0 B8R1.2 CSc1ncccn1 CSC000000289 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.1 CNc1ccc(cc1)Br CSC000219623 [0,1,0,0,0,0|3,0,0]=4 2 B9R1.1 CNc1ccc(cc1)Cl CSC000220157 [0,1,0,0,0,0|3,0,0]=4 3 B9R1.1 CNc1ncc(cn1)Br CSC000697329 [0,1,0,0,0,0|3,0,0]=4 4 B9R1.1 CNc1ncc(cn1)Cl CSC012001665 [0,1,0,0,0,0|3,0,0]=4 5 B9R1.1 COc1ccc(cc1)Br CSC000169945 [0,1,0,0,0,0|2,1,0]=4 6 B9R1.1 COc1ccc(cc1)Cl CSC000169959 [0,1,0,0,0,0|2,1,0]=4 7 B9R1.1 COc1ccc(cc1)I CSC000171711 [0,1,0,0,0,0|2,1,0]=4 8 B9R1.1 CSc1ccc(cc1)Br CSC000149455 [0,1,0,0,0,0|2,0,0]=3 9 B9R1.1 CSc1ccc(cc1)Cl CSC000150468 [0,1,0,0,0,0|2,0,0]=3 10 B9R1.1 CSc1ccc(cc1)F CSC000000078 [0,1,0,0,0,0|2,0,0]=3 11 B9R1.1 CSc1ccc(cc1)O CSC000211864 [0,1,0,0,0,0|2,0,0]=3 12 B9R1.1 CSc1ccc(cn1)Br CSC011408404 [0,1,0,0,0,0|1,0,0]=2 13 B9R1.2 CNc1cccc(c1)Cl CSC000220044 [0,1,0,0,0,0|3,0,0]=4 14 B9R1.2 CNc1cccc(c1)I CSC000221217 [0,1,0,0,0,0|3,0,0]=4 15 B9R1.2 COc1cccc(c1)Br CSC000170001 [0,1,0,0,0,0|2,1,0]=4 16 B9R1.2 COc1cccc(c1)Cl CSC000170018 [0,1,0,0,0,0|2,1,0]=4 17 B9R1.2 COc1cccc(c1)I CSC000171673 [0,1,0,0,0,0|2,1,0]=4 18 B9R1.2 CSc1cccc(c1)Br CSC011215954 [0,1,0,0,0,0|2,0,0]=3 19 B9R1.2 CSc1cccc(c1)Cl CSC000033908 [0,1,0,0,0,0|2,0,0]=3 20 B9R1.2 CSc1cccc(c1)F CSC000067534 [0,1,0,0,0,0|2,0,0]=3 21 B9R1.6 CS(=O)c1ccccc1 CSC000038873 [0,1,0,0,0,0|2,0,1]=4 22 B9R1.6 CS(=O)c1ccccn1 CSC000064355 [0,1,0,0,0,0|1,0,1]=3 23 B9R1.8 CCSc1ncccn1 CSC000000290 [0,1,0,0,0,0|2,0,0]=3 24 B9R1.15 CNc1ccccc1Cl CSC000219374 [0,1,0,0,0,0|3,0,0]=4 25 B9R1.15 CNc1ncccc1Br CSC000700899 [0,1,0,0,0,0|2,0,0]=3 26 B9R1.15 CNc1ncncc1Br CSC012180720 [0,1,0,0,0,0|3,0,0]=4 27 B9R1.15 COc1ccccc1Br CSC000174000 [0,1,0,0,0,0|2,1,0]=4 28 B9R1.15 COc1ccccc1Cl CSC000169952 [0,1,0,0,0,0|2,1,0]=4 29 B9R1.15 COc1ccccc1I CSC000210334 [0,1,0,0,0,0|2,1,0]=4 30 B9R1.15 CSc1ccccc1Br CSC000230855 [0,1,0,0,0,0|2,0,0]=3 31 B9R1.15 CSc1ccccc1Cl CSC000000335 [0,1,0,0,0,0|2,0,0]=3 32 B9R1.15 CSc1ccccc1F CSC000000233 [0,1,0,0,0,0|2,0,0]=3 33 B9R1.15 CSc1ccccc1O CSC011216402 [0,1,0,0,0,0|2,0,0]=3 34 B8R1.1 CCn1cc(cn1)Br CSC011400201 [0,1,0,0,1,0|2,0,0]=4 35 B8R1.1 CCn1cc(cn1)I CSC000754281 [0,1,0,0,1,0|2,0,0]=4 36 B8R1.1 CCn1cnc(n1)Br CSC009822555 [0,1,0,0,1,0|2,0,0]=4 37 B8R1.8 CCSc1cccs1 CSC009829625 [0,1,0,0,1,0|1,0,0]=3 38 B8R1.11 CSc1nccn1C CSC000000347 [0,1,0,0,1,0|0,0,1]=3 39 B10R1.1 CCNc1ccc(cn1)Br CSC000741496 [0,2,0,0,0,0|2,0,0]=4 40 B10R1.1 CCSc1ccc(cc1)Br CSC009811893 [0,2,0,0,0,0|2,0,0]=4 41 B10R1.1 CCSc1ccc(cc1)C CSC000006686 [0,2,0,0,0,0|2,0,0]=4 42 B10R1.1 