0 B22R3.29187 Cc1oc2ccccc2c1SCCC(=O)c3cccs3 62a_100011290775_200010236113 [0,0,0,0,0,0|3,0,0]=3 1 B22R3.29187 Cc1sc2ccccc2c1SCCC(=O)c3cccs3 62a_100010002616_100011290775 [0,0,0,0,0,0|3,0,0]=3 2 B22R3.29187 Cc1sc2ccccc2c1SCCC(=O)c3cccs3 62a_100011290775_100010002616 [0,0,0,0,0,0|3,0,0]=3 3 B21R3.2809 O=C(CCSc1csc2c1cccc2)c3cccs3 62a_100011290775_100009813928 [1,0,0,0,0,0|3,0,0]=4 4 B21R3.2809 O=C(CSCc1csc2c1cccc2)c3cccs3 62a_100000211436_200000742921 [1,0,0,0,0,0|3,0,0]=4 5 B21R3.2809 O=C(CSCc1csc2c1cccc2)c3cccs3 62a_200000742921_100000211436 [1,0,0,0,0,0|3,0,0]=4 6 B23R3.7695790 Cc1[nH]c2ccccc2c1CCNC(C)c3cc(cs3)Br 269862a_100000750322_100000718618 [0,1,0,0,0,0|1,0,1]=3 7 B23R3.7695790 Cc1[nH]c2ccccc2c1CCNC(C)c3cc(cs3)Cl 269862a_100000750322_100000061699 [0,1,0,0,0,0|1,0,1]=3 8 B23R3.7695790 Cc1[nH]c2ccccc2c1CCNC(C)c3ccc(s3)Br 269862a_100000750322_100000183331 [0,1,0,0,0,0|1,0,1]=3 9 B23R3.7695790 Cc1[nH]c2ccccc2c1CCNC(C)c3ccc(s3)Cl 269862a_100000750322_100000182421 [0,1,0,0,0,0|1,0,1]=3 10 B23R3.7695790 Cc1[nH]c2ccccc2c1CCNC(C)c3ccc(s3)I 269862a_100000750322_200000034408 [0,1,0,0,0,0|1,0,1]=3 11 B23R3.9667003 Cc1[nH]c2ccccc2c1CCNC(C)c3sccc3Br 269862a_100000750322_100000738688 [0,1,0,0,0,0|1,0,1]=3 12 B21R3.19585 Cc1sc2ccccc2c1CNC(C)c3cccs3 207a_100000703493_100000066825 [0,0,0,0,1,0|2,0,1]=4 13 B21R3.19585 Cc1sc2ccccc2c1CNC(C)c3cccs3 270004a_100000703493_100000066825 [0,0,0,0,1,0|2,0,1]=4 14 B21R3.19585 Cc1sc2ccccc2c1SCC(=O)c3cccs3 62a_100000211436_100010002616 [0,0,0,0,1,0|2,0,0]=3 15 B21R3.19585 Cc1sc2ccccc2c1SCC(=O)c3cccs3 62a_100010002616_100000211436 [0,0,0,0,1,0|2,0,0]=3 16 B23R3.45341 Cc1ccc2ccccc2c1CSCC(=O)c3cccs3 62a_100000211436_100000689653 [0,0,0,0,0,1|3,0,0]=4 17 B23R3.45341 Cc1ccc2ccccc2c1CSCC(=O)c3cccs3 62a_100000689653_100000211436 [0,0,0,0,0,1|3,0,0]=4 18 B23R3.45341 Cc1ccc2ccccc2c1SCCC(=O)c3cccs3 62a_100000759710_100011290775 [0,0,0,0,0,1|3,0,0]=4 19 B23R3.45341 Cc1ccc2ccccc2c1SCCC(=O)c3cccs3 62a_100011290775_100000759710 [0,0,0,0,0,1|3,0,0]=4 20 B22R3.28899 Cc1oc2ccccc2c1SC(C)C(=O)c3cccs3 62a_100011262360_200010236113 [0,1,0,0,1,0|2,0,0]=4 21 B22R3.28899 Cc1sc2ccccc2c1SC(C)C(=O)c3cccs3 62a_100010002616_100011262360 [0,1,0,0,1,0|2,0,0]=4 22 B22R3.28899 Cc1sc2ccccc2c1SC(C)C(=O)c3cccs3 62a_100011262360_100010002616 [0,1,0,0,1,0|2,0,0]=4 23 B22R3.5316392 Cc1ccc(s1)C(=O)CSc2c(oc3c2cccc3)C 62a_100011262362_200010236113 [0,1,0,0,1,0|2,0,0]=4 24 B22R3.5316392 Cc1ccc(s1)C(=O)CSc2c(sc3c2cccc3)C 62a_100010002616_100011262362 [0,1,0,0,1,0|2,0,0]=4 25 B22R3.5316392 Cc1ccc(s1)C(=O)CSc2c(sc3c2cccc3)C 62a_100011262362_100010002616 [0,1,0,0,1,0|2,0,0]=4 26 B22R3.5316392 Cc1oc2ccccc2c1SCC(=O)c3ccc(s3)Br 62a_100000185163_200010236113 [0,1,0,0,1,0|2,0,0]=4 27 B22R3.5316392 Cc1oc2ccccc2c1SCC(=O)c3ccc(s3)Cl 62a_100000185135_200010236113 [0,1,0,0,1,0|2,0,0]=4 28 B22R3.5316392 Cc1sc2ccccc2c1SCC(=O)c3ccc(s3)Cl 62a_100000185135_100010002616 [0,1,0,0,1,0|2,0,0]=4 29 B22R3.5316392 Cc1sc2ccccc2c1SCC(=O)c3ccc(s3)Cl 62a_100010002616_100000185135 [0,1,0,0,1,0|2,0,0]=4 30 B22R3.6457350 Cc1oc2ccccc2c1SCC(=O)c3sccc3Br 62a_100000740827_200010236113 [0,1,0,0,1,0|2,0,0]=4 31 B24R3.30636286 CCCC(NCCc1c([nH]c2c1cccc2)C)c3cccs3 269862a_100000750322_100011218182 [0,2,0,0,0,0|1,0,1]=4 32 B24R3.420182806 