0 B14R2.8239 Cc1cc2c([nH]c(=O)c(=O)[nH]2)nc1 rp251lit2 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.8239 c1c(cnc2c1[nH]c(=O)c(=O)[nH]2)Cl rp251lit1 [0,0,0,0,0,0|2,0,1]=3 2 B14R2.8239 c1cc2c(cc1Cl)cc(c(n2)Br)F qn055lit6 [0,0,0,0,0,0|2,0,1]=3 3 B14R2.8239 c1cc2c(cc1Cl)cc(c(n2)O)F qn055lit5 [0,0,0,0,0,0|1,0,2]=3 4 B13R2.155 Cc1ccc2ccc(cc2c1)Br dna432 [1,0,0,0,0,0|2,1,0]=4 5 B13R2.155 Cc1ccc2ccc(cc2c1)Cl dna409 [1,0,0,0,0,0|2,0,0]=3 6 B13R2.155 Cc1ccc2ccc(cc2c1)F dna072 [1,0,0,0,0,0|2,1,0]=4 7 B13R2.155 Cc1ccc2ccc(cc2c1)N dna371 [1,0,0,0,0,0|3,0,0]=4 8 B13R2.155 c1cc(cc2c1ccc(c2)Br)Cl dna442 [1,0,0,0,0,0|2,0,0]=3 9 B13R2.155 c1cc(cc2c1ccc(c2)Br)F dna460 [1,0,0,0,0,0|2,1,0]=4 10 B13R2.155 c1cc(cc2c1ccc(c2)Br)N dna455 [1,0,0,0,0,0|2,1,0]=4 11 B13R2.155 c1cc(cc2c1ccc(c2)Cl)N dna289 [1,0,0,0,0,0|2,0,0]=3 12 B13R2.155 c1cc(cc2c1ccc(c2)Cl)O dna113 [1,0,0,0,0,0|1,0,0]=2 13 B13R2.155 c1cc(cc2c1ccc(c2)F)O dna483 [1,0,0,0,0,0|1,1,0]=3 14 B13R2.155 c1cc(cc2c1ccc(c2)I)Cl dna480 [1,0,0,0,0,0|2,0,0]=3 15 B13R2.155 c1cc(cc2c1ccc(c2)I)I dna171 [1,0,0,0,0,0|2,1,0]=4 16 B13R2.155 c1cc(cc2c1ccc(c2)I)O dna382 [1,0,0,0,0,0|1,1,0]=3 17 B13R2.369 Cc1c(cc2ccccc2n1)Cl qn062 [1,0,0,0,0,0|2,0,1]=4 18 B13R2.369 Cc1c(cc2ccccc2n1)N qn067 [1,0,0,0,0,0|2,0,1]=4 19 B13R2.369 Cc1cc2ccccc2[nH]c1=O qn061 [1,0,0,0,0,0|1,0,0]=2 20 B13R2.369 Cc1cc2ccccc2cc1Cl dna202 [1,0,0,0,0,0|3,0,0]=4 21 B13R2.369 Cc1cc2ccccc2nc1Br qn071 [1,0,0,0,0,0|2,0,1]=4 22 B13R2.369 Cc1cc2ccccc2nc1C qn059 [1,0,0,0,0,0|2,0,1]=4 23 B13R2.369 Cc1cc2ccccc2nc1N qn075 [1,0,0,0,0,0|2,0,1]=4 24 B13R2.369 c1cc2c(cc(c(=O)[nH]2)Br)nc1 f009fp3 [1,0,0,0,0,0|2,0,0]=3 25 B13R2.369 c1ccc2c(c1)cc(c(=O)[nH]2)Cl qn058 [1,0,0,0,0,0|1,0,0]=2 26 B13R2.369 c1ccc2c(c1)cc(c(=O)[nH]2)O qn068 [1,0,0,0,0,0|0,0,0]=1 27 B13R2.369 c1ccc2c(c1)cc(c(n2)Br)F qn055lit4 [1,0,0,0,0,0|2,0,1]=4 28 B13R2.369 c1ccc2c(c1)cc(c(n2)Br)N qn065 [1,0,0,0,0,0|2,0,1]=4 29 B13R2.369 c1ccc2c(c1)cc(c(n2)Cl)Br qn080 [1,0,0,0,0,0|2,0,1]=4 30 B13R2.369 c1ccc2c(c1)cc(c(n2)Cl)Cl qn057 [1,0,0,0,0,0|2,0,1]=4 31 B13R2.369 c1ccc2c(c1)cc(c(n2)O)F qn055lit3 [1,0,0,0,0,0|1,0,2]=4 32 B13R2.369 c1ccc2cc(c(cc2c1)Cl)Br dna246 [1,0,0,0,0,0|3,0,0]=4 33 B13R2.369 c1ccc2cc(c(cc2c1)F)Br dna176 [1,0,0,0,0,0|3,0,0]=4 