100000225621_100000039610 [0,0,0,0,0,1|3,0,0]=4 29 B20R2.1326552 Cn1c(=O)c2c(ncn2CCC(=O)CO)n(c1=O)C 1458a_100000210174_100000039610 [0,0,0,0,0,1|0,0,2]=3 30 B17R1.152250 Cc1c(c(=O)n(c(=O)n1C)C)SCC(O)CO 62a_100011219619_200009812460 [1,0,1,0,0,0|1,0,1]=4 31 B17R1.152250 Cc1c(c(=O)n(c(=O)n1C)C)SCC(O)CO 62a_200009812460_100011219619 [1,0,1,0,0,0|1,0,1]=4 32 B17R1.152250 Cc1c(c(=O)n(c(=O)n1C)C)SC[C@@H](O)CO 62a_100009815848_200009812460 [1,0,1,0,0,0|1,0,1]=4 33 B17R1.152250 Cc1c(c(=O)n(c(=O)n1C)C)SC[C@@H](O)CO 62a_200009812460_100009815848 [1,0,1,0,0,0|1,0,1]=4 34 B19R2.1046181 CCNCCn1cnc2c1c(=O)n(c(=O)n2C)C 2230a_100015525214_100000039610 [1,1,0,0,0,0|1,0,0]=3 35 B19R2.1046181 CCOCCn1cnc2c1c(=O)n(c(=O)n2C)C 34a_100121572206_100000039610 [1,1,0,0,0,0|1,0,0]=3 36 B19R2.1046181 CCSCCn1cnc2c1c(=O)n(c(=O)n2C)C 62a_100000039610_100000210202 [1,1,0,0,0,0|1,0,0]=3 37 B19R2.1046181 CCSCCn1cnc2c1c(=O)n(c(=O)n2C)C 62a_100000210202_100000039610 [1,1,0,0,0,0|1,0,0]=3 38 B19R2.1046181 CNCCCn1cnc2c1c(=O)n(c(=O)n2C)C 2230a_106832991635_100020672187 [1,1,0,0,0,0|1,0,0]=3 39 B19R2.1046181 CNCCCn1cnc2c1c(=O)n(c(=O)n2C)C 34a_100102657272_100020672187 [1,1,0,0,0,0|1,0,0]=3 40 B19R2.1046181 CNCCCn1cnc2c1c(=O)n(c(=O)n2C)C 7a_106832991635_100020672187 [1,1,0,0,0,0|1,0,0]=3 41 B19R2.1046181 COCCCn1cnc2c1c(=O)n(c(=O)n2C)C 34a_100138415774_100020672187 [1,1,0,0,0,0|0,0,0]=2 42 B19R2.1046181 CSCCCn1cnc2c1c(=O)n(c(=O)n2C)C 62a_100020672187_200000210301 [1,1,0,0,0,0|0,1,0]=3 43 B19R2.1046181 CSCCCn1cnc2c1c(=O)n(c(=O)n2C)C 62a_200000210301_100020672187 [1,1,0,0,0,0|0,1,0]=3 44 B19R2.1046181 Cn1c(=O)c2c(ncn2CCCS[13CH3])n(c1=O)C 62a_100020672187_200025704644 [1,1,0,0,0,0|0,1,0]=3 45 B19R2.1046181 Cn1c(=O)c2c(ncn2CCCS[13CH3])n(c1=O)C 62a_200025704644_100020672187 [1,1,0,0,0,0|0,1,0]=3 46 B19R2.1046181 Cn1c(=O)c2c(ncn2CCSCF)n(c1=O)C 62a_100000039610_100015361967 [1,1,0,0,0,0|1,0,0]=3 47 B19R2.1046181 Cn1c(=O)c2c(ncn2CCSCF)n(c1=O)C 62a_100015361967_100000039610 [1,1,0,0,0,0|1,0,0]=3 48 B19R2.11728957 CC(=O)CCn1cnc2c1c(=O)n(c(=O)n2C)C 1458a_100000070787_100000039610 [1,1,0,0,0,0|0,0,2]=4 49 B19R2.11728957 CN(C)CCn1cnc2c1c(=O)n(c(=O)n2C)C 2230a_100102631434_100000039610 [1,1,0,0,0,0|2,0,0]=4 50 B19R2.11728957 CN(C)CCn1cnc2c1c(=O)n(c(=O)n2C)C 269982a_100102631434_100000039610 [1,1,0,0,0,0|2,0,0]=4 51 B21R2.2243713 CCC(C)C(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 1458a_100000499738_100000758301 [0,1,0,0,0,1|2,0,0]=4 52 B21R2.5288511 CN(CCO)CCn1cnc2c1c(=O)n(c(=O)n2C)C 2230a_100000210263_100000039610 [0,1,0,0,0,1|2,0,0]=4 53 B21R2.5288511 CN(CCO)CCn1cnc2c1c(=O)n(c(=O)n2C)C 269982a_100000210263_100000039610 [0,1,0,0,0,1|2,0,0]=4 54 B21R2.5288511 COCC(=O)CCn1cnc2c1c(=O)n(c(=O)n2C)C 1458a_100000210968_100000039610 [0,1,0,0,0,1|0,0,2]=4 55 B21R2.5288511 