0 B16R2.12 CC(=O)C(C)Sc1c[nH]c2c1cccn2 62a_100009814033_100011934613 [0,0,0,0,0,0|3,0,0]=3 1 B16R2.12 CC(=O)C(C)Sc1c[nH]c2c1cncn2 62a_100009814033_100000072862 [0,0,0,0,0,0|4,0,0]=4 2 B16R2.12 CC(=O)C(C)Sc1c[nH]c2c1cncn2 62a_100009817560_100009814033 [0,0,0,0,0,0|4,0,0]=4 3 B16R2.12 CC(=O)C(C)Sc1c[nH]c2c1nccn2 62a_100009814033_100009819587 [0,0,0,0,0,0|4,0,0]=4 4 B16R2.12 CC(=O)C(C)Sc1csc2c1cccn2 62a_100009814033_100009830249 [0,0,0,0,0,0|4,0,0]=4 5 B16R2.12 CC(=O)C(C)Sc1csc2c1cccn2 62a_100009830249_100009814033 [0,0,0,0,0,0|4,0,0]=4 6 B16R2.12 CC(=O)C(C)Sc1n[nH]c2c1cccn2 62a_100009814033_100009888962 [0,0,0,0,0,0|4,0,0]=4 7 B16R2.12 CC(Sc1c[nH]c2c1cccn2)C(=O)N 62a_100000702099_100011934613 [0,0,0,0,0,0|3,0,0]=3 8 B16R2.12 CC(Sc1c[nH]c2c1cncn2)C(=O)N 62a_100000702099_100000072862 [0,0,0,0,0,0|4,0,0]=4 9 B16R2.12 CC(Sc1c[nH]c2c1cncn2)C(=O)N 62a_100009817560_100000702099 [0,0,0,0,0,0|4,0,0]=4 10 B16R2.12 CC(Sc1c[nH]c2c1nccn2)C(=O)N 62a_100000702099_100009819587 [0,0,0,0,0,0|4,0,0]=4 11 B16R2.12 CC(Sc1csc2c1cccn2)C(=O)N 62a_100000702099_100009830249 [0,0,0,0,0,0|4,0,0]=4 12 B16R2.12 CC(Sc1csc2c1cccn2)C(=O)N 62a_100009830249_100000702099 [0,0,0,0,0,0|4,0,0]=4 13 B16R2.12 CC(Sc1n[nH]c2c1cccn2)C(=O)N 62a_100000702099_100009888962 [0,0,0,0,0,0|4,0,0]=4 14 B16R2.12 C[C@@H](Nc1n[nH]c2c1cccn2)C(=O)N 27a_100000119354_100009818534 [0,0,0,0,0,0|4,0,0]=4 15 B16R2.12 NC(=O)C(F)Sc1c[nH]c2c1cccn2 62a_100009813875_100011934613 [0,0,0,0,0,0|3,0,0]=3 16 B16R2.12 NC(=O)C(F)Sc1c[nH]c2c1cncn2 62a_100009813875_100000072862 [0,0,0,0,0,0|4,0,0]=4 17 B16R2.12 NC(=O)C(F)Sc1c[nH]c2c1cncn2 62a_100009817560_100009813875 [0,0,0,0,0,0|4,0,0]=4 18 B16R2.12 NC(=O)C(F)Sc1c[nH]c2c1nccn2 62a_100009813875_100009819587 [0,0,0,0,0,0|4,0,0]=4 19 B16R2.12 NC(=O)C(F)Sc1csc2c1cccn2 62a_100009813875_100009830249 [0,0,0,0,0,0|4,0,0]=4 20 B16R2.12 NC(=O)C(F)Sc1csc2c1cccn2 62a_100009830249_100009813875 [0,0,0,0,0,0|4,0,0]=4 21 B16R2.12 NC(=O)C(F)Sc1n[nH]c2c1cccn2 62a_100009813875_100009888962 [0,0,0,0,0,0|4,0,0]=4 22 B16R2.12 O=C([O-])C(F)Sc1c[nH]c2c1cccn2 62a_100020610796_100011934613 [0,0,0,0,0,0|2,0,1]=3 23 B16R2.12 O=C([O-])C(F)Sc1c[nH]c2c1cncn2 62a_100009817560_100020610796 [0,0,0,0,0,0|3,0,1]=4 24 B16R2.12 O=C([O-])C(F)Sc1c[nH]c2c1cncn2 62a_100020610796_100000072862 [0,0,0,0,0,0|3,0,1]=4 25 B16R2.12 O=C([O-])C(F)Sc1c[nH]c2c1nccn2 62a_100020610796_100009819587 [0,0,0,0,0,0|3,0,1]=4 26 B16R2.12 O=C([O-])C(F)Sc1csc2c1cccn2 62a_100009830249_100020610796 [0,0,0,0,0,0|3,0,1]=4 27 B16R2.12 O=C([O-])C(F)Sc1csc2c1cccn2 62a_100020610796_100009830249 [0,0,0,0,0,0|3,0,1]=4 28 B16R2.12 O=C([O-])C(F)Sc1n[nH]c2c1cccn2 62a_100020610796_100009888962 [0,0,0,0,0,0|3,0,1]=4 29 B15R2.4 C=CC(C)Sc1c[nH]c2c1cccn2 62a_100011215867_100011934613 [1,0,0,0,0,0|3,0,0]=4 30 B15R2.4 CC(CO)Sc1c[nH]c2c1cccn2 62a_100012180447_100011934613 [1,0,0,0,0,0|2,0,1]=4 31 B15R2.4 C[C@H](CO)Sc1c[nH]c2c1cccn2 62a_100016084084_100011934613 [1,0,0,0,0,0|2,0,1]=4 32 B15R2.6 C=C(C)CSc1c[nH]c2c1cccn2 62a_100000748629_100011934613 [1,0,0,0,0,0|3,0,0]=4 33 B15R2.6 C=C(F)CSc1c[nH]c2c1cccn2 62a_100000042424_100011934613 [1,0,0,0,0,0|3,0,0]=4 34 B15R2.6 CC(=O)CCc1c[nH]c2c1cccc2 1458a_100000070787_100011218569 [1,0,0,0,0,0|2,0,0]=3 35 B15R2.6 CC(=O)CCc1c[nH]c2c1cccc2 1458a_100000211458_200000210301 [1,0,0,0,0,0|2,0,0]=3 36 B15R2.6 CC(=O)CCc1c[nH]c2c1cccn2 1458a_100000070787_100009895007 [1,0,0,0,0,0|1,0,0]=2 37 B15R2.6 CC(=O)CCc1c[nH]c2c1cccn2 1458a_100102525369_200000210301 [1,0,0,0,0,0|1,0,0]=2 38 B15R2.6 CC(=O)NCc1c[nH]c2c1cccc2 240690a_100015202335_100015343762 [1,0,0,0,0,0|3,0,0]=4 39 B15R2.6 