0 B18R3.174 Cc1cc(c2[nH]cnc2c1)C3=CCCCO3 AIFCHEM-94519054527 [0,0,0,0,0,0|3,0,1]=4 1 B18R3.174 Cc1cc(c2[nH]cnc2c1)C3=COCCC3 AIFCHEM-94519054617 [0,0,0,0,0,0|3,0,1]=4 2 B18R3.174 Cc1cc(c2cc[nH]c2c1)C3=CCCNC3 AIFCHEM-6470750335 [0,0,0,0,0,0|0,0,0]=0 3 B18R3.174 Cc1cc(c2cc[nH]c2c1)c3cccnc3 AIFCHEM-94520920656 [0,0,0,0,0,0|0,0,4]=4 4 B18R3.174 Cc1cc(c2cc[nH]c2c1)c3ccncc3 AIFCHEM-94530065331 [0,0,0,0,0,0|2,0,2]=4 5 B18R3.174 Cc1cc(c2cn[nH]c2c1)C3=CCCCO3 AIFCHEM-6274129302 [0,0,0,0,0,0|3,0,0]=3 6 B18R3.174 Cc1cc(c2cn[nH]c2c1)C3=CCOCC3 AIFCHEM-6220037190 [0,0,0,0,0,0|3,0,0]=3 7 B18R3.174 Cc1cc(c2occc2c1)C3=CCCNC3 AIFCHEM-6324937068 [0,0,0,0,0,0|2,0,0]=2 8 B18R3.174 Cc1cc(c2occc2c1)C3=CCSCC3 AIFCHEM-6325066338 [0,0,0,0,0,0|4,0,0]=4 9 B18R3.174 Cc1cc(c2occc2c1)C3=COCCC3 AIFCHEM-6296408072 [0,0,0,0,0,0|4,0,0]=4 10 B18R3.174 Cc1cc(n2ccnc2c1)C3=CCCCC3 AIFCHEM-6310857391 [0,0,0,0,0,0|2,0,1]=3 11 B18R3.174 Cc1cc(n2ccnc2c1)C3=CCCCO3 AIFCHEM-6310802336 [0,0,0,0,0,0|3,0,1]=4 12 B18R3.174 Fc1cc(c2[nH]ccc2c1)C3=CCCNC3 AIFCHEM-6375187405 [0,0,0,0,0,0|3,0,0]=3 13 B18R3.174 Fc1cc(c2[nH]ncc2c1)C3=CCCNC3 AIFCHEM-6451337990 [0,0,0,0,0,0|4,0,0]=4 14 B18R3.174 Fc1cc(c2cc[nH]c2c1)C3=CCSCC3 AIFCHEM-6478125892 [0,0,0,0,0,0|3,0,0]=3 15 B18R3.174 Fc1cc(c2cn[nH]c2c1)C3=CCCCO3 AIFCHEM-6374792659 [0,0,0,0,0,0|4,0,0]=4 16 B18R3.174 Fc1cc(c2ncoc2c1)C3=CCCNC3 AIFCHEM-6335039756 [0,0,0,0,0,0|3,0,0]=3 17 B18R3.174 Fc1cc(c2ncsc2c1)C3=CCCNC3 AIFCHEM-94529202768 [0,0,0,0,0,0|3,0,0]=3 18 B18R3.174 Nc1cc(c2cc[nH]c2c1)C3=CCOCC3 AIFCHEM-94564158405 [0,0,0,0,0,0|3,0,0]=3 19 B18R3.174 Nc1cc(c2cc[nH]c2c1)C3=CCSCC3 AIFCHEM-94564161630 [0,0,0,0,0,0|3,0,0]=3 20 B18R3.174 Nc1cc(c2cc[nH]c2n1)C3=CCCCC3 AIFCHEM-6107101276 [0,0,0,0,0,0|3,0,0]=3 21 B18R3.174 Nc1cc(c2cn[nH]c2c1)C3=CCCCC3 AIFCHEM-6244729272 [0,0,0,0,0,0|3,0,0]=3 22 B18R3.174 Nc1cc(c2cn[nH]c2c1)C3=CCCCO3 AIFCHEM-6243380980 [0,0,0,0,0,0|4,0,0]=4 23 B18R3.174 Nc1cc(c2cn[nH]c2c1)C3=CCSCC3 AIFCHEM-6244718666 [0,0,0,0,0,0|4,0,0]=4 