0 B20R1.67918 CCCCCCCCCC(=O)OCSc1ccsc1C 62a_100000684487_200010990708 [0,0,0,0,0,0|3,0,0]=3 1 B20R1.67918 CCCCCCCCCC(=O)OCSc1cscc1C 62a_100000759966_200010990708 [0,0,0,0,0,0|4,0,0]=4 2 B20R1.67918 CCCCCCCCCC(=O)OCSc1ncsc1C 62a_100000732656_200010990708 [0,0,0,0,0,0|3,0,0]=3 3 B20R1.67918 CCCCCCCCCC(=O)OCSc1sccc1C 62a_100010247149_200010990708 [0,0,0,0,0,0|2,0,0]=2 4 B20R1.67918 CCCCCCCCCC(=O)OCSc1scnc1C 62a_100009817116_200010990708 [0,0,0,0,0,0|1,0,0]=1 5 B20R1.67918 CCCCCCCCCC(C)CNCc1scnc1C 270004a_100000752186_200011218516 [0,0,0,0,0,0|3,0,1]=4 6 B20R1.67918 CCCCCCCCCC(C)NCCc1scnc1C 270004a_100000238517_100011215753 [0,0,0,0,0,0|2,0,1]=3 7 B20R1.67918 CCCCCCCCCC(C)OCCc1scnc1C 34a_100011218016_100000057103 [0,0,0,0,0,0|1,0,1]=2 8 B20R1.67918 CCCCCCCCCC(C)OCCc1scnc1C 7a_100011218016_100000057103 [0,0,0,0,0,0|1,0,1]=2 9 B19R1.46476 CCCCCCCCCC(=O)CCCc1cccs1 1458a_100000184482_100000210670 [1,0,0,0,0,0|2,0,0]=3 10 B19R1.46476 CCCCCCCCCC(=O)CCCc1cccs1 1458a_100000210558_100010992444 [1,0,0,0,0,0|2,0,0]=3 11 B19R1.46476 CCCCCCCCCC(=O)OCSc1ccco1 62a_100009814098_200010990708 [1,0,0,0,0,0|2,1,0]=4 12 B19R1.46476 CCCCCCCCCC(=O)OCSc1cccs1 62a_100011215356_200010990708 [1,0,0,0,0,0|2,0,0]=3 13 B19R1.46476 CCCCCCCCCC(=O)OCSc1ccoc1 62a_100011215275_200010990708 [1,0,0,0,0,0|3,0,0]=4 14 B19R1.46476 CCCCCCCCCC(=O)OCSc1ccsc1 62a_100000738268_200010990708 [1,0,0,0,0,0|3,0,0]=4 15 B19R1.46476 CCCCCCCCCC(C)OCCc1cccs1 34a_100011218016_100000748579 [1,0,0,0,0,0|2,0,1]=4 16 B19R1.46476 CCCCCCCCCC(C)OCCc1cccs1 7a_100011218016_100000748579 [1,0,0,0,0,0|2,0,1]=4 17 B19R1.46518 CCCCCCCCCCCNCc1scnc1C 207a_200011215754_100000764165 [1,0,0,0,0,0|2,0,1]=4 18 B19R1.46518 CCCCCCCCCCCNCc1scnc1C 2230a_100000752186_100011215454 [1,0,0,0,0,0|2,0,1]=4 19 B19R1.46518 CCCCCCCCCCCOCc1scnc1C 34a_100000750112_100011215454 [1,0,0,0,0,0|2,0,1]=4 20 B19R1.46518 CCCCCCCCCCCOCc1scnc1C 7a_100000750112_100011215454 [1,0,0,0,0,0|2,0,1]=4 21 B19R1.46518 CCCCCCCCCCOCCc1scnc1C 34a_100000210711_100000057103 [1,0,0,0,0,0|0,0,1]=2 22 B19R1.46518 CCCCCCCCCCOCCc1scnc1C 34a_100000211055_100000210320 [1,0,0,0,0,0|0,0,1]=2 23 B19R1.46518 CCCCCCCCCCOCCc1scnc1C 7a_100000210711_100000057103 [1,0,0,0,0,0|0,0,1]=2 24 B19R1.46518 CCCCCCCCCCOCCc1scnc1C 7a_100000211055_100000210320 [1,0,0,0,0,0|0,0,1]=2 25 B19R1.46518 CCCCCCCCCCSCCc1scnc1C 62a_100000057103_100000210320 [1,0,0,0,0,0|0,1,1]=3 26 B19R1.46518 Cc1ncsc1CCOCCCCCCCCCBr 34a_100009813782_100000057103 [1,0,0,0,0,0|1,0,1]=3 27 B19R1.46518 Cc1ncsc1CCOCCCCCCCCCBr 7a_100009813782_100000057103 [1,0,0,0,0,0|1,0,1]=3 28 B19R1.48340 CCCCCCCCC(C)OCCc1scnc1C 34a_100000210740_100000057103 [1,0,0,0,0,0|1,0,1]=3 29 B19R1.48340 CCCCCCCCC(C)OCCc1scnc1C 7a_100000210740_100000057103 [1,0,0,0,0,0|1,0,1]=3 30 B21R1.19507 CCCCCCCCCC(=O)OCSc1sccc1C=O 62a_100009816921_200010990708 [0,1,0,0,0,0|2,0,1]=4 31 B21R1.19788 CCCCCCCCCCC(=O)CCCn1ccnc1C 