CC(=O)NCc1c[nH]c2c1cccc2 527a_100015202335_100103153847 [1,0,0,0,0,0|3,0,0]=4 40 B15R2.6 CC(O)CSc1c[nH]c2c1cccn2 62a_100011218427_100011934613 [1,0,0,0,0,0|2,0,1]=4 41 B15R2.6 CN(C)CCc1c[nH]c2c1cccn2 2230a_100102631434_100009895007 [1,0,0,0,0,0|3,0,0]=4 42 B15R2.6 CN(C)CCc1c[nH]c2c1cccn2 269982a_100102631434_100009895007 [1,0,0,0,0,0|3,0,0]=4 43 B15R2.6 C[C@@H](O)CSc1c[nH]c2c1cccn2 62a_100009817552_100011934613 [1,0,0,0,0,0|2,0,1]=4 44 B15R2.6 NC(=O)CSc1c[nH]c2c1cccn2 62a_100000747473_100011934613 [1,0,0,0,0,0|2,0,0]=3 45 B15R2.6 NC(=O)CSc1c[nH]c2c1cncn2 62a_100000747473_100000072862 [1,0,0,0,0,0|3,0,0]=4 46 B15R2.6 NC(=O)CSc1c[nH]c2c1cncn2 62a_100009817560_100000747473 [1,0,0,0,0,0|3,0,0]=4 47 B15R2.6 NC(=O)CSc1c[nH]c2c1nccn2 62a_100000747473_100009819587 [1,0,0,0,0,0|3,0,0]=4 48 B15R2.6 NC(=O)CSc1csc2c1cccn2 62a_100000747473_100009830249 [1,0,0,0,0,0|3,0,0]=4 49 B15R2.6 NC(=O)CSc1csc2c1cccn2 62a_100009830249_100000747473 [1,0,0,0,0,0|3,0,0]=4 50 B15R2.6 NC(=O)CSc1n[nH]c2c1cccn2 62a_100000747473_100009888962 [1,0,0,0,0,0|3,0,0]=4 51 B15R2.6 O=C([O-])CSc1c[nH]c2c1cccn2 62a_100020667443_100011934613 [1,0,0,0,0,0|1,0,1]=3 52 B15R2.6 O=C([O-])CSc1c[nH]c2c1cncn2 62a_100009817560_100020667443 [1,0,0,0,0,0|2,0,1]=4 53 B15R2.6 O=C([O-])CSc1c[nH]c2c1cncn2 62a_100020667443_100000072862 [1,0,0,0,0,0|2,0,1]=4 54 B15R2.6 O=C([O-])CSc1c[nH]c2c1nccn2 62a_100020667443_100009819587 [1,0,0,0,0,0|2,0,1]=4 55 B15R2.6 O=C([O-])CSc1csc2c1cccn2 62a_100009830249_100020667443 [1,0,0,0,0,0|2,0,1]=4 56 B15R2.6 O=C([O-])CSc1csc2c1cccn2 62a_100020667443_100009830249 [1,0,0,0,0,0|2,0,1]=4 57 B15R2.6 O=C([O-])CSc1n[nH]c2c1cccn2 62a_100020667443_100009888962 [1,0,0,0,0,0|2,0,1]=4 58 B15R2.6 [13CH3]C(=O)CCc1c[nH]c2c1cccc2 1458a_100000211458_200025704644 [1,0,0,0,0,0|2,0,0]=3 59 B15R2.6 [13CH3]C(=O)CCc1c[nH]c2c1cccn2 1458a_100102525369_200025704644 [1,0,0,0,0,0|1,0,0]=2 60 B17R2.7 CCC(=O)C(C)Sc1c[nH]c2c1cccn2 62a_100000742827_100011934613 [0,1,0,0,0,0|3,0,0]=4 61 B17R2.7 CNC(=O)C(C)Sc1c[nH]c2c1cccn2 62a_100000209862_100011934613 [0,1,0,0,0,0|3,0,0]=4 62 B17R2.7 CNC(=O)C(F)Sc1c[nH]c2c1cccn2 62a_100009813575_100011934613 [0,1,0,0,0,0|3,0,0]=4 63 B17R2.7 COC(=O)C(C)Sc1c[nH]c2c1cccn2 62a_100000211248_100011934613 [0,1,0,0,0,0|2,0,0]=3 64 B17R2.7 COC(=O)C(C)Sc1c[nH]c2c1cncn2 62a_100000211248_100000072862 [0,1,0,0,0,0|3,0,0]=4 65 B17R2.7 COC(=O)C(C)Sc1c[nH]c2c1cncn2 62a_100009817560_100000211248 [0,1,0,0,0,0|3,0,0]=4 66 B17R2.7 COC(=O)C(C)Sc1c[nH]c2c1nccn2 62a_100000211248_100009819587 [0,1,0,0,0,0|3,0,0]=4 67 B17R2.7 COC(=O)C(C)Sc1csc2c1cccn2 62a_100000211248_100009830249 [0,1,0,0,0,0|3,0,0]=4 68 B17R2.7 COC(=O)C(C)Sc1csc2c1cccn2 62a_100009830249_100000211248 [0,1,0,0,0,0|3,0,0]=4 69 B17R2.7 COC(=O)C(C)Sc1n[nH]c2c1cccn2 62a_100000211248_100009888962 [0,1,0,0,0,0|3,0,0]=4 70 B17R2.138 CC(=O)C(C)(C)Sc1c[nH]c2c1cccn2 62a_100000075568_100011934613 [0,1,0,0,0,0|3,0,0]=4 71 B17R2.138 CC(C)(Sc1c[nH]c2c1cccn2)C(=O)N 62a_100000702505_100011934613 [0,1,0,0,0,0|3,0,0]=4 72 B17R2.138 NC(=O)C(F)(F)Sc1c[nH]c2c1cccn2 62a_100009811971_100011934613 [0,1,0,0,0,0|3,0,0]=4 73 B17R2.138 O=C([O-])C(F)(F)Sc1c[nH]c2c1cccn2 62a_100000745680_100011934613 [0,1,0,0,0,0|2,0,1]=4 74 B17R2.289 CCC(Sc1c[nH]c2c1cccn2)C(=O)N 62a_100000750255_100011934613 [0,1,0,0,0,0|3,0,0]=4 75 B17R2.289 CN[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N 2230a_100015190000_200000210301 [0,1,0,0,0,0|2,0,0]=3 76 B17R2.289 [13CH3]N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N 2230a_100015190000_200025704644 [0,1,0,0,0,0|2,0,0]=3 77 B17R2.3450 CC(=O)C(C)Sc1c[nH]c2c1ccc(n2)Cl 