34 B13R2.369 c1ccc2cc(c(cc2c1)N)Br dna144 [1,0,0,0,0,0|3,0,0]=4 35 B13R2.369 c1ccc2cc(c(cc2c1)N)Cl dna107 [1,0,0,0,0,0|3,0,0]=4 36 B13R2.369 c1ccc2cc(c(cc2c1)N)F dna444 [1,0,0,0,0,0|3,0,0]=4 37 B13R2.369 c1ccc2cc(c(cc2c1)N)I dna374 [1,0,0,0,0,0|3,0,0]=4 38 B13R2.369 c1ccc2cc(c(cc2c1)O)Cl dna154 [1,0,0,0,0,0|2,0,0]=3 39 B13R2.369 c1ccc2cc(c(cc2c1)O)I dna347 [1,0,0,0,0,0|2,0,0]=3 40 B13R2.3683 Cc1ccc2c(n1)ccc(=O)[nH]2 f009fp1 [1,0,0,0,0,0|2,0,0]=3 41 B13R2.3683 Cc1ccc2c(n1)ccc(n2)Cl f009fp2 [1,0,0,0,0,0|2,0,1]=4 42 B13R2.3683 Cc1ccc2cc(ccc2c1)Br dna098 [1,0,0,0,0,0|2,1,0]=4 43 B13R2.3683 Cc1ccc2cc(ccc2c1)N dna099 [1,0,0,0,0,0|3,0,0]=4 44 B13R2.3683 Cc1cnc2cc(ccc2n1)Cl rp017lit7de5 [1,0,0,0,0,0|2,0,1]=4 45 B13R2.3683 c1cc(cc2c1cc(cc2)Br)Cl dna481 [1,0,0,0,0,0|2,0,0]=3 46 B13R2.3683 c1cc(cc2c1cc(cc2)Cl)O dna114 [1,0,0,0,0,0|1,0,1]=3 47 B13R2.3683 c1cc(cc2c1cc(cc2)F)F dna178 [1,0,0,0,0,0|2,1,0]=4 48 B13R2.3683 c1cc(cc2c1cc(cc2)I)Br dna448 [1,0,0,0,0,0|2,1,0]=4 49 B13R2.3683 c1cc(cc2c1cc(cc2)I)I dna095 [1,0,0,0,0,0|2,1,0]=4 50 B13R2.3683 c1cc(cc2c1cc(cc2)I)O dna327 [1,0,0,0,0,0|1,1,1]=4 51 B13R1.133 c1cc(ccc1NC(=S)C(=O)N)Cl f126de2 [0,0,1,0,0,0|1,1,1]=4 52 B13R1.148 Cc1cccc(c1)NC(=S)C(=O)N f126de5 [0,0,1,0,0,0|2,1,0]=4 53 B13R1.148 c1cc(cc(c1)Br)NC(=S)C(=O)N f126de14 [0,0,1,0,0,0|1,2,0]=4 54 B13R1.148 c1cc(cc(c1)Cl)NC(=S)C(=O)N f126de6 [0,0,1,0,0,0|1,1,0]=3 55 B13R1.148 c1cc(cc(c1)F)NC(=S)C(=O)N f126de18 [0,0,1,0,0,0|1,2,0]=4 56 B12R2.24 c1cc(=O)oc2c1ccnc2 f002fp1fp2 [2,0,0,0,0,0|2,0,0]=4 57 B12R2.24 c1cc2c(cc(cn2)O)nc1 ct009de2 [2,0,0,0,0,0|1,0,1]=4 58 B12R2.24 c1cc2ccc(cc2nc1)O tj006vp1 [2,0,0,0,0,0|2,0,0]=4 59 B12R2.24 c1ccc2c(c1)cc(cn2)Cl qn056 [2,0,0,0,0,0|1,0,1]=4 60 B12R2.24 c1ccc2c(c1)cc(cn2)F qn055 [2,0,0,0,0,0|1,0,1]=4 61 B12R2.24 c1ccc2c(c1)cc(cn2)I fpzz0101fp1 [2,0,0,0,0,0|1,0,1]=4 62 B12R2.24 c1ccc2c(c1)cc(cn2)O a084 [2,0,0,0,0,0|0,0,1]=3 63 B12R2.24 c1ccc2c(c1)cc(cn2)S fpzz0101fp2 [2,0,0,0,0,0|0,1,1]=4 64 B12R2.24 c1ccc2c(c1)ccc(n2)Br ct318 [2,0,0,0,0,0|1,0,1]=4 65 B12R2.24 c1ccc2c(c1)ccc(n2)F qn052 [2,0,0,0,0,0|1,0,1]=4 66 B14R1.153 Cc1c(cccc1Cl)NC(=S)C(=O)N f126de46 [0,1,1,0,0,0|1,1,0]=4 67 B14R1.153 c1cc(c(c(c1)Cl)Cl)NC(=S)C(=O)N f126de39 [0,1,1,0,0,0|1,1,0]=4 68 