0 B17R2.915365 C=C(C)c1ccc2c(c1)C(=O)CC(O2)(C)C 271570a_100000694244_100000725310 [1,0,0,0,0,0|1,0,2]=4 1 B19R2.36451 CC(=O)c1ccc2c(c1)C(C(C(O2)(C)C)O[13CH3])N 34a_200121597685_200025704644 [0,1,0,0,0,0|1,0,0]=2 2 B19R2.36451 COC1C(c2cc(ccc2OC1(C)C)C(=O)C)N 34a_200121597685_200000210301 [0,1,0,0,0,0|1,0,0]=2 3 B17R1.5359 C#CC(C)(C)Oc1ccc(cc1CCl)C(=O)C 34a_100000010293_100000038118 [0,0,1,0,0,0|2,0,1]=4 4 B17R1.5359 CC(=O)c1ccc(c(c1)C#N)NC(C)(C)CO 27a_100000210608_100010125495 [0,0,1,0,0,0|2,0,1]=4 5 B17R1.5359 CC(=O)c1ccc(c(c1)CCl)OC(C)(C)C#N 34a_100000010293_100011162410 [0,0,1,0,0,0|2,0,1]=4 6 B17R1.5359 CC(=O)c1ccc(c(c1)CCl)OC(C)(C)C#N 7a_100000010293_100011162410 [0,0,1,0,0,0|2,0,1]=4 7 B17R1.5359 CC(=O)c1ccc(c(c1)CO)OC(C)(C)C#N 7a_100000025453_100011162410 [0,0,1,0,0,0|1,0,1]=3 8 B17R1.5359 CCC(C)(C)Oc1ccc(cc1CCl)C(=O)C 7a_100000010293_100000210677 [0,0,1,0,0,0|2,0,0]=3 9 B17R1.5359 CCC(C)(C)Oc1ccc(cc1CO)C(=O)C 7a_100000025453_100000210677 [0,0,1,0,0,0|1,0,0]=2 10 B17R1.5359 CCC(C)(C)Oc1ccc(cc1CO)[N+](=O)[O-] 7a_100011215696_100000210677 [0,0,1,0,0,0|3,0,0]=4 11 B17R1.5359 CCC(C)(C)Oc1ccc(cc1OC)C(=O)C 7a_100000186468_100000210677 [0,0,1,0,0,0|3,0,0]=4 12 B16R1.1020 CC(=O)c1ccc(c(c1)[C@@H](N)CC(C)C)Br 271570a_100015190218_100010146556 [1,0,1,0,0,0|2,0,0]=4 13 B16R1.1020 CC(=O)c1ccc(c(c1)[C@@H](N)CC(C)C)C 271570a_100015190218_100011934287 [1,0,1,0,0,0|2,0,0]=4 14 B16R1.1020 CC(=O)c1ccc(c(c1)[C@@H](N)CC(C)C)F 271570a_100015190218_100000239719 [1,0,1,0,0,0|2,0,0]=4 15 B16R1.1020 CC(=O)c1ccc(c(c1)[C@@H](N)CC(C)C)N 271570a_100015190218_100012029215 [1,0,1,0,0,0|2,0,0]=4 16 B16R1.1020 CC(=O)c1ccc(c(c1)[C@@H](N)CC(C)C)O 271570a_100015190218_100011772453 [1,0,1,0,0,0|1,0,0]=3 17 B16R1.1046 CC(=O)c1ccc(c(c1)CN(C)C(C)C)O 269982a_200000211004_100000010293 [1,0,1,0,0,0|2,0,0]=4 18 B16R1.645 C=CCc1cc(ccc1OC(C)C)C(=O)C 7a_200000038806_100000210206 [1,0,1,0,0,0|1,0,1]=4 19 B16R1.28 CC(=O)c1ccc(c(c1)CCl)OC(C)(C)C 34a_100000010293_100000210625 [1,0,1,0,0,0|1,0,0]=3 20 B16R1.28 CC(C)(C)Oc1ccc(cc1CO)[N+](=O)[O-] 34a_100011215696_100000210625 [1,0,1,0,0,0|2,0,0]=4 21 B16R1.28 COc1cc(ccc1OC(C)(C)C)C(=O)C 34a_100000186468_100000210625 [1,0,1,0,0,0|2,0,0]=4 22 B16R1.18493 CC(=O)c1ccc(c(c1)CCl)OC(C)CO 34a_100000010293_100012180447 [1,0,1,0,0,0|1,0,0]=3 23 B16R1.18493 CC(=O)c1ccc(c(c1)CCl)OC(C)CO 