CCSc1ccc(cc1)Cl CSC000005996 [0,2,0,0,0,0|2,0,0]=4 43 B10R1.1 CCSc1ccc(cc1)F CSC000006007 [0,2,0,0,0,0|2,0,0]=4 44 B10R1.1 CCSc1ncc(cn1)C CSC000048305 [0,2,0,0,0,0|2,0,0]=4 45 B10R1.1 CSCc1ccc(cc1)C CSC000051358 [0,2,0,0,0,0|2,0,0]=4 46 B10R1.1 CSCc1ccc(cc1)Cl CSC000000312 [0,2,0,0,0,0|2,0,0]=4 47 B10R1.1 CSCc1ccc(cc1)F CSC000051356 [0,2,0,0,0,0|2,0,0]=4 48 B10R1.3 COc1ccc(cc1)SC CSC000007070 [0,2,0,0,0,0|2,0,0]=4 49 B10R1.3 CSc1ccc(cc1)C#N CSC000188601 [0,2,0,0,0,0|2,0,0]=4 50 B10R1.25 CSc1ccc(cc1C)C CSC000001076 [0,2,0,0,0,0|2,0,0]=4 51 B10R1.25 CSc1ccc(cc1Cl)Cl CSC000076917 [0,2,0,0,0,0|2,0,0]=4 52 B10R1.25 CSc1ccc(cc1F)F CSC000017874 [0,2,0,0,0,0|2,0,0]=4 53 B10R1.176 CSc1ccc(c(c1)C)C CSC000001060 [0,2,0,0,0,0|2,0,0]=4 54 B10R1.176 CSc1ccc(c(c1)Cl)Cl CSC000116842 [0,2,0,0,0,0|2,0,0]=4 55 B10R1.176 CSc1ccc(c(c1)Cl)F CSC000021471 [0,2,0,0,0,0|2,0,0]=4 56 B10R1.176 CSc1ncc(c(=O)[nH]1)C CSC015189492 [0,2,0,0,0,0|2,0,0]=4 57 B10R1.8 CSc1nc(cc(n1)N)C CSC000241641 [0,2,0,0,0,0|2,0,0]=4 58 B10R1.10 CCSc1cccc(c1)C CSC000055746 [0,2,0,0,0,0|2,0,0]=4 59 B10R1.10 CCSc1cccc(c1)Cl CSC000059004 [0,2,0,0,0,0|2,0,0]=4 60 B10R1.10 CCSc1cccc(c1)F CSC000106542 [0,2,0,0,0,0|2,0,0]=4 61 B10R1.10 CSCc1cccc(c1)Cl CSC000051353 [0,2,0,0,0,0|2,0,0]=4 62 B10R1.10 CSCc1cccc(c1)F CSC000053058 [0,2,0,0,0,0|2,0,0]=4 63 B10R1.30 CSc1cc(ccc1C)C CSC000001074 [0,2,0,0,0,0|2,0,0]=4 64 B10R1.30 CSc1cc(ccc1Cl)Cl CSC000001111 [0,2,0,0,0,0|2,0,0]=4 65 B10R1.172 COc1cccc(c1)SC CSC000044647 [0,2,0,0,0,0|2,0,0]=4 66 B10R1.172 CSc1cc(ccn1)C#N CSC011326727 [0,2,0,0,0,0|1,0,0]=3 67 B10R1.4 CCSc1ccccc1C CSC000053911 [0,2,0,0,0,0|2,0,0]=4 68 B10R1.4 CCSc1ccccc1Cl CSC000006683 [0,2,0,0,0,0|2,0,0]=4 69 B10R1.4 CSCc1ccccc1Br CSC000148299 [0,2,0,0,0,0|2,0,0]=4 70 B10R1.4 CSCc1ccccc1Cl CSC000051354 [0,2,0,0,0,0|2,0,0]=4 71 B10R1.17 C#CCSc1ccccc1 CSC000172648 [0,2,0,0,0,0|2,0,0]=4 72 B10R1.17 C=CCSc1ccccc1 CSC000006400 [0,2,0,0,0,0|2,0,0]=4 73 B10R1.17 CCCSc1ccccc1 CSC000005822 [0,2,0,0,0,0|2,0,0]=4 74 B10R1.17 CCCSc1ccccn1 CSC000006455 [0,2,0,0,0,0|1,0,0]=3 75 B10R1.17 CCSCc1ccccc1 CSC000006444 [0,2,0,0,0,0|2,0,0]=4 76 B10R1.17 COCSc1ccccc1 CSC000000817 [0,2,0,0,0,0|2,0,0]=4 77 B10R1.17 N#CCSc1ncccn1 CSC000148890 [0,2,0,0,0,0|2,0,0]=4 78 B10R1.17 OCCSc1ccccc1 CSC000230494 [0,2,0,0,0,0|2,0,0]=4 79 B10R1.17 OCCSc1ccccn1 CSC000156319 [0,2,0,0,0,0|1,0,0]=3 80 B10R1.20 COc1ccccc1SC CSC000037525 [0,2,0,0,0,0|2,0,0]=4 81 B10R1.20 CSc1ccccc1C#N CSC011217975 [0,2,0,0,0,0|2,0,0]=4 82 B10R1.245 CSc1c(cccc1Cl)Cl CSC000000219 [0,2,0,0,0,0|2,0,0]=4