1458a_100000210375_100000690325 [0,1,0,0,0,0|3,0,0]=4 32 B21R1.19788 CCCCCCCCCCC(=O)CCCn1ccnc1C 1458a_100000748694_100000210319 [0,1,0,0,0,0|3,0,0]=4 33 B21R1.19788 CCCCCCCCCCC(C)NCCc1scnc1C 270004a_100000238517_200011219864 [0,1,0,0,0,0|2,0,1]=4 34 B21R1.19788 CCCCCCCCCCC(C)OCCc1scnc1C 34a_100011215000_100000057103 [0,1,0,0,0,0|1,0,1]=3 35 B21R1.19788 CCCCCCCCCCC(C)OCCc1scnc1C 7a_100011215000_100000057103 [0,1,0,0,0,0|1,0,1]=3 36 B21R1.20228 CCCCCCCCCC(C)N(C)CCc1scnc1C 270004a_100025748334_100011215753 [0,1,0,0,0,0|2,0,1]=4 37 B21R1.695385 CCCCCCCCCC(=O)OCSc1c(noc1C)C 62a_100000694658_200010990708 [0,1,0,0,0,0|3,0,0]=4 38 B21R1.987150 CCCCCCCCCC(=O)OCSc1nc(sc1C)C 62a_100010270876_200010990708 [0,1,0,0,0,0|3,0,0]=4 39 B21R1.987150 CCCCCCCCCC(=O)OCSc1sc(nc1C)C 62a_100009814099_200010990708 [0,1,0,0,0,0|1,0,0]=2 40 B19R1.30498 CCCCCCCCCC(=O)C=Cc1sccc1C 1458a_100000185125_100000210670 [0,0,0,0,1,0|1,0,2]=4 41 B19R1.30498 CCCCCCCCCC(=O)CCc1scnc1C 1458a_100000210558_100000057103 [0,0,0,0,1,0|0,0,0]=1 42 B19R1.30498 CCCCCCCCCC(=O)CCc1scnc1C 1458a_100011934404_100000210670 [0,0,0,0,1,0|0,0,0]=1 43 B19R1.30498 CCCCCCCCCC(=O)NCc1sccc1Cl 11a_100011934584_100000210558 [0,0,0,0,1,0|3,0,0]=4 44 B19R1.30498 CCCCCCCCCC(=O)NCc1sccc1Cl 1626a_100011934584_100000210558 [0,0,0,0,1,0|3,0,0]=4 45 B19R1.30498 CCCCCCCCCC(=O)NCc1sccc1Cl 240690a_100011934584_100000210558 [0,0,0,0,1,0|3,0,0]=4 46 B19R1.30498 CCCCCCCCCC(=O)NCc1sccc1Cl 527a_100011934584_100000210558 [0,0,0,0,1,0|3,0,0]=4 47 B19R1.30498 CCCCCCCCCC(C)NCc1scnc1C 270004a_100000752186_100011215753 [0,0,0,0,1,0|2,0,1]=4 48 B21R1.19508 CCCCCCCCCC(=O)OCNCc1ccsc1Br 2230a_100000727803_200010990708 [0,0,0,0,0,1|3,0,0]=4 49 B21R1.19508 CCCCCCCCCC(=O)OCNCc1ccsc1Br 34a_100000727803_200010990708 [0,0,0,0,0,1|3,0,0]=4 50 B21R1.19508 CCCCCCCCCC(=O)OCNCc1sccc1Cl 2230a_100011934584_200010990708 [0,0,0,0,0,1|2,0,0]=3 51 B21R1.19508 CCCCCCCCCC(=O)OCNCc1sccc1Cl 34a_100011934584_200010990708 [0,0,0,0,0,1|2,0,0]=3 52 B21R1.19508 CCCCCCCCCC(=O)OCOCc1ccsc1Br 34a_100009816922_200010990708 [0,0,0,0,0,1|3,0,0]=4 53 B21R1.19508 CCCCCCCCCC(=O)OCOCc1ccsc1Br 7a_100009816922_200010990708 [0,0,0,0,0,1|3,0,0]=4 54 B21R1.19508 CCCCCCCCCC(=O)OCOCc1sccc1Br 34a_100000702026_200010990708 [0,0,0,0,0,1|2,0,0]=3 55 B21R1.19508 CCCCCCCCCC(=O)OCOCc1sccc1C 34a_100000238368_200010990708 [0,0,0,0,0,1|1,0,0]=2 56 B21R1.19508 CCCCCCCCCC(=O)OCOCc1sccc1C 7a_100000238368_200010990708 [0,0,0,0,0,1|1,0,0]=2 57 B21R1.19508 CCCCCCCCCC(=O)OCOCc1sccc1Cl 34a_100000722387_200010990708 [0,0,0,0,0,1|2,0,0]=3 58 B21R1.19508 CCCCCCCCCC(=O)OCOCc1sccc1Cl 7a_100000722387_200010990708 [0,0,0,0,0,1|2,0,0]=3 59 B21R1.19508 CCCCCCCCCC(=O)OCOCc1scnc1Br 7a_100012000948_200010990708 [0,0,0,0,0,1|1,0,0]=2 60 B21R1.19508 CCCCCCCCCC(C)CNCCc1scnc1C 270004a_100000238517_200011218516 [0,0,0,0,0,1|2,0,1]=4 61 B21R1.66577 CCCCCCCCCC(=O)OCNc1cccc(c1)C 