7a_100000010293_100012180447 [1,0,1,0,0,0|1,0,0]=3 24 B16R1.18493 CC(=O)c1ccc(c(c1)CO)OC(C)C#N 7a_100000025453_100000703298 [1,0,1,0,0,0|1,0,1]=4 25 B16R1.18493 CC(=O)c1ccc(c(c1)CO)OC(C)CO 7a_100000025453_100012180447 [1,0,1,0,0,0|0,0,0]=2 26 B16R1.18493 CC(CO)Oc1ccc(cc1CO)[N+](=O)[O-] 34a_100011215696_100012180447 [1,0,1,0,0,0|2,0,0]=4 27 B16R1.18493 CC(CO)Oc1ccc(cc1CO)[N+](=O)[O-] 7a_100011215696_100012180447 [1,0,1,0,0,0|2,0,0]=4 28 B16R1.18493 CCC(C)Oc1ccc(cc1CCl)C(=O)C 34a_100000010293_100011215416 [1,0,1,0,0,0|2,0,0]=4 29 B16R1.18493 CCC(C)Oc1ccc(cc1CCl)C(=O)C 7a_100000010293_100000758301 [1,0,1,0,0,0|2,0,0]=4 30 B16R1.18493 CCC(C)Oc1ccc(cc1CO)C(=O)C 7a_100000025453_100000758301 [1,0,1,0,0,0|1,0,0]=3 31 B16R1.18493 COc1cc(ccc1OC(C)CO)C(=O)C 34a_100000186468_100012180447 [1,0,1,0,0,0|2,0,0]=4 32 B16R1.18493 COc1cc(ccc1OC(C)CO)C(=O)C 7a_100000186468_100012180447 [1,0,1,0,0,0|2,0,0]=4 33 B16R1.30265 C#CC(C)(C)Oc1ccc(cc1C)C(=O)C 34a_100000188726_100000038118 [1,0,1,0,0,0|1,0,1]=4 34 B16R1.30265 CC(=O)c1ccc(c(c1)C)OC(C)(C)C#N 34a_100000188726_100011162410 [1,0,1,0,0,0|1,0,1]=4 35 B16R1.30265 CC(=O)c1ccc(c(c1)C)OC(C)(C)C#N 7a_100000188726_100011162410 [1,0,1,0,0,0|1,0,1]=4 36 B16R1.30265 CC(=O)c1cnc(c(c1)C)NC(C)(C)CO 27a_100000210608_100009864263 [1,0,1,0,0,0|2,0,0]=4 37 B16R1.30265 CCC(C)(C)Oc1ccc(cc1Br)C(=O)C 7a_100011772453_100000210677 [1,0,1,0,0,0|2,0,0]=4 38 B16R1.30265 CCC(C)(C)Oc1ccc(cc1C)C(=O)C 7a_100000188726_100000210677 [1,0,1,0,0,0|1,0,0]=3 39 B16R1.30265 CCC(C)(C)Oc1ccc(cc1Cl)C(=O)C 7a_100000188625_100000210677 [1,0,1,0,0,0|2,0,0]=4 40 B16R1.30265 CCC(C)(C)Oc1ccc(cc1F)C(=O)C 7a_100000751691_100000210677 [1,0,1,0,0,0|2,0,0]=4 41 B16R1.30265 CCC(C)(C)Oc1ccc(cc1N)C(=O)C 7a_100000117292_100000210677 [1,0,1,0,0,0|2,0,0]=4 42 B16R1.30265 CCC(C)(C)Sc1ccc(cc1C)C(=O)C 62a_100000032637_100000697869 [1,0,1,0,0,0|1,1,0]=4 43 B16R1.30265 CCC(C)(C)Sc1ccc(cc1C)C(=O)C 62a_100000697869_100000032637 [1,0,1,0,0,0|1,1,0]=4 44 B16R1.30265 Cc1cc(ccc1NC(C)(C)CO)C(=O)N 27a_100000210608_100011218126 [1,0,1,0,0,0|2,0,0]=4 45 B16R1.32029 CCC(C)(C)Sc1ccc(cc1CO)C=O 62a_100000032637_100015639582 [1,0,1,0,0,0|1,1,0]=4 46 B16R1.32029 CCC(C)(C)Sc1ccc(cc1CO)C=O 62a_100015639582_100000032637 [1,0,1,0,0,0|1,1,0]=4 47 B16R1.12397 CC(=O)c1cccc(c1)CC(=O)C(C)(C)O 1458a_100000242741_100000084091 [1,0,1,0,0,0|0,0,2]=4 48 B16R1.12329 CC(=O)c1ccc(cc1)OC(C)(C)C(=O)C 7a_100000185113_100000075568 [1,0,1,0,0,0|0,0,2]=4 49 B16R1.61942 CC(=O)c1ccc(nc1)NC(C)(C)CCO 27a_100000763138_100000690552 [1,0,1,0,0,0|2,0,0]=4 50 B16R1.61942 CC(C)(CCO)Nc1ccc(cc1)C(=O)N 27a_100000763138_100000162191 [1,0,1,0,0,0|2,0,0]=4 51 B16R2.27376 C=C(C)c1ccc2c(c1)NCC(O2)(C)C 271570a_100000694244_200012343274 [2,0,0,0,0,0|2,0,0]=4 52 B18R1.5580 CC(=O)c1ccc(c(c1)CO)OC(C)(C)C(=O)C 7a_100000025453_100000075568 [0,1,1,0,0,0|0,0,2]=4 53 B18R1.5580 CC(=O)c1ccc(c(c1)CO)OC(C)(C)C(=O)N 7a_100000025453_100000702505 [0,1,1,0,0,0|0,0,2]=4 54 B18R1.22092 C=CCc1cc(ccc1OC(C)(C)CC)C(=O)C 7a_200000038806_100000210677 [0,1,1,0,0,0|2,0,0]=4 55 B18R1.62708 CC(C)(C#N)Oc1ccc(cc1CO)C(=O)CBr 7a_100010262812_100011162410 [0,1,1,0,0,0|1,0,1]=4 56 B18R1.62708 CCC(C)(C)Oc1ccc(cc1CO)C(=O)CBr 7a_100010262812_100000210677 [0,1,1,0,0,0|1,0,0]=3 57 B18R1.62708 CCC(C)(C)Sc1ccc(cc1CO)C(=O)OC 62a_100000032637_100010201863 [0,1,1,0,0,0|1,1,0]=4 58 B18R1.62708 CCC(C)(C)Sc1ccc(cc1CO)C(=O)OC 62a_100010201863_100000032637 [0,1,1,0,0,0|1,1,0]=4 59 B18R1.62770 CCC(C)(CC)Oc1ccc(cc1CCl)C(=O)C 7a_100000010293_100009817345 [0,1,1,0,0,0|2,0,0]=4 60 B18R1.62770 CCC(C)(CC)Oc1ccc(cc1CO)C(=O)C 7a_100000025453_100009817345 [0,1,1,0,0,0|1,0,0]=3 61 B20R2.2205613 CC(=O)c1ccc2c(c1)C(C(C(O2)(C)C)OCF)N 34a_200121597685_100015361967 [0,2,0,0,0,0|1,0,0]=3 62 B20R2.2205613 CCOC1C(c2cc(ccc2OC1(C)C)C(=O)C)N 34a_200121597685_100000210202 [0,2,0,0,0,0|1,0,0]=3 63 B18R1.282202 CC(=O)c1ccc(c(c1)CCl)OCC(C)(C)CO 34a_100000010293_100009813988 [0,0,1,0,0,1|1,0,0]=3 64 B18R1.282202 CC(=O)c1ccc(c(c1)CCl)OCC(C)(C)CO 7a_100000010293_100009813988 [0,0,1,0,0,1|1,0,0]=3 65 B18R1.282202 CC(=O)c1ccc(c(c1)CO)OCC(C)(C)CO 7a_100000025453_100009813988 [0,0,1,0,0,1|0,0,0]=2 66 B18R1.282202 CC(C)(CO)COc1ccc(cc1CO)[N+](=O)[O-] 34a_100011215696_100009813988 [0,0,1,0,0,1|2,0,0]=4 67 B18R1.282202 CC(C)(CO)COc1ccc(cc1CO)[N+](=O)[O-] 7a_100011215696_100009813988 [0,0,1,0,0,1|2,0,0]=4 68 B18R1.282202 CCc1cc(ccc1COC(C)(C)CC)C(=O)C 7a_100009829543_100000210677 [0,0,1,0,0,1|2,0,0]=4 69 B18R1.282202 COc1cc(ccc1OCC(C)(C)CO)C(=O)C 34a_100000186468_100009813988 [0,0,1,0,0,1|2,0,0]=4 70 B18R1.282202 COc1cc(ccc1OCC(C)(C)CO)C(=O)C 7a_100000186468_100009813988 [0,0,1,0,0,1|2,0,0]=4