62a_100009814033_100010168512 [0,1,0,0,0,0|3,0,0]=4 78 B17R2.3450 CC(=O)C(C)Sc1c[nH]c2c1ccc(n2)F 62a_100009814033_100010168364 [0,1,0,0,0,0|3,0,0]=4 79 B17R2.3450 CC(Sc1c[nH]c2c1ccc(n2)Cl)C(=O)N 62a_100000702099_100010168512 [0,1,0,0,0,0|3,0,0]=4 80 B17R2.3450 CC(Sc1c[nH]c2c1ccc(n2)F)C(=O)N 62a_100000702099_100010168364 [0,1,0,0,0,0|3,0,0]=4 81 B17R2.3450 NC(=O)C(F)Sc1c[nH]c2c1ccc(n2)Cl 62a_100009813875_100010168512 [0,1,0,0,0,0|3,0,0]=4 82 B17R2.3450 NC(=O)C(F)Sc1c[nH]c2c1ccc(n2)F 62a_100009813875_100010168364 [0,1,0,0,0,0|3,0,0]=4 83 B17R2.3450 O=C([O-])C(F)Sc1c[nH]c2c1ccc(n2)Cl 62a_100020610796_100010168512 [0,1,0,0,0,0|2,0,1]=4 84 B17R2.3450 O=C([O-])C(F)Sc1c[nH]c2c1ccc(n2)F 62a_100020610796_100010168364 [0,1,0,0,0,0|2,0,1]=4 85 B17R2.5003 CC(=O)C(C)Sc1c([nH]c2c1cccn2)C 62a_100009814033_100010174266 [0,1,0,0,0,0|3,0,0]=4 86 B17R2.5003 Cc1[nH]c2ncccc2c1SC(C)C(=O)N 62a_100000702099_100010174266 [0,1,0,0,0,0|3,0,0]=4 87 B17R2.5003 Cc1[nH]c2ncccc2c1SC(F)C(=O)N 62a_100009813875_100010174266 [0,1,0,0,0,0|3,0,0]=4 88 B17R2.5003 Cc1[nH]c2ncccc2c1SC(F)C(=O)[O-] 62a_100020610796_100010174266 [0,1,0,0,0,0|2,0,1]=4 89 B17R2.25461 CC(=O)C(C)Sc1c[nH]c2c1cc(cn2)Br 62a_100009814033_100011290788 [0,1,0,0,0,0|3,0,0]=4 90 B17R2.25461 CC(=O)C(C)Sc1c[nH]c2c1cc(cn2)Br 62a_100011290788_100009814033 [0,1,0,0,0,0|3,0,0]=4 91 B17R2.25461 CC(=O)C(C)Sc1c[nH]c2c1cc(cn2)C 62a_100009814033_100010246215 [0,1,0,0,0,0|3,0,0]=4 92 B17R2.25461 CC(=O)C(C)Sc1c[nH]c2c1cc(cn2)Cl 62a_100009814033_100000050100 [0,1,0,0,0,0|3,0,0]=4 93 B17R2.25461 CC(=O)C(C)Sc1c[nH]c2c1cc(cn2)F 62a_100009814033_100010168383 [0,1,0,0,0,0|3,0,0]=4 94 B17R2.25461 CC(=O)C(C)Sc1c[nH]c2c1cc(cn2)N 62a_100009814033_100010168510 [0,1,0,0,0,0|3,0,0]=4 95 B17R2.25461 CC(Sc1c[nH]c2c1cc(cn2)Br)C(=O)N 62a_100000702099_100011290788 [0,1,0,0,0,0|3,0,0]=4 96 B17R2.25461 CC(Sc1c[nH]c2c1cc(cn2)Br)C(=O)N 62a_100011290788_100000702099 [0,1,0,0,0,0|3,0,0]=4 97 B17R2.25461 CC(Sc1c[nH]c2c1cc(cn2)Cl)C(=O)N 62a_100000702099_100000050100 [0,1,0,0,0,0|3,0,0]=4 98 B17R2.25461 CC(Sc1c[nH]c2c1cc(cn2)F)C(=O)N 62a_100000702099_100010168383 [0,1,0,0,0,0|3,0,0]=4 99 B17R2.25461 CC(Sc1c[nH]c2c1cc(cn2)N)C(=O)N 62a_100000702099_100010168510 [0,1,0,0,0,0|3,0,0]=4 100 B17R2.25461 Cc1cnc2[nH]cc(c2c1)SC(C)C(=O)N 62a_100000702099_100010246215 [0,1,0,0,0,0|3,0,0]=4 101 B17R2.25461 Cc1cnc2[nH]cc(c2c1)SC(F)C(=O)N 62a_100009813875_100010246215 [0,1,0,0,0,0|3,0,0]=4 102 B17R2.25461 Cc1cnc2[nH]cc(c2c1)SC(F)C(=O)[O-] 62a_100020610796_100010246215 [0,1,0,0,0,0|2,0,1]=4 103 B17R2.25461 NC(=O)C(F)Sc1c[nH]c2c1cc(cn2)Br 62a_100009813875_100011290788 [0,1,0,0,0,0|3,0,0]=4 104 B17R2.25461 NC(=O)C(F)Sc1c[nH]c2c1cc(cn2)Br 62a_100011290788_100009813875 [0,1,0,0,0,0|3,0,0]=4 105 B17R2.25461 NC(=O)C(F)Sc1c[nH]c2c1cc(cn2)Cl 62a_100009813875_100000050100 [0,1,0,0,0,0|3,0,0]=4 106 B17R2.25461 NC(=O)C(F)Sc1c[nH]c2c1cc(cn2)F 62a_100009813875_100010168383 [0,1,0,0,0,0|3,0,0]=4 107 B17R2.25461 NC(=O)C(F)Sc1c[nH]c2c1cc(cn2)N 62a_100009813875_100010168510 [0,1,0,0,0,0|3,0,0]=4 108 B17R2.25461 Nc1cnc2[nH]cc(c2c1)SC(F)C(=O)[O-] 62a_100020610796_100010168510 [0,1,0,0,0,0|2,0,1]=4 109 B17R2.25461 O=C([O-])C(F)Sc1c[nH]c2c1cc(cn2)Br 62a_100011290788_100020610796 [0,1,0,0,0,0|2,0,1]=4 110 B17R2.25461 O=C([O-])C(F)Sc1c[nH]c2c1cc(cn2)Br 62a_100020610796_100011290788 [0,1,0,0,0,0|2,0,1]=4 111 B17R2.25461 O=C([O-])C(F)Sc1c[nH]c2c1cc(cn2)Cl 62a_100020610796_100000050100 [0,1,0,0,0,0|2,0,1]=4 112 B17R2.25461 O=C([O-])C(F)Sc1c[nH]c2c1cc(cn2)F 62a_100020610796_100010168383 [0,1,0,0,0,0|2,0,1]=4 113 B17R2.37552 CC(=O)C(C)Sc1c[nH]c2c1c(ccn2)Br 