2230a_100000188690_200010990708 [0,0,0,0,0,1|3,0,0]=4 62 B21R1.66577 CCCCCCCCCC(=O)OCNc1cccc(c1)C 34a_100000188690_200010990708 [0,0,0,0,0,1|3,0,0]=4 63 B21R1.66577 CCCCCCCCCC(=O)OCOc1cccc(c1)C 34a_100000210337_200010990708 [0,0,0,0,0,1|3,0,0]=4 64 B21R1.66577 CCCCCCCCCC(=O)OCOc1cccc(c1)C 7a_100000210337_200010990708 [0,0,0,0,0,1|3,0,0]=4 65 B21R1.66577 CCCCCCCCCC(=O)OCSc1cc(ccn1)C 62a_100000750283_200010990708 [0,0,0,0,0,1|3,0,0]=4 66 B21R1.66577 CCCCCCCCCC(=O)OCSc1cccc(c1)C 62a_100011215228_200010990708 [0,0,0,0,0,1|3,0,0]=4 67 B21R1.66577 CCCCCCCCCC(=O)OCSc1cccc(n1)C 62a_100000742759_200010990708 [0,0,0,0,0,1|3,0,0]=4 68 B21R1.66577 CCCCCCCCCC(=O)OCSc1ccnc(c1)Br 62a_100009814637_200010990708 [0,0,0,0,0,1|3,0,0]=4 69 B21R1.66577 CCCCCCCCCC(=O)OCSc1ccnc(c1)C 62a_100000758586_200010990708 [0,0,0,0,0,1|2,0,0]=3 70 B21R1.66577 CCCCCCCCCC(=O)OCSc1ccnc(c1)Cl 62a_100000035001_200010990708 [0,0,0,0,0,1|3,0,0]=4 71 B21R1.78153 CCCCCCCCCC(=O)OCNc1ccccc1C 34a_100015192222_200010990708 [0,0,0,0,0,1|3,0,0]=4 72 B21R1.78153 CCCCCCCCCC(=O)OCOc1ccccc1C 34a_100000210338_200010990708 [0,0,0,0,0,1|3,0,0]=4 73 B21R1.78153 CCCCCCCCCC(=O)OCOc1ccccc1C 7a_100000210338_200010990708 [0,0,0,0,0,1|3,0,0]=4 74 B21R1.78153 CCCCCCCCCC(=O)OCSc1ccccc1C 62a_100000210755_200010990708 [0,0,0,0,0,1|3,0,0]=4 75 B21R1.78153 CCCCCCCCCC(=O)OCSc1cccnc1Br 62a_100010202626_200010990708 [0,0,0,0,0,1|3,0,0]=4 76 B21R1.78153 CCCCCCCCCC(=O)OCSc1cccnc1C 62a_100000751574_200010990708 [0,0,0,0,0,1|2,0,0]=3 77 B21R1.78153 CCCCCCCCCC(=O)OCSc1cccnc1Cl 62a_100000036424_200010990708 [0,0,0,0,0,1|3,0,0]=4 78 B21R1.78153 CCCCCCCCCC(=O)OCSc1ccncc1Br 62a_100000726257_200010990708 [0,0,0,0,0,1|3,0,0]=4 79 B21R1.78153 CCCCCCCCCC(=O)OCSc1ccncc1C 62a_100000765111_200010990708 [0,0,0,0,0,1|2,0,0]=3 80 B21R1.78153 CCCCCCCCCC(=O)OCSc1ccncc1Cl 62a_100000708259_200010990708 [0,0,0,0,0,1|3,0,0]=4 81 B21R1.78153 CCCCCCCCCC(=O)OCSc1cnccc1C 62a_100000761580_200010990708 [0,0,0,0,0,1|3,0,0]=4 82 B21R1.78153 CCCCCCCCCC(=O)OCSc1ncccc1C 62a_100000751373_200010990708 [0,0,0,0,0,1|3,0,0]=4 83 B18R1.292 CCCCCCCCCCOCCc1cccs1 34a_100000210711_100000748579 [2,0,0,0,0,0|1,0,1]=4 84 B18R1.292 CCCCCCCCCCOCCc1cccs1 34a_100011216825_100000210320 [2,0,0,0,0,0|1,0,1]=4 85 B18R1.292 CCCCCCCCCCOCCc1cccs1 7a_100000210711_100000748579 [2,0,0,0,0,0|1,0,1]=4 86 B18R1.292 CCCCCCCCCCOCCc1cccs1 7a_100011216825_100000210320 [2,0,0,0,0,0|1,0,1]=4 87 B18R1.21875 CCCCCCCCC(=O)CCCc1cccs1 1458a_100000184482_100000210759 [2,0,0,0,0,0|2,0,0]=4 88 B18R1.21875 CCCCCCCCC(=O)CCCc1cccs1 1458a_100000210188_100010992444 [2,0,0,0,0,0|2,0,0]=4 89 B18R1.21916 CCCCCCCCCCCCc1scnc1C 271570a_100011290949_100009817116 [2,0,0,0,0,0|0,0,1]=3 90 B18R1.21916 CCCCCCCCCCOCc1sccc1C 34a_100000238368_100000210320 [2,0,0,0,0,0|1,0,1]=4 91 B18R1.21916 CCCCCCCCCCOCc1sccc1C 7a_100000238368_100000210320 [2,0,0,0,0,0|1,0,1]=4 92 B18R1.21916 CCCCCCCCCCOCc1scnc1Br 