24 B18R3.174 Oc1cc(c2[nH]ncc2c1)C3=CCCNC3 AIFCHEM-6360518605 [0,0,0,0,0,0|4,0,0]=4 25 B17R3.8707 C1=C(CCCC1)c2cccc3c2cns3 AIFCHEM-6317271450 [1,0,0,0,0,0|3,0,0]=4 26 B17R3.8707 C1=C(CCCC1)c2cccc3c2nco3 AIFCHEM-6223689367 [1,0,0,0,0,0|3,0,0]=4 27 B17R3.8707 C1=C(CCCC1)c2cccc3c2scc3 AIFCHEM-6353608869 [1,0,0,0,0,0|3,0,0]=4 28 B17R3.8707 C1=C(CCCC1)c2nccc3c2cc[nH]3 AIFCHEM-6311883868 [1,0,0,0,0,0|2,0,0]=3 29 B17R3.8707 C1=C(CCCC1)c2nccc3c2cco3 AIFCHEM-6312615217 [1,0,0,0,0,0|3,0,0]=4 30 B17R3.8707 C1=C(CCCO1)c2cccc3c2cn[nH]3 AIFCHEM-6454109233 [1,0,0,0,0,0|3,0,0]=4 31 B17R3.8707 C1=C(CCNC1)c2cccc3c2cc[nH]3 AIFCHEM-6368901846 [1,0,0,0,0,0|2,0,0]=3 32 B17R3.8707 C1=C(CCNC1)c2ccnc3c2cc[nH]3 AIFCHEM-6414414598 [1,0,0,0,0,0|3,0,0]=4 33 B17R3.8707 C1=C(CCNC1)c2nccc3c2cc[nH]3 AIFCHEM-6335894219 [1,0,0,0,0,0|3,0,0]=4 34 B17R3.8707 C1=C(CCOC1)c2cccc3c2ccs3 AIFCHEM-6450784600 [1,0,0,0,0,0|3,0,0]=4 35 B17R3.8707 C1=C(CCSC1)c2cccc3c2cn[nH]3 AIFCHEM-6425842874 [1,0,0,0,0,0|3,0,0]=4 36 B17R3.8707 C1=C(CNCC1)c2cccc3c2CCN3 AIFCHEM-94594634850 [1,0,0,0,0,0|0,0,2]=3 37 B17R3.8707 C1=C(CNCC1)c2cccc3c2[nH]nn3 AIFCHEM-94538518605 [1,0,0,0,0,0|2,0,1]=4 38 B17R3.8707 C1=C(CNCC1)c2cccc3c2cn[nH]3 AIFCHEM-6403270447 [1,0,0,0,0,0|1,0,0]=2 39 B17R3.8707 C1=C(CNCC1)c2cccc3c2non3 AIFCHEM-6387920517 [1,0,0,0,0,0|2,0,1]=4 40 B17R3.8707 C1=C(CNCC1)c2cccc3c2nsn3 AIFCHEM-6323294419 [1,0,0,0,0,0|2,0,1]=4 41 B17R3.8707 C1=C(CNCC1)c2cccc3c2scn3 AIFCHEM-6412785842 [1,0,0,0,0,0|1,0,1]=3 42 B17R3.8707 C1=C(CNCC1)c2ccnc3c2[nH]cn3 AIFCHEM-6338857833 [1,0,0,0,0,0|2,0,1]=4 43 B17R3.8707 C1=C(CNCC1)c2cncc3n2ccn3 AIFCHEM-6309029317 [1,0,0,0,0,0|2,0,1]=4 44 B17R3.8707 C1=C(OCCC1)c2ccnc3c2cc[nH]3 AIFCHEM-6414366234 [1,0,0,0,0,0|3,0,0]=4 45 B17R3.8707 C1=C(OCCO1)c2cccc3c2cc[nH]3 AIFCHEM-6377886021 [1,0,0,0,0,0|2,0,1]=4 46 B19R3.506 COc1cc(c2cc[nH]c2c1)C3=CCCCO3 AIFCHEM-6306401685 [0,1,0,0,0,0|2,0,0]=3 47 B19R3.506 COc1cc(c2cn[nH]c2c1)C3=CCCCC3 AIFCHEM-6385659533 [0,1,0,0,0,0|2,0,0]=3 