62a_100009814033_100010212587 [0,1,0,0,0,0|3,0,0]=4 114 B17R2.37552 CC(=O)C(C)Sc1c[nH]c2c1c(ccn2)Br 62a_100010212587_100009814033 [0,1,0,0,0,0|3,0,0]=4 115 B17R2.37552 CC(=O)C(C)Sc1c[nH]c2c1c(ccn2)Cl 62a_100009814033_100011356983 [0,1,0,0,0,0|3,0,0]=4 116 B17R2.37552 CC(=O)C(C)Sc1c[nH]c2c1c(ccn2)F 62a_100009814033_100010168365 [0,1,0,0,0,0|3,0,0]=4 117 B17R2.37552 CC(Sc1c[nH]c2c1c(ccn2)Br)C(=O)N 62a_100000702099_100010212587 [0,1,0,0,0,0|3,0,0]=4 118 B17R2.37552 CC(Sc1c[nH]c2c1c(ccn2)Br)C(=O)N 62a_100010212587_100000702099 [0,1,0,0,0,0|3,0,0]=4 119 B17R2.37552 CC(Sc1c[nH]c2c1c(ccn2)Cl)C(=O)N 62a_100000702099_100011356983 [0,1,0,0,0,0|3,0,0]=4 120 B17R2.37552 CC(Sc1c[nH]c2c1c(ccn2)F)C(=O)N 62a_100000702099_100010168365 [0,1,0,0,0,0|3,0,0]=4 121 B17R2.37552 NC(=O)C(F)Sc1c[nH]c2c1c(ccn2)Br 62a_100009813875_100010212587 [0,1,0,0,0,0|3,0,0]=4 122 B17R2.37552 NC(=O)C(F)Sc1c[nH]c2c1c(ccn2)Br 62a_100010212587_100009813875 [0,1,0,0,0,0|3,0,0]=4 123 B17R2.37552 NC(=O)C(F)Sc1c[nH]c2c1c(ccn2)Cl 62a_100009813875_100011356983 [0,1,0,0,0,0|3,0,0]=4 124 B17R2.37552 NC(=O)C(F)Sc1c[nH]c2c1c(ccn2)F 62a_100009813875_100010168365 [0,1,0,0,0,0|3,0,0]=4 125 B17R2.37552 O=C([O-])C(F)Sc1c[nH]c2c1c(ccn2)Br 62a_100010212587_100020610796 [0,1,0,0,0,0|2,0,1]=4 126 B17R2.37552 O=C([O-])C(F)Sc1c[nH]c2c1c(ccn2)Br 62a_100020610796_100010212587 [0,1,0,0,0,0|2,0,1]=4 127 B17R2.37552 O=C([O-])C(F)Sc1c[nH]c2c1c(ccn2)Cl 62a_100020610796_100011356983 [0,1,0,0,0,0|2,0,1]=4 128 B17R2.37552 O=C([O-])C(F)Sc1c[nH]c2c1c(ccn2)F 62a_100020610796_100010168365 [0,1,0,0,0,0|2,0,1]=4 129 B17R2.78536 CC(=O)C(C)Sc1cn(c2c1cccn2)C 62a_100009814033_100010205794 [0,1,0,0,0,0|3,0,0]=4 130 B17R2.78536 CC(Sc1cn(c2c1cccn2)C)C(=O)N 62a_100000702099_100010205794 [0,1,0,0,0,0|3,0,0]=4 131 B17R2.78536 Cn1cc(c2c1nccc2)SC(F)C(=O)N 62a_100009813875_100010205794 [0,1,0,0,0,0|3,0,0]=4 132 B17R2.78536 Cn1cc(c2c1nccc2)SC(F)C(=O)[O-] 62a_100020610796_100010205794 [0,1,0,0,0,0|2,0,1]=4 133 B17R3.70 O=C1CCC1Sc2c[nH]c3c2cccn3 62a_100009892977_100011934613 [0,0,0,1,0,0|3,0,0]=4 134 B17R2.16 CC(=O)C(=O)CSc1c[nH]c2c1cccn2 62a_100011261029_100011934613 [0,0,0,0,0,1|2,0,1]=4 135 B17R2.16 C[C@H](NCc1csc2c1cccc2)C(=O)O 269956a_100000743915_200000742921 [0,0,0,0,0,1|3,0,0]=4 136 B17R2.39 CC(=O)OC(C)Sc1c[nH]c2c1cccn2 62a_100009818208_100011934613 [0,0,0,0,0,1|3,0,0]=4 137 B17R2.39 NC(=O)CC(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_100000187820 [0,0,0,0,0,1|2,0,1]=4 138 B17R2.39 O=C([O-])CC(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_100020667443 [0,0,0,0,0,1|1,0,2]=4 139 B14R2.2 CC(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_200000210301 [2,0,0,0,0,0|1,0,1]=4 140 B14R2.2 [13CH3]C(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_200025704644 [2,0,0,0,0,0|1,0,1]=4 141 B14R2.3 C=CCSc1c[nH]c2c1cccn2 62a_100000210623_100011934613 [2,0,0,0,0,0|2,0,0]=4 142 B14R2.3 CCCCc1c[nH]c2c1cccn2 271570a_100020621405_100011934613 [2,0,0,0,0,0|1,0,1]=4 143 B14R2.3 CNCCc1c[nH]c2c1cccn2 2230a_106832991635_100009895007 [2,0,0,0,0,0|2,0,0]=4 144 B14R2.3 CNCCc1c[nH]c2c1cccn2 7a_106832991635_100009895007 [2,0,0,0,0,0|2,0,0]=4 145 B14R2.3 CSCCc1c[nH]c2c1cccn2 62a_200000210301_100009895007 [2,0,0,0,0,0|2,0,0]=4 146 B14R2.3 O=CCSc1c[nH]c2c1cccn2 62a_200015260668_100011934613 [2,0,0,0,0,0|1,0,0]=3 147 B14R2.3 O=CCSc1c[nH]c2c1cncn2 62a_100009817560_200015260668 [2,0,0,0,0,0|2,0,0]=4 148 B14R2.3 O=CCSc1c[nH]c2c1cncn2 62a_200015260668_100000072862 [2,0,0,0,0,0|2,0,0]=4 149 B14R2.3 O=CCSc1c[nH]c2c1nccn2 62a_200015260668_100009819587 [2,0,0,0,0,0|2,0,0]=4 150 B14R2.3 O=CCSc1csc2c1cccn2 