0 B16R1.608 C=C(C)CCOC(=O)C=CC1=CC=CC=C1 CNP0192386.0 [0,0,0,0,0,0|0,0,2]=2 1 B16R1.608 CC(=CCOC(=O)C=CC1=CC=CC=C1)C CNP0304663.0 [0,0,0,0,0,0|0,0,2]=2 2 B16R1.608 CC(C)CCNC(=O)C=CC1=CC=CC=C1 CNP0486417.0 [0,0,0,0,0,0|1,0,0]=1 3 B16R1.608 CC(C)CCOC(=O)C=CC1=CC=CC=C1 CNP0002795.0 [0,0,0,0,0,0|0,0,0]=0 4 B16R1.608 CC(C)CCOC(=O)CCC1=CC=CC=C1 CNP0502390.0 [0,0,0,0,0,0|0,0,2]=2 5 B16R1.608 CN(C)CCOC(=O)C=CC1=CC=CC=C1 CNP0121597.0 [0,0,0,0,0,0|1,0,0]=1 6 B15R1.78 CCCCCC(=O)OCC1=CC=CC=C1 CNP0185938.0 [1,0,0,0,0,0|2,0,1]=4 7 B15R1.78 CCCCCC(O)C=CC1=CC=CC=C1 CNP0541967.0 [1,0,0,0,0,0|1,0,2]=4 8 B15R1.78 CCCCOC(=O)C=CC1=CC=CC=C1 CNP0358950.0 [1,0,0,0,0,0|0,0,0]=1 9 B15R1.78 CSCCNC(=O)C=CC1=CC=CC=C1 CNP0304825.0 [1,0,0,0,0,0|2,0,0]=3 10 B17R1.1079 CN(C)CCOC(=O)COC1=CC=C(C=C1)Cl CNP0339121.0 [0,1,0,0,0,0|2,0,1]=4 11 B17R2.3231 O=C(/C=C/C1=CC=CC=C1)N2CC[C@@H](C2)O CNP0591915.1 [0,0,0,1,0,0|2,0,0]=3 12 B17R2.3231 O=C(/C=C/C1=CC=CC=C1)N2CC[C@H](C2)O CNP0591915.2 [0,0,0,1,0,0|2,0,0]=3 13 B15R1.503 CC(C)CCOC(=O)CCC1=CC=CO1 CNP0277016.0 [0,0,0,0,1,0|1,0,2]=4 14 B15R1.1081 CC(C)CCOC(=O)CC1=CC=CC=C1 CNP0279445.0 [0,0,0,0,1,0|0,0,1]=2 15 B15R1.1081 CN(C)CCOC(=NC1=CC=CC=C1)S CNP0611501.0 [0,0,0,0,1,0|2,1,0]=4 16 B15R1.1081 CN(C)CCOC(=S)NC1=CC=CC=C1 CNP0416285.0 [0,0,0,0,1,0|2,1,0]=4 17 B15R1.5919 CC(C)CNC(=O)C=CC1=CC=CC=C1 CNP0581871.0 [0,0,0,0,1,0|1,0,0]=2 18 B15R1.5919 CC(C)COC(=O)C=CC1=CC=CC=C1 CNP0079856.0 [0,0,0,0,1,0|0,0,0]=1 19 B15R1.5919 CC(C)COC(=O)CCC1=CC=CC=C1 CNP0591880.0 [0,0,0,0,1,0|0,0,2]=3 20 B15R1.5919 CN(C)C=CC(=O)C=CC1=CC=CC=C1 CNP0287098.0 [0,0,0,0,1,0|1,0,2]=4 21 B14R1.156 C=CCOC(=O)C=CC1=CC=CC=C1 CNP0240721.0 [2,0,0,0,0,0|0,0,2]=4 22 B14R1.156 CCCCC(=O)OCC1=CC=CC=C1 CNP0222285.0 [2,0,0,0,0,0|1,0,1]=4 23 B14R1.156 CCCOC(=O)C=CC1=CC=CC=C1 CNP0077243.0 [2,0,0,0,0,0|0,0,0]=2 24 B14R1.156 CCCOC(=O)CCC1=CC=CC=C1 CNP0546590.0 [2,0,0,0,0,0|0,0,2]=4 25 B14R1.156 O=C(C=CC1=CC=CC=C1)NCCO CNP0209791.0 [2,0,0,0,0,0|2,0,0]=4 26 B16R1.688 CCCCCNC(=O)C=CC1=CC=CC=C1 CNP0232825.0 [1,1,0,0,0,0|1,0,0]=3 27 B16R1.688 NCCCCNC(=O)C=CC1=CC=CC=C1 CNP0608679.0 [1,1,0,0,0,0|1,0,0]=3 28 B16R1.1343 CCC(C)COC(=O)CCC1=CC=CC=C1 CNP0599490.0 [1,1,0,0,0,0|0,0,2]=4 29 B16R1.1516 CCCCC(C)C(=O)C=CC1=CC=CC=C1 CNP0076413.0 [1,1,0,0,0,0|1,0,0]=3 30 B16R1.1516 CSCCN(C)C(=O)C=CC1=CC=CC=C1 CNP0253379.0 [1,1,0,0,0,0|2,0,0]=4 31 B16R1.4131 C[C@H](O)[C@@H](C)C/C=C/C=C/C1=CC=CC=C1 CNP0306848.1 [1,1,0,0,0,0|2,0,0]=4 32 B16R1.4131 