7a_100012000948_100000210320 [2,0,0,0,0,0|1,0,1]=4 93 B18R1.21916 CCCCCCCCCCOCc1scnc1C 34a_100000750112_100000210320 [2,0,0,0,0,0|0,0,1]=3 94 B18R1.21916 CCCCCCCCCCOCc1scnc1C 7a_100000750112_100000210320 [2,0,0,0,0,0|0,0,1]=3 95 B18R1.21916 CCCCCCCCCSCCc1scnc1C 62a_100000057103_100000210670 [2,0,0,0,0,0|0,1,0]=3 96 B18R1.23582 CCCCCCCC(=O)OCSc1sccc1C 62a_100010247149_100009852258 [2,0,0,0,0,0|2,0,0]=4 97 B20R1.57916 CCCCCCCCCC(=O)NCCc1ccc(s1)Br 11a_100000217605_100000210558 [1,1,0,0,0,0|2,0,0]=4 98 B20R1.57916 CCCCCCCCCC(=O)NCCc1ccc(s1)Br 1626a_100000217605_100000210558 [1,1,0,0,0,0|2,0,0]=4 99 B20R1.57916 CCCCCCCCCC(=O)NCCc1ccc(s1)Br 240690a_100000217605_100000210558 [1,1,0,0,0,0|2,0,0]=4 100 B20R1.57916 CCCCCCCCCC(=O)NCCc1ccc(s1)Br 527a_100000217605_100000210558 [1,1,0,0,0,0|2,0,0]=4 101 B20R1.57916 CCCCCCCCCC(=O)OCSc1cc(cs1)C 62a_100009876951_200010990708 [1,1,0,0,0,0|2,0,0]=4 102 B20R1.57916 CCCCCCCCCC(=O)OCSc1ccc(s1)C 62a_100000031368_200010990708 [1,1,0,0,0,0|2,0,0]=4 103 B20R1.57916 CCCCCCCCCC(=O)OCSc1cnc(s1)Br 62a_100012357534_200010990708 [1,1,0,0,0,0|1,0,0]=3 104 B20R1.57916 CCCCCCCCCC(=O)OCSc1cnc(s1)C 62a_100000764884_200010990708 [1,1,0,0,0,0|1,0,0]=3 105 B20R1.65916 CCCCCCCCOCC(=O)CCCc1cccs1 1458a_100000759886_100010992444 [1,1,0,0,0,0|2,0,0]=4 106 B20R1.65916 O=C(CCCCCCCCCF)CCCc1cccs1 1458a_200009909015_100010992444 [1,1,0,0,0,0|2,0,0]=4 107 B20R1.61279 CCCCCCCCC=CC(=O)CCc1scnc1C 1458a_100015345288_100000057103 [1,1,0,0,0,0|1,0,1]=4 108 B20R1.61279 CCCCCCCCCCC(=O)CCc1scnc1C 1458a_100000210375_100000057103 [1,1,0,0,0,0|1,0,1]=4 109 B20R1.61279 CCCCCCCCCCC(=O)CCc1scnc1C 1458a_100011934404_100000210319 [1,1,0,0,0,0|1,0,1]=4 110 B20R1.61279 CCCCCCCCCCN(C)CCc1scnc1C 2230a_100000207566_100000057103 [1,1,0,0,0,0|1,0,1]=4 111 B20R1.61279 CCCCCCCCCCN(C)CCc1scnc1C 2230a_100025748334_100000210320 [1,1,0,0,0,0|1,0,1]=4 112 B20R1.61279 CCCCCCCCCCN(C)CCc1scnc1C 269982a_100000207566_100000057103 [1,1,0,0,0,0|1,0,1]=4 113 B20R1.61279 CCCCCCCCCCN(C)CCc1scnc1C 269982a_100025748334_100000210320 [1,1,0,0,0,0|1,0,1]=4 114 B20R1.65958 C=CCCCCCCCCCOCCc1scnc1C 34a_100000038209_100000057103 [1,1,0,0,0,0|0,0,2]=4 115 B20R1.65958 C=CCCCCCCCCCOCCc1scnc1C 34a_100000211055_100009814027 [1,1,0,0,0,0|0,0,2]=4 116 B20R1.65958 C=CCCCCCCCCCOCCc1scnc1C 7a_100000038209_100000057103 [1,1,0,0,0,0|0,0,2]=4 117 B20R1.65958 C=CCCCCCCCCCOCCc1scnc1C 7a_100000211055_100009814027 [1,1,0,0,0,0|0,0,2]=4 118 B20R1.65958 CCCCCCCC/C=C/COCCc1scnc1C 34a_200020667288_100000057103 [1,1,0,0,0,0|0,0,1]=3 119 B20R1.65958 CCCCCCCC/C=C/COCCc1scnc1C 7a_200020667288_100000057103 [1,1,0,0,0,0|0,0,1]=3 120 B20R1.65958 CCCCCCCCC/C=C/COCc1snnc1C 34a_100015232335_100000732739 [1,1,0,0,0,0|2,0,0]=4 121 B20R1.65958 CCCCCCCCC/C=C/COCc1snnc1C 7a_100015232335_100000732739 [1,1,0,0,0,0|2,0,0]=4 122 B20R1.65958 CCCCCCCCCCCCNCc1scnc1C 207a_100000210451_100000764165 [1,1,0,0,0,0|1,0,1]=4 123 B20R1.65958 CCCCCCCCCCCCNCc1scnc1C 2230a_100000752186_100011215052 [1,1,0,0,0,0|1,0,1]=4 124 B20R1.65958 CCCCCCCCCCCCNCc1scnc1C 270004a_100000752186_100011218549 [1,1,0,0,0,0|1,0,1]=4 125 B20R1.65958 CCCCCCCCCCCCOCc1scnc1C 34a_100000750112_100000759014 [1,1,0,0,0,0|1,0,1]=4 126 B20R1.65958 CCCCCCCCCCCCOCc1scnc1C 7a_100000750112_100000759014 [1,1,0,0,0,0|1,0,1]=4 127 B20R1.65958 CCCCCCCCCCCNCCc1scnc1C 2230a_100000238517_100011215454 [1,1,0,0,0,0|1,0,1]=4 128 B20R1.65958 CCCCCCCCCCCNCCc1scnc1C 2230a_200011215754_100000057103 [1,1,0,0,0,0|1,0,1]=4 129 B20R1.65958 CCCCCCCCCCCNCCc1scnc1C 34a_100000238517_100011215454 [1,1,0,0,0,0|1,0,1]=4 130 B20R1.65958 CCCCCCCCCCCNCCc1scnc1C 34a_200011215754_100000057103 [1,1,0,0,0,0|1,0,1]=4 131 B20R1.65958 CCCCCCCCCCCOCCc1scnc1C 34a_100000210809_100000057103 [1,1,0,0,0,0|0,0,1]=3 132 B20R1.65958 CCCCCCCCCCCOCCc1scnc1C 34a_100000211055_100011215454 [1,1,0,0,0,0|0,0,1]=3 133 B20R1.65958 CCCCCCCCCCCOCCc1scnc1C 7a_100000210809_100000057103 [1,1,0,0,0,0|0,0,1]=3 134 B20R1.65958 CCCCCCCCCCCOCCc1scnc1C 7a_100000211055_100011215454 [1,1,0,0,0,0|0,0,1]=3 135 B20R1.65958 Cc1ncsc1CCOCCCCCCCCCCBr 34a_100009813290_100000057103 [1,1,0,0,0,0|0,0,1]=3 136 B20R1.65958 Cc1ncsc1CCOCCCCCCCCCCBr 7a_100009813290_100000057103 [1,1,0,0,0,0|0,0,1]=3 137 B20R1.65958 Cc1ncsc1CCOCCCCCCCCCCCl 34a_200000033068_100000057103 [1,1,0,0,0,0|0,0,1]=3 138 B20R1.65958 Cc1ncsc1CCOCCCCCCCCCCCl 7a_200000033068_100000057103 [1,1,0,0,0,0|0,0,1]=3 139 B20R1.67649 CCCCCCCCC(C)COCCc1scnc1C 34a_200012125181_100000057103 [1,1,0,0,0,0|0,0,1]=3 140 B20R1.67649 CCCCCCCCC(C)COCCc1scnc1C 7a_200012125181_100000057103 [1,1,0,0,0,0|0,0,1]=3 141 B20R1.89002 CCCCCCCCC(CC)OCCc1scnc1C 34a_200011216270_100000057103 [1,1,0,0,0,0|1,0,1]=4 142 B20R1.89002 CCCCCCCCC(CC)OCCc1scnc1C 7a_200011216270_100000057103 [1,1,0,0,0,0|1,0,1]=4 143 B20R1.18054 CCCCCCCCCC(C)OCc1sc(nc1C)C 34a_100011218016_100000760948 [0,1,0,0,1,0|1,0,1]=4 144 B20R1.18054 CCCCCCCCCC(C)OCc1sc(nc1C)C 7a_100011218016_100000760948 [0,1,0,0,1,0|1,0,1]=4 145 B20R1.18578 CCCCCCCCCC(=O)N(C)Cc1sccc1C 11a_100000695154_100000210558 [0,1,0,0,1,0|2,0,0]=4 146 B20R1.18578 CCCCCCCCCC(=O)N(C)Cc1sccc1C 1626a_100000695154_100000210558 [0,1,0,0,1,0|2,0,0]=4 147 B20R1.18578 CCCCCCCCCC(=O)N(C)Cc1sccc1C 240690a_100000695154_100000210558 [0,1,0,0,1,0|2,0,0]=4 148 B20R1.18578 CCCCCCCCCC(=O)N(C)Cc1sccc1C 527a_100000695154_100000210558 [0,1,0,0,1,0|2,0,0]=4 149 B20R1.282787 CCCCCCCCCC(=O)CCc1c(c[nH]c1C)C 1458a_100102525370_100000210670 [0,1,0,0,1,0|1,0,1]=4 150 B22R1.328386 CCCCCCCCCC(=O)OCN(C)Cc1sccc1Br 2230a_100000767120_200010990708 [0,1,0,0,0,1|2,0,0]=4 151 B22R1.328386 CCCCCCCCCC(=O)OCN(C)Cc1sccc1Br 269982a_100000767120_200010990708 [0,1,0,0,0,1|2,0,0]=4 152 B22R1.328386 CCCCCCCCCC(=O)OCN(C)Cc1sccc1C 2230a_100000695154_200010990708 [0,1,0,0,0,1|1,0,0]=3 153 B22R1.328386 