48 B19R3.506 COc1cc(c2cn[nH]c2c1)C3=CCSCC3 AIFCHEM-6385611868 [0,1,0,0,0,0|3,0,0]=4 49 B19R3.506 N#Cc1cc(c2cc[nH]c2c1)C3=CCNCC3 AIFCHEM-6322884200 [0,1,0,0,0,0|2,0,1]=4 50 B19R3.506 OCc1cc(c2cc[nH]c2c1)C3=CCCCO3 AIFCHEM-6402337013 [0,1,0,0,0,0|2,0,0]=3 51 B19R3.506 OCc1cc(c2cc[nH]c2c1)C3=CCNCC3 AIFCHEM-6429408580 [0,1,0,0,0,0|2,0,0]=3 52 B19R3.5829 Cc1cc2c(c(c1)C3=CCCNC3)CCC2=O AIFCHEM-6485521059 [0,1,0,0,0,0|1,0,2]=4 53 B19R3.2130831 CC1CC=C(CC1)c2cc(cc3c2cn[nH]3)N AIFCHEM-6279195975 [0,1,0,0,0,0|3,0,0]=4 54 B19R3.2130831 Cc1cc(c2[nH]cnc2c1)C3=CCC(CC3)C AIFCHEM-94519057547 [0,1,0,0,0,0|2,0,1]=4 55 B19R3.2130831 Cc1cc(c2cc[nH]c2c1)C3=CCC(CC3)C AIFCHEM-6484031672 [0,1,0,0,0,0|1,0,0]=2 56 B19R3.2130831 Cc1cc(c2occc2c1)C3=CCC(CC3)N AIFCHEM-94531772931 [0,1,0,0,0,0|3,0,0]=4 57 B19R3.2130831 Nc1cc(c2cc[nH]c2c1)C3=CCC(CC3)O AIFCHEM-94564159432 [0,1,0,0,0,0|2,0,0]=3 58 B19R3.2130831 Nc1cc(c2cn[nH]c2c1)C3=CCC(CC3)O AIFCHEM-6279346603 [0,1,0,0,0,0|3,0,0]=4 59 B19R3.2130831 OC1CC=C(CC1)c2cc(cc3c2cc[nH]3)F AIFCHEM-6315432724 [0,1,0,0,0,0|2,0,0]=3 60 B19R3.2145860 Cc1cc(c2cc[nH]c2c1)C3=CC(=O)CCC3 AIFCHEM-6476393649 [0,1,0,0,0,0|1,0,1]=3 61 B19R3.2145860 Cc1cc(c2cn[nH]c2c1)C3=CC(=O)CCC3 AIFCHEM-6281467374 [0,1,0,0,0,0|2,0,1]=4 62 B19R3.2145860 Cc1cc(c2ncnn2c1)C3=CCCN(C3)C AIFCHEM-6349933190 [0,1,0,0,0,0|2,0,1]=4 63 B17R2.17866 Cc1cc(c(c(c1)C2=CCCNC2)C=O)F AIFCHEM-6376855299 [0,0,1,0,0,0|2,0,0]=3 64 B17R2.46861 CCCCC=Cc1cc(cc2c1[nH]cn2)C AIFCHEM-94519057016 [0,0,1,0,0,0|2,0,1]=4 65 B17R3.104 Cc1cc(c2[nH]cnc2c1)C3=COCC3 AIFCHEM-94519054618 [0,0,0,0,1,0|2,0,1]=4 66 B17R3.104 Cc1cc(c2cc[nH]c2c1)c3ccoc3 AIFCHEM-6390424833 [0,0,0,0,1,0|1,0,2]=4 67 B17R3.104 Cc1cc(c2ncnn2c1)C3=CCNC3 AIFCHEM-6377611404 [0,0,0,0,1,0|2,0,1]=4 68 B17R3.104 Cc1cc(c2occc2c1)C3=CCCC3 AIFCHEM-6295961784 [0,0,0,0,1,0|2,0,0]=3 69 B17R3.104 Cc1cc(n2ccnc2c1)C3=CCCC3 AIFCHEM-6317860072 [0,0,0,0,1,0|1,0,1]=3 70 B17R3.104 Fc1cc(c2cc[nH]c2c1)C3=COCC3 AIFCHEM-6395638185 [0,0,0,0,1,0|2,0,0]=3 71 B17R3.104 Fc1cc(c2ncsc2c1)C3=CCNC3 AIFCHEM-94529203019 [0,0,0,0,1,0|3,0,0]=4 72 B17R3.104 Nc1cc(c2cc[nH]c2c1)C3=CCNC3 AIFCHEM-94564160580 [0,0,0,0,1,0|1,0,0]=2 73 B17R3.104 Nc1cc(c2cc[nH]c2c1)C3=CCOC3 AIFCHEM-94564160334 [0,0,0,0,1,0|2,0,0]=3 74 B17R3.104 Nc1cc(c2cn[nH]c2c1)C3=CCNC3 AIFCHEM-6246896053 [0,0,0,0,1,0|2,0,0]=3 75 B19R3.284 Cc1cc(c2cc[nH]c2c1)C=C3CCOCC3 AIFCHEM-6483966955 [0,0,0,0,0,1|2,0,1]=4 76 B19R3.294 Cc1cc(c2ccccc2n1)C3=CCCCC3 AIFCHEM-6340504262 [0,0,0,0,0,1|3,0,0]=4 77 B19R3.294 Cc1cc(c2ccccc2n1)C3=CCCNC3 AIFCHEM-6291472305 [0,0,0,0,0,1|2,0,0]=3 78 B19R3.294 Fc1cc(c2nccnc2c1)C3=CCCNC3 AIFCHEM-94589504949 [0,0,0,0,0,1|1,0,1]=3 79 B19R3.294 Nc1cc2cccnc2c(n1)C3=CCCNC3 AIFCHEM-5909661807 [0,0,0,0,0,1|3,0,0]=4 80 B19R3.156707 Cc1cc(c2occc2c1)C3=CCCCCC3 AIFCHEM-6342543999 [0,0,0,0,0,1|3,0,0]=4 81 B19R3.156707 Nc1cc(c2cc[nH]c2n1)C3=CCCCCC3 AIFCHEM-6127391569 [0,0,0,0,0,1|3,0,0]=4 82 B19R3.156707 Nc1cc(c2cn[nH]c2c1)C3=CCCCCC3 AIFCHEM-6246972121 [0,0,0,0,0,1|3,0,0]=4 83 B16R2.19 CNc1cc(cc(c1)C2=CCCNC2)F AIFCHEM-6085624468 [1,0,1,0,0,0|1,0,1]=4 84 B16R2.19 O=Cc1cc(cc(c1)C2=CCCNC2)F AIFCHEM-6456993353 [1,0,1,0,0,0|2,0,0]=4 85 B16R2.6164 Cc1cc(c(c(c1)C2=CCCCC2)C)N AIFCHEM-5957950435 [1,0,1,0,0,0|1,0,1]=4 86 B16R2.6164 Cc1cc(c(c(c1)C2=CCCNC2)C)N AIFCHEM-5991672216 [1,0,1,0,0,0|0,0,1]=3 87 B16R2.2443 COc1ccc(cc1C2=CCCNC2)C AIFCHEM-94571713296 [1,0,1,0,0,0|1,0,1]=4 88 B16R2.2443 Cc1ccc(c(c1)C2=CCCCC2)C=O AIFCHEM-6294652673 [1,0,1,0,0,0|2,0,0]=4 89 B16R2.2443 NCc1ccc(cc1C2=CCCNC2)F AIFCHEM-5907071622 [1,0,1,0,0,0|1,0,1]=4 90 B16R2.2602 COc1c(cccc1C2=CCCNC2)N AIFCHEM-6120881691 [1,0,1,0,0,0|1,0,1]=4 91 B16R2.7689 CCCC=Cc1cc(cc2c1cn[nH]2)F AIFCHEM-6294131085 [1,0,1,0,0,0|2,0,0]=4 92 B16R2.7689 CCCC=Cc1cc(cc2c1cn[nH]2)N AIFCHEM-6244324613 [1,0,1,0,0,0|2,0,0]=4 93 B16R2.7689 COCC=Cc1cc(cc2c1cc[nH]2)F AIFCHEM-6314858175 [1,0,1,0,0,0|2,0,0]=4 94 B16R2.7689 COCC=Cc1cc(cc2c1cn[nH]2)C AIFCHEM-6254245263 [1,0,1,0,0,0|2,0,0]=4 