C[C@H](O)[C@@H](C)C/C=C\C=C\C1=CC=CC=C1 CNP0306848.2 [1,1,0,0,0,0|2,0,0]=4 33 B16R1.6929 CC(C)CC(=O)OCC=CC1=CC=CC=C1 CNP0129513.0 [1,1,0,0,0,0|0,0,2]=4 34 B16R1.1061 CC(C)CNC(=O)C=CC1=CC=C(C=C1)Cl CNP0531598.0 [0,1,0,0,1,0|1,0,0]=3 35 B16R1.4122 C[C@H](O)[C@H](C)OC(=O)/C=C/C1=CC=CC=C1 CNP0234931.1 [0,1,0,0,1,0|1,0,0]=3 36 B16R1.4122 C[C@H](O)[C@H](C)OC(=O)/C=C\C1=CC=CC=C1 CNP0234931.2 [0,1,0,0,1,0|1,0,0]=3 37 B18R1.979 CC(C)CCCOC(=O)CCC1=CC=C(C=C1)O CNP0264964.0 [0,1,0,0,0,1|0,0,2]=4 38 B18R1.219 COC1=CC=C(C=C1)C=CC(=O)OCCC(C)C CNP0257679.0 [0,2,0,0,0,0|0,0,0]=2 39 B18R1.978 C[N+](C)(C)CCOC(=O)C=CC1=CC=C(C=C1)O CNP0609384.0 [0,2,0,0,0,0|1,0,0]=3 40 B18R1.9308 C[C@@H](O)C[C@H](C)OC(=O)/C=C/C1=CC=C(C=C1)O CNP0316737.1 [0,2,0,0,0,0|1,0,0]=3 41 B18R1.32338 C=C(C)CCOC(=O)C=CC1=CC=C(C(=C1)O)O CNP0304401.0 [0,2,0,0,0,0|0,0,2]=4 42 B18R1.32338 CC(=CCOC(=O)C=CC1=CC=C(C(=C1)O)O)C CNP0264553.0 [0,2,0,0,0,0|0,0,2]=4 43 B18R1.32338 CC(C)CCOC(=O)C=CC1=CC=C(C(=C1)O)O CNP0078087.0 [0,2,0,0,0,0|0,0,0]=2 44 B18R1.34914 O=C(/C=C/C1=CC=CC=C1)OC[C@@H](O)[C@@H](O)CO CNP0489564.1 [0,2,0,0,0,0|1,0,0]=3 45 B16R2.2238 O=C(C=CC1=CC=CC=C1)N2CCCC2 CNP0192642.0 [1,0,0,1,0,0|1,0,0]=3 46 B16R2.2441 CCCCCC1=CC=C2C=CC=CC2=N1 CNP0150480.0 [1,0,0,1,0,0|2,0,0]=4 47 B16R2.477 CC(C)CCC1=CC=C2C=CC=CC2=C1 CNP0201965.0 [0,0,0,1,1,0|1,0,0]=3 48 B16R2.477 CC(C)COC1=CC=C2C=CC=CC2=C1 CNP0362324.0 [0,0,0,1,1,0|1,0,0]=3 49 B18R2.7182 CN(C)CCNC(=O)C1=CNC2=CC=CC=C12 CNP0162911.0 [0,0,0,1,0,1|2,0,0]=4 50 B18R2.31386 CC(C)CCOC1=CC=C2C=CC(=O)OC2=C1 CNP0495065.0 [0,1,0,1,0,0|2,0,0]=4 51 B18R2.3787 O=C(/C=C/C1=CC=CC=C1)N2C[C@@H]([C@H](C2)O)O CNP0303189.1 [0,1,0,1,0,0|2,0,0]=4 52 B14R1.158 CCCCOC(=O)CC1=CC=CC=C1 CNP0002492.0 [1,0,0,0,1,0|0,0,1]=3 53 B14R1.422 CC(C)CCOCCC1=CC=CC=C1 CNP0002392.0 [1,0,0,0,1,0|0,0,2]=4 54 B14R1.420 CC(=CCOC(=O)C1=CC=CC=C1)C CNP0611701.0 [0,0,0,0,2,0|0,0,2]=4 55 B14R1.420 CC(C)CCOC(=O)C1=CC=CC=C1 CNP0347277.0 [0,0,0,0,2,0|0,0,0]=2 56 B14R1.420 CN(C)CCOC(=O)C1=CC=CC=C1 CNP0453289.0 [0,0,0,0,2,0|1,0,0]=3 57 B14R1.423 CC(C)CNC(=O)CC1=CC=CC=C1 CNP0428187.0 [0,0,0,0,2,0|1,0,1]=4 58 B14R1.423 CC(C)COC(=O)CC1=CC=CC=C1 CNP0003033.0 [0,0,0,0,2,0|0,0,1]=3 59 B14R1.818 CC(C)CC(=O)OCC1=CC=CC=C1 CNP0227794.0 [0,0,0,0,2,0|1,0,1]=4 60 B14R1.818 CC(C)OC(=O)C=CC1=CC=CC=C1 CNP0180499.0 [0,0,0,0,2,0|0,0,0]=2 61 B14R1.818 CC(C)OC(=O)CCC1=CC=CC=C1 CNP0542232.0 [0,0,0,0,2,0|0,0,2]=4 62 B16R1.1694 CCCCOC(=O)NCCC1=CC=CC=C1 CNP0288242.0 [1,0,0,0,0,1|0,0,2]=4