CCCCCCCCCC(=O)OCN(C)Cc1sccc1C 269982a_100000695154_200010990708 [0,1,0,0,0,1|1,0,0]=3 154 B22R1.950895 CCCCCCCCCC(=O)OCOCc1cc(oc1C)C 34a_100000688432_200010990708 [0,1,0,0,0,1|2,0,0]=4 155 B22R1.950895 CCCCCCCCCC(=O)OCOCc1cc(oc1C)C 7a_100000688432_200010990708 [0,1,0,0,0,1|2,0,0]=4 156 B22R1.950895 CCCCCCCCCC(=O)OCOCc1nc(sc1C)Br 7a_100010127906_200010990708 [0,1,0,0,0,1|2,0,0]=4 157 B22R1.950895 CCCCCCCCCC(=O)OCOCc1sc(nc1Br)Br 7a_100010218989_200010990708 [0,1,0,0,0,1|1,0,0]=3 158 B22R1.950895 CCCCCCCCCC(=O)OCOCc1sc(nc1C)Br 7a_100010264302_200010990708 [0,1,0,0,0,1|0,0,0]=2 159 B22R1.950895 CCCCCCCCCC(=O)OCOCc1sc(nc1Cl)Cl 7a_100000721200_200010990708 [0,1,0,0,0,1|1,0,0]=3 160 B22R1.950895 CCCCCCCCCC(=O)OCSCc1sc(nc1C)C 62a_100000760948_200010990708 [0,1,0,0,0,1|0,0,0]=2 161 B22R1.1658992 CCCCCCCCCC(=O)OCSCc1c(noc1C)C 62a_100000184612_200010990708 [0,1,0,0,0,1|2,0,0]=4 162 B22R1.42492 CCCCCCCCCC(=O)OCSc1cc(nc(c1)C)C 62a_100000066820_200010990708 [0,1,0,0,0,1|2,0,0]=4 163 B22R1.42492 CCCCCCCCCC(=O)OCSc1cc(nc(c1)Cl)C 62a_100010068023_200010990708 [0,1,0,0,0,1|2,0,0]=4 164 B22R1.42492 CCCCCCCCCC(=O)OCSc1cc(nc(c1)F)C 62a_100010006595_200010990708 [0,1,0,0,0,1|2,0,0]=4 165 B22R1.69445 CCCCCCCCCC(=O)OCSc1ccnc(c1C)C 62a_100009846815_200010990708 [0,1,0,0,0,1|2,0,0]=4 166 B22R1.69445 CCCCCCCCCC(=O)OCSc1ccnc(c1Cl)C 62a_100000698670_200010990708 [0,1,0,0,0,1|2,0,0]=4 167 B22R1.69445 CCCCCCCCCC(=O)OCSc1ccnc(c1F)C 62a_100009849794_200010990708 [0,1,0,0,0,1|2,0,0]=4 168 B22R1.951109 CCCCCCCCCC(=O)OCSc1ccnc(c1)CC 62a_100009820011_200010990708 [0,1,0,0,0,1|2,0,0]=4 169 B22R1.1399596 CCCCCCCCCC(=O)OCOc1cc(ncc1Br)C 34a_100011016184_200010990708 [0,1,0,0,0,1|2,0,0]=4 170 B22R1.1399596 CCCCCCCCCC(=O)OCSc1cc(ncc1C)C 62a_100009862788_200010990708 [0,1,0,0,0,1|2,0,0]=4 171 B22R1.1399596 CCCCCCCCCC(=O)OCSc1cc(ncc1F)C 62a_100009867690_200010990708 [0,1,0,0,0,1|2,0,0]=4 172 B22R1.42551 CCCCCCCCCC(=O)OCOc1cccnc1CBr 34a_200020655725_200010990708 [0,1,0,0,0,1|2,0,0]=4 173 B22R1.42551 CCCCCCCCCC(=O)OCOc1cccnc1CBr 7a_200020655725_200010990708 [0,1,0,0,0,1|2,0,0]=4 174 B22R1.42551 CCCCCCCCCC(=O)OCSc1cccnc1CC 62a_100009877225_200010990708 [0,1,0,0,0,1|2,0,0]=4 175 B22R1.42551 CCCCCCCCCC(=O)OCSc1cccnc1SC 62a_100011465278_200010990708 [0,1,0,0,0,1|2,0,0]=4 176 B22R1.42551 CCCCCCCCCC(=O)OCSc1ccncc1CC 62a_100025704421_200010990708 [0,1,0,0,0,1|2,0,0]=4 177 B22R1.81821 CCCCCCCCCC(=O)OCOc1ccc(nc1C)Br 34a_100012002022_200010990708 [0,1,0,0,0,1|2,0,0]=4 178 B22R1.81821 CCCCCCCCCC(=O)OCOc1ccc(nc1C)Br 7a_100012002022_200010990708 [0,1,0,0,0,1|2,0,0]=4 179 B22R1.81821 CCCCCCCCCC(=O)OCOc1ccc(nc1C)Cl 34a_100012184626_200010990708 [0,1,0,0,0,1|2,0,0]=4 180 B22R1.81821 CCCCCCCCCC(=O)OCOc1ccc(nc1C)Cl 7a_100012184626_200010990708 [0,1,0,0,0,1|2,0,0]=4 181 B22R1.81821 CCCCCCCCCC(=O)OCOc1ccc(nc1C)I 34a_100010233687_200010990708 [0,1,0,0,0,1|2,0,0]=4 182 B22R1.81821 CCCCCCCCCC(=O)OCOc1ccc(nc1C)I 