62a_100009830249_200015260668 [2,0,0,0,0,0|2,0,0]=4 151 B14R2.3 O=CCSc1csc2c1cccn2 62a_200015260668_100009830249 [2,0,0,0,0,0|2,0,0]=4 152 B14R2.3 O=CCSc1n[nH]c2c1cccn2 62a_200015260668_100009888962 [2,0,0,0,0,0|2,0,0]=4 153 B14R2.3 OCCSc1c[nH]c2c1cccn2 62a_100000211926_100011934613 [2,0,0,0,0,0|1,0,1]=4 154 B14R2.3 [13CH3]SCCc1c[nH]c2c1cccn2 62a_200025704644_100009895007 [2,0,0,0,0,0|2,0,0]=4 155 B16R2.4 CN[C@@H](CO)Cc1c[nH]c2c1cccc2 2230a_100102526151_200000210301 [1,1,0,0,0,0|1,0,1]=4 156 B16R2.4 O=CC(C=O)Sc1c[nH]c2c1cccn2 62a_100000736813_100011934613 [1,1,0,0,0,0|2,0,0]=4 157 B16R2.4 [13CH3]N[C@@H](CO)Cc1c[nH]c2c1cccc2 2230a_100102526151_200025704644 [1,1,0,0,0,0|1,0,1]=4 158 B16R2.14 C#CC(=O)CCc1c[nH]c2c1cccc2 1458a_100000211873_100011218569 [1,1,0,0,0,0|2,0,0]=4 159 B16R2.14 C#CC(=O)CCc1c[nH]c2c1cccn2 1458a_100000211873_100009895007 [1,1,0,0,0,0|1,0,0]=3 160 B16R2.14 C=CC(=O)CCc1c[nH]c2c1cccc2 1458a_100000185746_100011218569 [1,1,0,0,0,0|2,0,0]=4 161 B16R2.14 C=CC(=O)CCc1c[nH]c2c1cccn2 1458a_100000185746_100009895007 [1,1,0,0,0,0|1,0,0]=3 162 B16R2.14 CCC(=O)CCc1c[nH]c2c1cccc2 1458a_100000210414_100011218569 [1,1,0,0,0,0|2,0,0]=4 163 B16R2.14 CCC(=O)CCc1c[nH]c2c1cccc2 1458a_100000211458_100000210202 [1,1,0,0,0,0|2,0,0]=4 164 B16R2.14 CCC(=O)CCc1c[nH]c2c1cccn2 1458a_100000210414_100009895007 [1,1,0,0,0,0|1,0,0]=3 165 B16R2.14 CCC(=O)CCc1c[nH]c2c1cccn2 1458a_100102525369_100000210202 [1,1,0,0,0,0|1,0,0]=3 166 B16R2.14 CCC(=O)CSc1c[nH]c2c1cccn2 62a_100000747405_100011934613 [1,1,0,0,0,0|2,0,0]=4 167 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccc2 11a_106832991635_100000211458 [1,1,0,0,0,0|2,0,0]=4 168 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccc2 1626a_100102657272_100000211458 [1,1,0,0,0,0|2,0,0]=4 169 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccc2 240690a_100102657272_100000211458 [1,1,0,0,0,0|2,0,0]=4 170 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccc2 527a_100102657272_100000211458 [1,1,0,0,0,0|2,0,0]=4 171 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccn2 11a_106832991635_100102525369 [1,1,0,0,0,0|1,0,0]=3 172 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccn2 240690a_100102657272_100102525369 [1,1,0,0,0,0|1,0,0]=3 173 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccn2 527a_100102657272_100102525369 [1,1,0,0,0,0|1,0,0]=3 174 B16R2.14 CNC(=O)CSc1c[nH]c2c1cccn2 62a_100000183359_100011934613 [1,1,0,0,0,0|2,0,0]=4 175 B16R2.14 COC(=O)CSc1c[nH]c2c1cccn2 62a_100000747449_100011934613 [1,1,0,0,0,0|1,0,0]=3 176 B16R2.14 COC(=O)CSc1c[nH]c2c1cncn2 62a_100000747449_100000072862 [1,1,0,0,0,0|2,0,0]=4 177 B16R2.14 COC(=O)CSc1c[nH]c2c1cncn2 62a_100009817560_100000747449 [1,1,0,0,0,0|2,0,0]=4 178 B16R2.14 COC(=O)CSc1c[nH]c2c1nccn2 62a_100000747449_100009819587 [1,1,0,0,0,0|2,0,0]=4 179 B16R2.14 COC(=O)CSc1csc2c1cccn2 62a_100000747449_100009830249 [1,1,0,0,0,0|2,0,0]=4 180 B16R2.14 COC(=O)CSc1csc2c1cccn2 62a_100009830249_100000747449 [1,1,0,0,0,0|2,0,0]=4 181 B16R2.14 COC(=O)CSc1n[nH]c2c1cccn2 62a_100000747449_100009888962 [1,1,0,0,0,0|2,0,0]=4 182 B16R2.14 O=C(CF)CCc1c[nH]c2c1cccc2 1458a_100000211458_100015361967 [1,1,0,0,0,0|2,0,0]=4 183 B16R2.14 O=C(CF)CCc1c[nH]c2c1cccn2 1458a_100102525369_100015361967 [1,1,0,0,0,0|1,0,0]=3 184 B16R2.14 O=C(CO)CCc1c[nH]c2c1cccc2 1458a_100000210174_100011218569 [1,1,0,0,0,0|1,0,0]=3 185 B16R2.14 O=C(CO)CCc1c[nH]c2c1cccn2 1458a_100000210174_100009895007 [1,1,0,0,0,0|0,0,0]=2 186 B16R2.14 O=C(CO)NCc1c[nH]c2c1cccc2 240690a_100015202335_100000210174 [1,1,0,0,0,0|2,0,0]=4 187 B16R2.14 O=C(CO)NCc1c[nH]c2c1cccc2 