B14R1.4257 c1c(cc(cc1Cl)Cl)NC(=S)C(=O)N f126de26 [0,1,1,0,0,0|1,1,0]=4 69 B14R1.4474 Cc1ccc(cc1NC(=S)C(=O)N)Cl f126de36 [0,1,1,0,0,0|1,1,0]=4 70 B14R1.4474 c1cc(c(cc1Cl)NC(=S)C(=O)N)Cl f126de24 [0,1,1,0,0,0|1,1,0]=4 71 B14R2.134 COc1ccc2ccc(cc2c1)Br dna434 [1,1,0,0,0,0|1,1,0]=4 72 B14R2.134 COc1ccc2ccc(cc2c1)N dna318 [1,1,0,0,0,0|2,0,0]=4 73 B14R2.1128 COc1cc2ccccc2cc1I dna475 [1,1,0,0,0,0|2,0,0]=4 74 B14R2.1128 COc1cc2ccccc2cc1N dna222 [1,1,0,0,0,0|2,0,0]=4 75 B14R2.1128 Cc1cc2ccccc2cc1C=O dna005 [1,1,0,0,0,0|2,0,0]=4 76 B14R2.1128 Cc1cc2ccccc2cc1OC dna196 [1,1,0,0,0,0|2,0,0]=4 77 B14R2.1128 Cc1cc2ccccc2nc1C=O qn082 [1,1,0,0,0,0|1,0,1]=4 78 B14R2.1128 c1cc2c(cc(c(=O)[nH]2)C#N)nc1 ct255fp3fp4 [1,1,0,0,0,0|2,0,0]=4 79 B14R2.1128 c1ccc2c(c1)cc(c(=O)[nH]2)C#N qn072 [1,1,0,0,0,0|1,0,0]=3 80 B14R2.1128 c1ccc2c(c1)cc(c(n2)C#N)O qn063 [1,1,0,0,0,0|1,0,1]=4 81 B14R2.1128 c1ccc2cc(c(cc2c1)C#N)O dna134 [1,1,0,0,0,0|2,0,0]=4 82 B14R2.1128 c1ccc2cc(c(cc2c1)C=O)Br dna282 [1,1,0,0,0,0|2,0,0]=4 83 B14R2.1128 c1ccc2cc(c(cc2c1)C=O)Cl dna271 [1,1,0,0,0,0|2,0,0]=4 84 B14R2.1128 c1ccc2cc(c(cc2c1)C=O)F dna038 [1,1,0,0,0,0|2,0,0]=4 85 B14R2.1128 c1ccc2cc(c(cc2c1)C=O)N dna414 [1,1,0,0,0,0|2,0,0]=4 86 B14R2.1128 c1cncc2c1cc(c(=O)[nH]2)C#N f002de1fp3 [1,1,0,0,0,0|2,0,0]=4 87 B14R2.8188 Cc1c(=O)n(c2ccccc2n1)C pw013 [1,1,0,0,0,0|2,0,0]=4 88 B14R2.8188 Cc1c(c2ccccc2[nH]c1=O)N qn011de2 [1,1,0,0,0,0|1,0,0]=3 89 B14R2.2332 COc1ccc2c(c1)ccc(=O)o2 ps010 [1,1,0,0,0,0|2,0,0]=4 90 B14R2.2332 COc1ccc2cc(ccc2c1)Cl dna226 [1,1,0,0,0,0|1,0,1]=4 91 B14R2.2332 c1cc2cc(ccc2cc1C=O)F dna471 [1,1,0,0,0,0|1,1,0]=4 92 B14R2.8235 c1cc2c(cc1Cl)c(cc(n2)N)O qn025lit8 [1,1,0,0,0,0|1,0,1]=4 93 B14R2.645 Cc1cc2c(cc1C)NC(=O)C2=O pw038 [0,1,0,0,1,0|1,0,1]=4 94 B14R2.4506 Cc1ccc2c(c1C)C(=O)C(=O)N2 pw036 [0,1,0,0,1,0|1,0,1]=4 95 B14R2.4507 c1cc2c(cc1Cl)C(C(=O)N2)(Br)Br md017fp03 [0,1,0,0,1,0|1,0,1]=4 96 B16R2.23520 c1cc2c(cc1Cl)cc(c(n2)C(=O)O)F qn055lit11 [0,2,0,0,0,0|1,0,1]=4 97 B12R2.132 c1cc2c(cc1Cl)c(c[nH]2)Br md017fp06 [1,0,0,0,1,0|1,0,0]=3 98 B12R2.132 c1cc2c(cc1Cl)c(c[nH]2)Cl md017fp12 [1,0,0,0,1,0|1,0,0]=3 99 B12R2.132 c1cc2c(cc1Cl)c(c[nH]2)I md017fp07 [1,0,0,0,1,0|1,0,0]=3 100 B12R2.612 Cn1ccc2c1ccc(c2)Cl md017fp13 [1,0,0,0,1,0|2,0,0]=4