7a_100010233687_200010990708 [0,1,0,0,0,1|2,0,0]=4 183 B22R1.81821 CCCCCCCCCC(=O)OCSc1ccc(nc1C)C 62a_100009813853_200010990708 [0,1,0,0,0,1|2,0,0]=4 184 B22R1.81821 CCCCCCCCCC(=O)OCSc1ccc(nc1C)Cl 62a_100000062408_200010990708 [0,1,0,0,0,1|2,0,0]=4 185 B22R1.81821 CCCCCCCCCC(=O)OCSc1ccc(nc1C)F 62a_100000688911_200010990708 [0,1,0,0,0,1|2,0,0]=4 186 B22R1.14153819 CCCCCCCCCC(=O)OCSc1c(ccnc1C)C 62a_100012000501_200010990708 [0,1,0,0,0,1|2,0,0]=4 187 B22R1.14153819 CCCCCCCCCC(=O)OCSc1c(cncc1C)C 62a_100009817138_200010990708 [0,1,0,0,0,1|2,0,0]=4 188 B22R1.14153819 CCCCCCCCCC(=O)OCSc1c(ncnc1Cl)C 62a_100012356128_200010990708 [0,1,0,0,0,1|2,0,0]=4 189 B22R1.1659029 CCCCCCCCCC(=O)OCSc1sccc1CNC 62a_100009817074_200010990708 [0,2,0,0,0,0|2,0,0]=4 190 B22R1.119719 CCCCCCCCCCCC(=O)NCCc1scnc1C 11a_100000238517_100000210736 [0,2,0,0,0,0|1,0,0]=3 191 B22R1.119719 CCCCCCCCCCCC(=O)NCCc1scnc1C 1626a_100000238517_100000210736 [0,2,0,0,0,0|1,0,0]=3 192 B22R1.119719 CCCCCCCCCCCC(=O)NCCc1scnc1C 240690a_100000238517_100000210736 [0,2,0,0,0,0|1,0,0]=3 193 B22R1.119719 CCCCCCCCCCCC(=O)OCSc1scnc1C 62a_100009817116_100020644155 [0,2,0,0,0,0|1,0,0]=3 194 B22R1.4501858 C#CC(C)(CCCCCCCCC)OCCc1scnc1C 34a_100000034731_100000057103 [0,2,0,0,0,0|1,0,1]=4 195 B22R1.4501858 C#CC(C)(CCCCCCCCC)OCCc1scnc1C 7a_100000034731_100000057103 [0,2,0,0,0,0|1,0,1]=4 196 B22R1.1399599 CCCCCCCCCC(=O)OCSc1sc(cc1C)C=O 62a_100000761930_200010990708 [0,2,0,0,0,0|2,0,0]=4 197 B22R1.1399599 CCCCCCCCCC(=O)OCSc1sc(nc1C)CC 62a_100010138847_200010990708 [0,2,0,0,0,0|1,0,0]=3 198 B20R2.174738 O=C(CCCc1cccs1)CCCC2CCCCC2 1458a_100000184482_100011713725 [1,0,0,1,0,0|2,0,0]=4 199 B20R2.174738 O=C(CCCc1cccs1)CCCC2CCCCC2 1458a_100000211478_100010992444 [1,0,0,1,0,0|2,0,0]=4 200 B22R2.398453 CCCCCCCCCC(=O)N1CCc2sccc2C1C 11a_100000018849_100000210558 [0,1,0,1,0,0|2,0,0]=4 201 B22R2.398453 CCCCCCCCCC(=O)N1CCc2sccc2C1C 240690a_100000018849_100000210558 [0,1,0,1,0,0|2,0,0]=4 202 B22R2.398453 CCCCCCCCCC(=O)N1CCc2sccc2C1C 527a_100000018849_100000210558 [0,1,0,1,0,0|2,0,0]=4 203 B22R2.582032 CCCCCCCCCCC(=O)N1CCc2sccc2C1 11a_100015185043_100000210375 [0,1,0,1,0,0|2,0,0]=4 204 B22R2.582032 CCCCCCCCCCC(=O)N1CCc2sccc2C1 1626a_100015185043_100000210375 [0,1,0,1,0,0|2,0,0]=4 205 B22R2.582032 CCCCCCCCCCC(=O)N1CCc2sccc2C1 240690a_100015185043_100000210375 [0,1,0,1,0,0|2,0,0]=4 206 B22R2.4515581 Cc1ncsc1CCOC2CCCCCCCCCCC2 34a_100000211378_100000057103 [0,1,0,1,0,0|1,0,1]=4 207 B22R2.4515581 Cc1ncsc1CCOC2CCCCCCCCCCC2 7a_100000211378_100000057103 [0,1,0,1,0,0|1,0,1]=4 208 B22R2.6949545 CCCCCCCCCC(=O)N1CCc2sc(cc2C1)Br 11a_100025757484_100000210558 [0,1,0,1,0,0|2,0,0]=4 209 B22R2.6949545 CCCCCCCCCC(=O)N1CCc2sc(cc2C1)Br 240690a_100025757484_100000210558 [0,1,0,1,0,0|2,0,0]=4 210 B22R2.6949545 CCCCCCCCCC(=O)N1CCc2sc(cc2C1)Br 527a_100025757484_100000210558 [0,1,0,1,0,0|2,0,0]=4 211 B18R1.346 