527a_100015202335_100000210174 [1,1,0,0,0,0|2,0,0]=4 188 B16R2.2976 NC(=O)CSc1c[nH]c2c1ccc(n2)Cl 62a_100000747473_100010168512 [1,1,0,0,0,0|2,0,0]=4 189 B16R2.2976 NC(=O)CSc1c[nH]c2c1ccc(n2)F 62a_100000747473_100010168364 [1,1,0,0,0,0|2,0,0]=4 190 B16R2.2976 O=C([O-])CSc1c[nH]c2c1ccc(n2)Cl 62a_100020667443_100010168512 [1,1,0,0,0,0|1,0,1]=4 191 B16R2.2976 O=C([O-])CSc1c[nH]c2c1ccc(n2)F 62a_100020667443_100010168364 [1,1,0,0,0,0|1,0,1]=4 192 B16R2.4003 Cc1[nH]c2ncccc2c1SCC(=O)N 62a_100000747473_100010174266 [1,1,0,0,0,0|2,0,0]=4 193 B16R2.4003 Cc1[nH]c2ncccc2c1SCC(=O)[O-] 62a_100020667443_100010174266 [1,1,0,0,0,0|1,0,1]=4 194 B16R2.15551 CC(=O)CCc1c[nH]c2c1cc(cc2)Br 1458a_100009828173_200000210301 [1,1,0,0,0,0|2,0,0]=4 195 B16R2.15551 Cc1cnc2[nH]cc(c2c1)SCC(=O)N 62a_100000747473_100010246215 [1,1,0,0,0,0|2,0,0]=4 196 B16R2.15551 Cc1cnc2[nH]cc(c2c1)SCC(=O)[O-] 62a_100020667443_100010246215 [1,1,0,0,0,0|1,0,1]=4 197 B16R2.15551 NC(=O)CSc1c[nH]c2c1cc(cn2)Br 62a_100000747473_100011290788 [1,1,0,0,0,0|2,0,0]=4 198 B16R2.15551 NC(=O)CSc1c[nH]c2c1cc(cn2)Br 62a_100011290788_100000747473 [1,1,0,0,0,0|2,0,0]=4 199 B16R2.15551 NC(=O)CSc1c[nH]c2c1cc(cn2)Cl 62a_100000747473_100000050100 [1,1,0,0,0,0|2,0,0]=4 200 B16R2.15551 NC(=O)CSc1c[nH]c2c1cc(cn2)F 62a_100000747473_100010168383 [1,1,0,0,0,0|2,0,0]=4 201 B16R2.15551 NC(=O)CSc1c[nH]c2c1cc(cn2)N 62a_100000747473_100010168510 [1,1,0,0,0,0|2,0,0]=4 202 B16R2.15551 Nc1cnc2[nH]cc(c2c1)SCC(=O)[O-] 62a_100020667443_100010168510 [1,1,0,0,0,0|1,0,1]=4 203 B16R2.15551 O=C([O-])CSc1c[nH]c2c1cc(cn2)Br 62a_100011290788_100020667443 [1,1,0,0,0,0|1,0,1]=4 204 B16R2.15551 O=C([O-])CSc1c[nH]c2c1cc(cn2)Br 62a_100020667443_100011290788 [1,1,0,0,0,0|1,0,1]=4 205 B16R2.15551 O=C([O-])CSc1c[nH]c2c1cc(cn2)Cl 62a_100020667443_100000050100 [1,1,0,0,0,0|1,0,1]=4 206 B16R2.15551 O=C([O-])CSc1c[nH]c2c1cc(cn2)F 62a_100020667443_100010168383 [1,1,0,0,0,0|1,0,1]=4 207 B16R2.15551 [13CH3]C(=O)CCc1c[nH]c2c1cc(cc2)Br 1458a_100009828173_200025704644 [1,1,0,0,0,0|2,0,0]=4 208 B16R2.22904 NC(=O)CSc1c[nH]c2c1c(ccn2)Br 62a_100000747473_100010212587 [1,1,0,0,0,0|2,0,0]=4 209 B16R2.22904 NC(=O)CSc1c[nH]c2c1c(ccn2)Br 62a_100010212587_100000747473 [1,1,0,0,0,0|2,0,0]=4 210 B16R2.22904 NC(=O)CSc1c[nH]c2c1c(ccn2)Cl 62a_100000747473_100011356983 [1,1,0,0,0,0|2,0,0]=4 211 B16R2.22904 NC(=O)CSc1c[nH]c2c1c(ccn2)F 62a_100000747473_100010168365 [1,1,0,0,0,0|2,0,0]=4 212 B16R2.22904 O=C([O-])CSc1c[nH]c2c1c(ccn2)Br 62a_100010212587_100020667443 [1,1,0,0,0,0|1,0,1]=4 213 B16R2.22904 O=C([O-])CSc1c[nH]c2c1c(ccn2)Br 62a_100020667443_100010212587 [1,1,0,0,0,0|1,0,1]=4 214 B16R2.22904 O=C([O-])CSc1c[nH]c2c1c(ccn2)Cl 62a_100020667443_100011356983 [1,1,0,0,0,0|1,0,1]=4 215 B16R2.22904 O=C([O-])CSc1c[nH]c2c1c(ccn2)F 62a_100020667443_100010168365 [1,1,0,0,0,0|1,0,1]=4 216 B16R2.104522 CC(=O)CCc1cn(c2c1cccc2)C 1458a_100000686839_200000210301 [1,1,0,0,0,0|2,0,0]=4 217 B16R2.104522 Cn1cc(c2c1cccc2)CCC(=O)[13CH3] 1458a_100000686839_200025704644 [1,1,0,0,0,0|2,0,0]=4 218 B16R2.104522 Cn1cc(c2c1nccc2)SCC(=O)N 62a_100000747473_100010205794 [1,1,0,0,0,0|2,0,0]=4 219 B16R2.104522 Cn1cc(c2c1nccc2)SCC(=O)[O-] 62a_100020667443_100010205794 [1,1,0,0,0,0|1,0,1]=4 220 B18R2.37 C=C(CSc1c[nH]c2c1cccn2)C(=O)OC 62a_100009813391_100011934613 [0,1,0,0,0,1|1,0,1]=4 221 B18R2.37 COC(=O)C(=O)CSc1c[nH]c2c1cccn2 62a_100011610305_100011934613 [0,1,0,0,0,1|1,0,1]=4 222 B18R2.37 COC(=O)C(C)CSc1c[nH]c2c1cccn2 62a_100000698445_100011934613 [0,1,0,0,0,1|1,0,0]=3 223 B18R2.37 COC(=O)C(C)CSc1c[nH]c2c1cncn2 62a_100000698445_100000072862 [0,1,0,0,0,1|2,0,0]=4 224 B18R2.37 