CCC(NCCc1c([nH]c2c1cc(cc2)C)C)c3cccs3 269862a_100000076026_100000211688 [0,2,0,0,0,0|1,0,1]=4 33 B24R3.420183879 CCC(NCCc1c([nH]c2c1cccc2)C)c3ccc(s3)Br 269862a_100000750322_200011203577 [0,2,0,0,0,0|1,0,1]=4 34 B24R3.420183879 CCC(NCCc1c([nH]c2c1cccc2)C)c3ccc(s3)C 269862a_100000750322_100011203523 [0,2,0,0,0,0|1,0,1]=4 35 B24R3.420183879 CCC(NCCc1c([nH]c2c1cccc2)C)c3ccc(s3)Cl 269862a_100000750322_100000238488 [0,2,0,0,0,0|1,0,1]=4 36 B24R3.24415936 Cc1[nH]c2ccccc2c1CCNC(C)c3cc(c(s3)Br)Cl 269862a_100000750322_200012360051 [0,2,0,0,0,0|1,0,1]=4 37 B24R3.24415936 Cc1[nH]c2ccccc2c1CCNC(C)c3cc(c(s3)Cl)Cl 269862a_100000750322_100000074699 [0,2,0,0,0,0|1,0,1]=4 38 B24R3.115402401 Cc1[nH]c2ccc(cc2c1CCNC(C)c3cc(cs3)Br)F 269862a_100015200695_100000718618 [0,2,0,0,0,0|1,0,1]=4 39 B24R3.115402401 Cc1[nH]c2ccc(cc2c1CCNC(C)c3cc(cs3)Cl)F 269862a_100015200695_100000061699 [0,2,0,0,0,0|1,0,1]=4 40 B24R3.115402401 Cc1[nH]c2ccc(cc2c1CCNC(C)c3ccc(s3)Br)F 269862a_100015200695_100000183331 [0,2,0,0,0,0|1,0,1]=4 41 B24R3.115402401 Cc1[nH]c2ccc(cc2c1CCNC(C)c3ccc(s3)Cl)F 269862a_100015200695_100000182421 [0,2,0,0,0,0|1,0,1]=4 42 B24R3.115402401 Cc1[nH]c2ccc(cc2c1CCNC(C)c3ccc(s3)I)F 269862a_100015200695_200000034408 [0,2,0,0,0,0|1,0,1]=4 43 B24R3.115402401 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3cc(cs3)Br)C 269862a_100000076026_100000718618 [0,2,0,0,0,0|1,0,1]=4 44 B24R3.115402401 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3cc(cs3)Cl)C 269862a_100000076026_100000061699 [0,2,0,0,0,0|1,0,1]=4 45 B24R3.115402401 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3ccc(s3)Br)C 269862a_100000076026_100000183331 [0,2,0,0,0,0|1,0,1]=4 46 B24R3.115402401 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3ccc(s3)C)C 269862a_100000076026_100000195387 [0,2,0,0,0,0|1,0,1]=4 47 B24R3.115402401 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3ccc(s3)Cl)C 269862a_100000076026_100000182421 [0,2,0,0,0,0|1,0,1]=4 48 B24R3.115402401 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3ccc(s3)I)C 269862a_100000076026_200000034408 [0,2,0,0,0,0|1,0,1]=4 49 B24R3.115402401 Cc1csc(c1)C(C)NCCc2c([nH]c3c2cc(cc3)C)C 269862a_100000076026_100000034720 [0,2,0,0,0,0|1,0,1]=4 50 B24R3.11485799 Cc1[nH]c2ccc(cc2c1CCNC(C)c3sccc3Br)F 269862a_100015200695_100000738688 [0,2,0,0,0,0|1,0,1]=4 51 B24R3.11485799 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3sccc3Br)C 269862a_100000076026_100000738688 [0,2,0,0,0,0|1,0,1]=4 52 B22R3.36296 O=C(CCSCc1csc2c1cccc2)c3cccs3 62a_100011290775_200000742921 [1,0,0,0,0,1|2,0,0]=4 53 B22R3.36296 O=C(CCSCc1csc2c1cccc2)c3cccs3 62a_200000742921_100011290775 [1,0,0,0,0,1|2,0,0]=4 54 B22R3.32815 Cc1ccc2ccccc2c1SCC(=O)c3cccs3 62a_100000211436_100000759710 [0,0,0,0,1,1|2,0,0]=4 55 B22R3.32815 Cc1ccc2ccccc2c1SCC(=O)c3cccs3 62a_100000759710_100000211436 [0,0,0,0,1,1|2,0,0]=4 56 B24R3.53013 Cc1cc(c2ccccc2n1)CSCCC(=O)c3cccs3 62a_100000755639_100011290775 [0,0,0,0,0,2|1,0,1]=4 57 B24R3.53013 Cc1cc(c2ccccc2n1)CSCCC(=O)c3cccs3 62a_100011290775_100000755639 [0,0,0,0,0,2|1,0,1]=4 58 B24R3.58090 Cc1ccc2ccccc2c1CSCCC(=O)c3cccs3 62a_100000689653_100011290775 [0,0,0,0,0,2|2,0,0]=4 59 B24R3.58090 Cc1ccc2ccccc2c1CSCCC(=O)c3cccs3 62a_100011290775_100000689653 [0,0,0,0,0,2|2,0,0]=4