CCCCCCCCCC(=O)CCc1cccs1 1458a_100000185280_100000210670 [1,0,0,0,1,0|1,0,0]=3 212 B18R1.346 CCCCCCCCCC(=O)CCc1cccs1 1458a_100000210558_100000748579 [1,0,0,0,1,0|1,0,0]=3 213 B18R1.346 CCCCCCCCCC(=O)CCc1ccsc1 1458a_100000195497_100000210670 [1,0,0,0,1,0|2,0,0]=4 214 B18R1.346 CCCCCCCCCC(C)OCc1cncs1 34a_100011218016_100015185245 [1,0,0,0,1,0|1,0,1]=4 215 B18R1.346 CCCCCCCCCC(C)OCc1cncs1 7a_100011218016_100015185245 [1,0,0,0,1,0|1,0,1]=4 216 B22R1.20319 CCCCCCCCCC(=O)OCOCc1ccccc1C 34a_100000698903_200010990708 [0,0,0,0,0,2|2,0,0]=4 217 B22R1.20319 CCCCCCCCCC(=O)OCOCc1ccccc1C 7a_100000698903_200010990708 [0,0,0,0,0,2|2,0,0]=4 218 B22R1.20319 CCCCCCCCCC(=O)OCOCc1cccnc1Br 34a_100000719692_200010990708 [0,0,0,0,0,2|2,0,0]=4 219 B22R1.20319 CCCCCCCCCC(=O)OCOCc1cccnc1Br 7a_100000719692_200010990708 [0,0,0,0,0,2|2,0,0]=4 220 B22R1.20319 CCCCCCCCCC(=O)OCSCc1ccccc1C 62a_100000211839_200010990708 [0,0,0,0,0,2|2,0,0]=4 221 B22R1.20319 CCCCCCCCCC(=O)OCSCc1cccnc1Br 62a_100010140945_200010990708 [0,0,0,0,0,2|2,0,0]=4 222 B22R1.20319 CCCCCCCCCC(=O)OCSCc1cccnc1C 62a_100000732876_200010990708 [0,0,0,0,0,2|1,0,0]=3 223 B22R1.20319 CCCCCCCCCC(=O)OCSCc1cccnc1Cl 62a_100000045678_200010990708 [0,0,0,0,0,2|2,0,0]=4 224 B22R1.20319 CCCCCCCCCC(=O)OCSCc1cccnc1F 62a_100000099810_200010990708 [0,0,0,0,0,2|2,0,0]=4 225 B22R1.20319 CCCCCCCCCC(=O)OCSCc1ccncc1C 62a_100020672808_200010990708 [0,0,0,0,0,2|1,0,0]=3 226 B22R1.20319 CCCCCCCCCC(=O)OCSCc1ccncc1Cl 62a_100000763264_200010990708 [0,0,0,0,0,2|2,0,0]=4 227 B22R1.20319 CCCCCCCCCC(=O)OCSCc1cnccc1C 62a_100000690890_200010990708 [0,0,0,0,0,2|2,0,0]=4 228 B22R1.20319 CCCCCCCCCC(=O)OCSCc1ncccc1C 62a_100000696600_200010990708 [0,0,0,0,0,2|2,0,0]=4 229 B22R1.42505 CCCCCCCCCC(=O)OCOCc1cccc(c1)C 34a_100011217746_200010990708 [0,0,0,0,0,2|2,0,0]=4 230 B22R1.42505 CCCCCCCCCC(=O)OCOCc1cccc(c1)C 7a_100011217746_200010990708 [0,0,0,0,0,2|2,0,0]=4 231 B22R1.42505 CCCCCCCCCC(=O)OCOCc1ccnc(c1)Br 34a_100009814636_200010990708 [0,0,0,0,0,2|2,0,0]=4 232 B22R1.42505 CCCCCCCCCC(=O)OCOCc1ccnc(c1)Br 7a_100009814636_200010990708 [0,0,0,0,0,2|2,0,0]=4 233 B22R1.42505 CCCCCCCCCC(=O)OCSCc1cc(ccn1)C 62a_100000718516_200010990708 [0,0,0,0,0,2|2,0,0]=4 234 B22R1.42505 CCCCCCCCCC(=O)OCSCc1cccc(c1)C 62a_100000211840_200010990708 [0,0,0,0,0,2|2,0,0]=4 235 B22R1.42505 CCCCCCCCCC(=O)OCSCc1cccc(n1)C 62a_100000757606_200010990708 [0,0,0,0,0,2|2,0,0]=4 236 B22R1.42505 CCCCCCCCCC(=O)OCSCc1ccnc(c1)Br 62a_100010254460_200010990708 [0,0,0,0,0,2|2,0,0]=4 237 B22R1.42505 CCCCCCCCCC(=O)OCSCc1ccnc(c1)C 62a_200020672517_200010990708 [0,0,0,0,0,2|1,0,0]=3 238 B22R1.42505 CCCCCCCCCC(=O)OCSCc1ccnc(c1)Cl 62a_100000764220_200010990708 [0,0,0,0,0,2|2,0,0]=4 239 B22R1.42505 CCCCCCCCCC(=O)OCSCc1ccnc(n1)Cl 62a_100000099655_200010990708 [0,0,0,0,0,2|2,0,0]=4 240 B22R1.1399595 CCCCCCCCCC(=O)OCSCCc1scnc1C 62a_100000057103_200010990708 [0,0,0,0,0,2|0,0,0]=2