COC(=O)C(C)CSc1c[nH]c2c1cncn2 62a_100009817560_100000698445 [0,1,0,0,0,1|2,0,0]=4 225 B18R2.37 COC(=O)C(C)CSc1c[nH]c2c1nccn2 62a_100000698445_100009819587 [0,1,0,0,0,1|2,0,0]=4 226 B18R2.37 COC(=O)C(C)CSc1csc2c1cccn2 62a_100000698445_100009830249 [0,1,0,0,0,1|2,0,0]=4 227 B18R2.37 COC(=O)C(C)CSc1csc2c1cccn2 62a_100009830249_100000698445 [0,1,0,0,0,1|2,0,0]=4 228 B18R2.37 COC(=O)C(C)CSc1n[nH]c2c1cccn2 62a_100000698445_100009888962 [0,1,0,0,0,1|2,0,0]=4 229 B18R2.38 CC(=O)C(C)C(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_100000179758 [0,1,0,0,0,1|2,0,0]=4 230 B18R2.38 CC(C(=O)N)C(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_100000702099 [0,1,0,0,0,1|2,0,0]=4 231 B18R2.38 NC(=O)C(F)C(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_100009813875 [0,1,0,0,0,1|2,0,0]=4 232 B18R2.38 O=C([O-])C(F)C(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_100020610796 [0,1,0,0,0,1|1,0,1]=4 233 B18R2.7129 CC(C)(CSc1c[nH]c2c1cccn2)C(=O)N 62a_200009895572_100011934613 [0,1,0,0,0,1|2,0,0]=4 234 B18R2.1 COC(=O)CC(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_100000747449 [0,1,0,0,0,1|1,0,1]=4 235 B18R2.1 COC(=O)CC(C)Sc1c[nH]c2c1cccn2 62a_100009817358_100011934613 [0,1,0,0,0,1|2,0,0]=4 236 B18R2.78780 CN[C@@H](Cc1ccc2ccccc2c1)C(=O)O 269956a_100020588631_200000210301 [0,1,0,0,0,1|2,0,0]=4 237 B18R2.78780 [13CH3]N[C@@H](Cc1ccc2ccccc2c1)C(=O)O 269956a_100020588631_200025704644 [0,1,0,0,0,1|2,0,0]=4 238 B18R2.12 CCOC(=O)C(C)Sc1c[nH]c2c1cccn2 62a_100011216346_100011934613 [0,2,0,0,0,0|2,0,0]=4 239 B18R2.12 CCOC(=O)C(F)Sc1c[nH]c2c1cccn2 62a_100000760018_100011934613 [0,2,0,0,0,0|2,0,0]=4 240 B18R2.283 CCC(Sc1c[nH]c2c1cccn2)C(=O)OC 62a_100000235869_100011934613 [0,2,0,0,0,0|2,0,0]=4 241 B18R2.283 COC(=O)C(C=O)Sc1c[nH]c2c1cccn2 62a_100000046368_100011934613 [0,2,0,0,0,0|2,0,0]=4 242 B18R2.283 COC(=O)C(CO)Sc1c[nH]c2c1cccn2 62a_100012276630_100011934613 [0,2,0,0,0,0|2,0,0]=4 243 B18R2.283 COC(=O)C(OC)Sc1c[nH]c2c1cccn2 62a_100000101307_100011934613 [0,2,0,0,0,0|2,0,0]=4 244 B18R2.374 COC(=O)C(C)(C)Sc1c[nH]c2c1cccn2 62a_100000689032_100011934613 [0,2,0,0,0,0|2,0,0]=4 245 B18R2.374 COC(=O)C(C)(F)Sc1c[nH]c2c1cccn2 62a_200009867631_100011934613 [0,2,0,0,0,0|2,0,0]=4 246 B18R2.374 COC(=O)C(F)(F)Sc1c[nH]c2c1cccn2 62a_100000211177_100011934613 [0,2,0,0,0,0|2,0,0]=4 247 B18R2.125805 COC(=O)C(C)Sc1cn(c2c1cccn2)C 62a_100000211248_100010205794 [0,2,0,0,0,0|2,0,0]=4 248 B18R2.125811 COC(=O)C(C)Sc1c([nH]c2c1cccn2)C 62a_100000211248_100010174266 [0,2,0,0,0,0|2,0,0]=4 249 B18R2.126667 COC(=O)C(C)Sc1c[nH]c2c1ccc(n2)Cl 62a_100000211248_100010168512 [0,2,0,0,0,0|2,0,0]=4 250 B18R2.126667 COC(=O)C(C)Sc1c[nH]c2c1ccc(n2)F 62a_100000211248_100010168364 [0,2,0,0,0,0|2,0,0]=4 251 B18R2.910620 COC(=O)C(C)Sc1c[nH]c2c1c(ccn2)Br 62a_100000211248_100010212587 [0,2,0,0,0,0|2,0,0]=4 252 B18R2.910620 COC(=O)C(C)Sc1c[nH]c2c1c(ccn2)Br 62a_100010212587_100000211248 [0,2,0,0,0,0|2,0,0]=4 253 B18R2.910620 COC(=O)C(C)Sc1c[nH]c2c1c(ccn2)Cl 62a_100000211248_100011356983 [0,2,0,0,0,0|2,0,0]=4 254 B18R2.910620 COC(=O)C(C)Sc1c[nH]c2c1c(ccn2)F 62a_100000211248_100010168365 [0,2,0,0,0,0|2,0,0]=4 255 B18R2.910661 COC(=O)C(C)Sc1c[nH]c2c1cc(cn2)Br 62a_100000211248_100011290788 [0,2,0,0,0,0|2,0,0]=4 256 B18R2.910661 COC(=O)C(C)Sc1c[nH]c2c1cc(cn2)Br 62a_100011290788_100000211248 [0,2,0,0,0,0|2,0,0]=4 257 B18R2.910661 COC(=O)C(C)Sc1c[nH]c2c1cc(cn2)C 62a_100000211248_100010246215 [0,2,0,0,0,0|2,0,0]=4 258 B18R2.910661 COC(=O)C(C)Sc1c[nH]c2c1cc(cn2)Cl 62a_100000211248_100000050100 [0,2,0,0,0,0|2,0,0]=4 259 B18R2.910661 COC(=O)C(C)Sc1c[nH]c2c1cc(cn2)F 