Cn1c(=O)c2c(ncn2CCC(=O)CCO)n(c1=O)C 1458a_100011216618_100000039610 [0,1,0,0,0,1|0,0,2]=4 56 B21R2.52919772 C[C@@H](O)C(=O)CCn1cnc2c1c(=O)n(c(=O)n2C)C 1458a_100000717761_100000039610 [0,1,0,0,0,1|0,0,2]=4 57 B21R2.52919772 C[C@H](O)C(=O)CCn1cnc2c1c(=O)n(c(=O)n2C)C 1458a_217856618621_100000039610 [0,1,0,0,0,1|0,0,2]=4 58 B21R2.52919772 Cn1c(=O)c2c(ncn2CCC(=O)C(O)O)n(c1=O)C 1458a_100000233687_100000039610 [0,1,0,0,0,1|0,0,2]=4 59 B21R2.2087832 COCCC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 1458a_100000499738_100000233755 [0,2,0,0,0,0|0,0,2]=4 60 B21R2.2087832 Cn1c(=O)c2c(ncn2CC(=O)CCCO)n(c1=O)C 1458a_100000499738_100011215043 [0,2,0,0,0,0|0,0,2]=4 61 B21R2.2087832 Cn1c(=O)c2c(ncn2CC(=O)NCCO)n(c1=O)C 240690a_100000210304_100000499738 [0,2,0,0,0,0|0,0,2]=4 62 B21R2.2087832 Cn1c(=O)c2c(ncn2CC(=O)NCCO)n(c1=O)C 527a_100000210304_100000499738 [0,2,0,0,0,0|0,0,2]=4 63 B21R2.52919774 CC(O)CC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C 1458a_100000499738_100011218427 [0,2,0,0,0,0|0,0,2]=4 64 B17R1.1183 CCC(O)CNCc1cc(=O)n(c(=O)n1C)C 2230a_100000241867_100011218378 [0,0,1,0,1,0|1,0,1]=4 65 B17R1.1183 C[C@@H](CO)CNCc1cc(=O)n(c(=O)n1C)C 2230a_100000241867_100000059175 [0,0,1,0,1,0|1,0,1]=4 66 B17R1.1183 Cn1c(cc(=O)n(c1=O)C)CNCC(O)CO 2230a_100000241867_100011219619 [0,0,1,0,1,0|0,0,1]=3 67 B17R1.1183 Cn1c(cc(=O)n(c1=O)C)CNC[C@@H](O)CF 2230a_100000241867_100015614560 [0,0,1,0,1,0|1,0,1]=4 68 B17R1.1183 Cn1c(cc(=O)n(c1=O)C)CNC[C@@H](O)CO 2230a_100000241867_100009815848 [0,0,1,0,1,0|0,0,1]=3 69 B21R2.1170306 CC(CF)OCCn1cnc2c1c(=O)n(c(=O)n2C)C 34a_100016041109_100000039610 [0,0,0,0,0,2|2,0,0]=4 70 B21R2.1170306 CC(CF)OCCn1cnc2c1c(=O)n(c(=O)n2C)C 7a_100016041109_100000039610 [0,0,0,0,0,2|2,0,0]=4 71 B21R2.1170306 CC(CN)OCCn1cnc2c1c(=O)n(c(=O)n2C)C 34a_100000210904_100000039610 [0,0,0,0,0,2|2,0,0]=4 72 B21R2.1170306 CC(CO)SCCn1cnc2c1c(=O)n(c(=O)n2C)C 62a_100012180447_100000039610 [0,0,0,0,0,2|1,0,0]=3 73 B21R2.1170306 CCC(C)NCCn1cnc2c1c(=O)n(c(=O)n2C)C 2230a_100000209981_100000039610 [0,0,0,0,0,2|2,0,0]=4 74 B21R2.1170306 CCC(C)OCCn1cnc2c1c(=O)n(c(=O)n2C)C 7a_100000210228_100000039610 [0,0,0,0,0,2|2,0,0]=4 75 B21R2.1170306 CCC(C)SCCn1cnc2c1c(=O)n(c(=O)n2C)C 62a_100000039610_100000758301 [0,0,0,0,0,2|2,0,0]=4 76 B21R2.1170306 CCC(C)SCCn1cnc2c1c(=O)n(c(=O)n2C)C 62a_100000758301_100000039610 [0,0,0,0,0,2|2,0,0]=4 77 B21R2.1170306 C[C@H](CO)NCCn1cnc2c1c(=O)n(c(=O)n2C)C 2230a_100000737577_100000039610 [0,0,0,0,0,2|1,0,0]=3 78 B21R2.1170306 C[C@H](CO)SCCn1cnc2c1c(=O)n(c(=O)n2C)C 62a_100000039610_100016084084 [0,0,0,0,0,2|1,0,0]=3 79 B21R2.1170306 C[C@H](CO)SCCn1cnc2c1c(=O)n(c(=O)n2C)C 62a_100016084084_100000039610 [0,0,0,0,0,2|1,0,0]=3 80 B21R2.1170306 Cn1c(=O)c2c(ncn2CCCC(=O)CO)n(c1=O)C 1458a_100000210174_100020672187 [0,0,0,0,0,2|0,0,2]=4