62a_100000211248_100010168383 [0,2,0,0,0,0|2,0,0]=4 260 B18R2.910661 COC(=O)C(C)Sc1c[nH]c2c1cc(cn2)N 62a_100000211248_100010168510 [0,2,0,0,0,0|2,0,0]=4 261 B18R2.195 CCN[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N 2230a_100015190000_100000210202 [0,2,0,0,0,0|2,0,0]=4 262 B18R3.184 O=C1OCCC1Sc2c[nH]c3c2cccn3 62a_100000211211_100011934613 [0,1,0,1,0,0|2,0,0]=4 263 B16R2.36 C=C(C)CCSc1c[nH]c2c1cccn2 62a_100000730704_100011934613 [1,0,0,0,0,1|2,0,0]=4 264 B16R2.36 CC(=O)CCCc1c[nH]c2c1cccc2 1458a_100000181718_200000210301 [1,0,0,0,0,1|2,0,0]=4 265 B16R2.36 CC(=O)CCSc1c[nH]c2c1cccn2 62a_100000053229_100011934613 [1,0,0,0,0,1|1,0,0]=3 266 B16R2.36 CC(=O)CCSc1c[nH]c2c1cncn2 62a_100000053229_100000072862 [1,0,0,0,0,1|2,0,0]=4 267 B16R2.36 CC(=O)CCSc1c[nH]c2c1cncn2 62a_100009817560_100000053229 [1,0,0,0,0,1|2,0,0]=4 268 B16R2.36 CC(=O)CCSc1c[nH]c2c1nccn2 62a_100000053229_100009819587 [1,0,0,0,0,1|2,0,0]=4 269 B16R2.36 CC(=O)CCSc1csc2c1cccn2 62a_100000053229_100009830249 [1,0,0,0,0,1|2,0,0]=4 270 B16R2.36 CC(=O)CCSc1csc2c1cccn2 62a_100009830249_100000053229 [1,0,0,0,0,1|2,0,0]=4 271 B16R2.36 CC(=O)CCSc1n[nH]c2c1cccn2 62a_100000053229_100009888962 [1,0,0,0,0,1|2,0,0]=4 272 B16R2.36 CC(=O)NCCc1c[nH]c2c1cccc2 240690a_100000211132_100015343762 [1,0,0,0,0,1|2,0,0]=4 273 B16R2.36 CC(=O)NCCc1c[nH]c2c1cccc2 527a_100000211132_100103153847 [1,0,0,0,0,1|2,0,0]=4 274 B16R2.36 CC(=O)OCSc1c[nH]c2c1cccn2 62a_100000076356_100011934613 [1,0,0,0,0,1|2,0,0]=4 275 B16R2.36 CC(O)CCSc1c[nH]c2c1cccn2 62a_100012276601_100011934613 [1,0,0,0,0,1|1,0,1]=4 276 B16R2.36 NC(=O)CCNc1n[nH]c2c1cccn2 27a_100000740010_100009818534 [1,0,0,0,0,1|2,0,0]=4 277 B16R2.36 NC(=O)CCSc1c[nH]c2c1cccn2 62a_100000744528_100011934613 [1,0,0,0,0,1|1,0,0]=3 278 B16R2.36 NC(=O)CCSc1c[nH]c2c1cncn2 62a_100000744528_100000072862 [1,0,0,0,0,1|2,0,0]=4 279 B16R2.36 NC(=O)CCSc1c[nH]c2c1cncn2 62a_100009817560_100000744528 [1,0,0,0,0,1|2,0,0]=4 280 B16R2.36 NC(=O)CCSc1c[nH]c2c1nccn2 62a_100000744528_100009819587 [1,0,0,0,0,1|2,0,0]=4 281 B16R2.36 NC(=O)CCSc1csc2c1cccn2 62a_100000744528_100009830249 [1,0,0,0,0,1|2,0,0]=4 282 B16R2.36 NC(=O)CCSc1csc2c1cccn2 62a_100009830249_100000744528 [1,0,0,0,0,1|2,0,0]=4 283 B16R2.36 NC(=O)CCSc1n[nH]c2c1cccn2 62a_100000744528_100009888962 [1,0,0,0,0,1|2,0,0]=4 284 B16R2.36 O=C(O)CNCc1csc2c1cccc2 269956a_100016091260_200000742921 [1,0,0,0,0,1|2,0,0]=4 285 B16R2.36 [13CH3]C(=O)CCCc1c[nH]c2c1cccc2 1458a_100000181718_200025704644 [1,0,0,0,0,1|2,0,0]=4 286 B18R2.178 CN(CCc1c[nH]c2c1cccn2)CC(=O)O 269956a_100000746989_100009895007 [0,0,0,0,0,2|2,0,0]=4 287 B18R2.179 CC(=O)C(C)SCCc1c[nH]c2c1cccn2 62a_100009814033_100009895007 [0,0,0,0,0,2|2,0,0]=4 288 B18R2.179 CC(SCCc1c[nH]c2c1cccn2)C(=O)N 62a_100000702099_100009895007 [0,0,0,0,0,2|2,0,0]=4 289 B18R2.179 C[C@@H](NCCc1c[nH]c2c1cccn2)C(=O)N 2230a_100000119354_100009895007 [0,0,0,0,0,2|2,0,0]=4 290 B18R2.179 C[C@@H](OCCc1c[nH]c2c1cccn2)C(=O)N 7a_100000731257_100009895007 [0,0,0,0,0,2|2,0,0]=4 291 B18R2.179 C[C@H](NCCc1c[nH]c2c1cccc2)C(=O)O 269956a_100000743915_100011218569 [0,0,0,0,0,2|2,0,0]=4 292 B18R2.179 C[C@H](NCCc1c[nH]c2c1cccn2)C(=O)O 269956a_100000743915_100009895007 [0,0,0,0,0,2|1,0,0]=3 293 B18R2.179 C[C@H](OCCc1c[nH]c2c1cccn2)C(=O)[O-] 7a_217856618621_100009895007 [0,0,0,0,0,2|1,0,1]=4 294 B18R2.179 NC(=O)C(F)SCCc1c[nH]c2c1cccn2 62a_100009813875_100009895007 [0,0,0,0,0,2|2,0,0]=4 295 B18R2.179 O=C([O-])C(F)SCCc1c[nH]c2c1cccn2 62a_100020610796_100009895007 [0,0,0,0,0,2|1,0,1]=4 296 B18R2.12980 C[C@H](NCc1ccc2ncccc2c1)C(=O)O 269956a_100000743915_100000703657 [0,0,0,0,0,2|2,0,0]=4