95 B16R2.11632 CCCCC=Cc1cccc2c1ccs2 AIFCHEM-6450784597 [1,0,1,0,0,0|2,0,0]=4 96 B16R2.11632 CCCCC=Cc1cncc2c1cc[nH]2 AIFCHEM-6308984429 [1,0,1,0,0,0|2,0,0]=4 97 B18R2.3670 CC(=O)Nc1cc(cc(c1)C2=CCCNC2)F AIFCHEM-96556418790 [0,1,1,0,0,0|1,0,1]=4 98 B18R2.4046 CC(=O)Nc1ccc(cc1C2=CCCNC2)C AIFCHEM-94573944883 [0,1,1,0,0,0|2,0,0]=4 99 B18R2.7859 COc1cc(c(c(c1)C2=CCCNC2)C=O)O AIFCHEM-6343678216 [0,1,1,0,0,0|2,0,0]=4 100 B18R2.99369 CCCCCC=Cc1cc(cc2c1cc[nH]2)C AIFCHEM-6404503770 [0,1,1,0,0,0|1,0,0]=3 101 B18R2.99369 CCCCCC=Cc1cc(cc2c1cc[nH]2)N AIFCHEM-94564161163 [0,1,1,0,0,0|2,0,0]=4 102 B18R2.99369 CCCCCC=Cc1cc(cc2c1cn[nH]2)C AIFCHEM-6281409573 [0,1,1,0,0,0|2,0,0]=4 103 B18R3.1 Cn1ccc2c1cccc2C3=COCCC3 AIFCHEM-6331969513 [1,1,0,0,0,0|2,0,0]=4 104 B18R3.1 Cn1ccc2c1cncc2C3=CCCNC3 AIFCHEM-6396751544 [1,1,0,0,0,0|1,0,0]=3 105 B18R3.1 Cn1ncc2c1cccc2C3=CCCNC3 AIFCHEM-6351907259 [1,1,0,0,0,0|1,0,0]=3 106 B18R3.1 Cn1ncc2c1cncc2C3=CCCNC3 AIFCHEM-6314369383 [1,1,0,0,0,0|2,0,0]=4 107 B18R3.213 Cc1cc2c(cccc2[nH]1)C3=CCOCC3 AIFCHEM-6353436273 [1,1,0,0,0,0|2,0,0]=4 108 B18R3.213 Cc1nc2c(cccc2[nH]1)C3=CCCCC3 AIFCHEM-6299242392 [1,1,0,0,0,0|2,0,0]=4 109 B18R3.213 Cc1nc2c(cccc2[nH]1)C3=CCCNC3 AIFCHEM-6299164723 [1,1,0,0,0,0|1,0,0]=3 110 B18R3.213 Nc1cn2c(cccc2n1)C3=CCCNC3 AIFCHEM-6091391476 [1,1,0,0,0,0|1,0,1]=4 111 B18R3.213 O=c1[nH]c2cccc(c2o1)C3=CCCCC3 AIFCHEM-6470642327 [1,1,0,0,0,0|2,0,0]=4 112 B18R3.213 O=c1[nH]c2cncc(c2[nH]1)C3=CCCNC3 AIFCHEM-94590001004 [1,1,0,0,0,0|2,0,0]=4 113 B18R3.3067 Cc1ccc2[nH]ccc2c1C3=CCOCC3 AIFCHEM-6378270991 [1,1,0,0,0,0|2,0,0]=4 114 B18R3.3067 Cc1ccc2[nH]ccc2c1C3=COCCC3 AIFCHEM-6378401110 [1,1,0,0,0,0|2,0,0]=4 115 B18R3.3067 Fc1ccc2[nH]ccc2c1C3=CCCCO3 AIFCHEM-6383943539 [1,1,0,0,0,0|2,0,0]=4 116 B18R3.3067 Fc1ccc2[nH]ccc2c1C3=COCCC3 AIFCHEM-6368618990 [1,1,0,0,0,0|2,0,0]=4 117 B18R3.6433 Cc1ccc(c2c1[nH]cc2)C3=CCCCC3 AIFCHEM-6319503755 [1,1,0,0,0,0|1,0,0]=3 118 B18R3.6433 Fc1ccc(c2c1[nH]cc2)C3=CCOCC3 AIFCHEM-6310495458 [1,1,0,0,0,0|2,0,0]=4 119 B18R3.6433 Fc1ccc(c2c1[nH]cc2)C3=COCCC3 AIFCHEM-6358786267 [1,1,0,0,0,0|2,0,0]=4 120 B18R3.8788 CC1CC=C(CC1)c2cccc3c2ccs3 AIFCHEM-6423893067 [1,1,0,0,0,0|2,0,0]=4 121 B18R3.8788 CC1CC=C(CC1)c2ccnc3c2cc[nH]3 AIFCHEM-6435454990 [1,1,0,0,0,0|2,0,0]=4 122 B18R3.8788 CC1CC=C(CC1)c2nccc3c2cc[nH]3 AIFCHEM-6296505023 [1,1,0,0,0,0|2,0,0]=4 123 B18R3.8788 OC1CC=C(CC1)c2cccc3c2nc[nH]3 AIFCHEM-6310596648 [1,1,0,0,0,0|2,0,0]=4 124 B18R3.8788 OC1CC=C(CC1)c2nccc3c2cc[nH]3 AIFCHEM-6311953170 [1,1,0,0,0,0|2,0,0]=4 125 B18R3.31674 CN1CCC=C(C1)c2cccc3c2occ3 AIFCHEM-6381913842 [1,1,0,0,0,0|2,0,0]=4 126 B18R3.31674 CN1CCC=C(C1)c2cccc3c2scc3 AIFCHEM-6353234441 [1,1,0,0,0,0|2,0,0]=4 127 B18R3.31674 CN1CCC=C(C1)c2cccc3c2scn3 AIFCHEM-6479553530 [1,1,0,0,0,0|1,0,1]=4 128 B18R3.31674 CN1CCC=C(C1)c2cccn3c2ccn3 AIFCHEM-6351166536 [1,1,0,0,0,0|1,0,1]=4 129 B18R3.31674 CN1CCC=C(C1)c2nccc3c2cn[nH]3 AIFCHEM-6358436525 [1,1,0,0,0,0|2,0,0]=4 130 B18R3.31674 O=C1C=C(CCC1)c2cccc3c2cc[nH]3 AIFCHEM-6386487714 [1,1,0,0,0,0|1,0,1]=4 131 B18R3.51480 Cc1c[nH]c2c1c(ccc2)C3=CCCCC3 AIFCHEM-6332692217 [1,1,0,0,0,0|1,0,0]=3 132 B18R3.51480 Cc1c[nH]c2c1c(ccn2)C3=CCCCC3 AIFCHEM-6293025988 [1,1,0,0,0,0|2,0,0]=4 133 B18R3.51480 Cc1n[nH]c2c1c(ccc2)C3=CCCCC3 AIFCHEM-6379701608 [1,1,0,0,0,0|2,0,0]=4 134 B18R3.51480 Nc1c[nH]c2c1c(ccn2)C3=CCCCC3 AIFCHEM-5892191199 [1,1,0,0,0,0|2,0,0]=4 135 B18R3.51480 Nc1snc2c1c(ccc2)C3=CCCNC3 AIFCHEM-6223261043 [1,1,0,0,0,0|1,0,1]=4 136 B18R3.51480 O=C1CCc2c1c(ccc2)C3=CCCNC3 AIFCHEM-6300686476 [1,1,0,0,0,0|1,0,1]=4 137 B18R3.305 COc1cc(c2[nH]ccc2c1)C3=CCCC3 AIFCHEM-6413915866 [0,1,0,0,1,0|2,0,0]=4 138 B18R3.305 COc1cc(c2cc[nH]c2c1)c3cn[nH]c3 AIFCHEM-94525314032 [0,1,0,0,1,0|1,0,1]=4 139 B18R3.305 COc1cc(c2ccnn2c1)C3=CCCC3 AIFCHEM-6368566024 [0,1,0,0,1,0|1,0,1]=4 140 B18R3.305 COc1cc(c2cn[nH]c2c1)C3=CCCC3 AIFCHEM-6375247475 [0,1,0,0,1,0|1,0,0]=3 141 B18R3.305 N#Cc1cc(c2cn[nH]c2c1)C3=CCCC3 AIFCHEM-6318999523 [0,1,0,0,1,0|1,0,1]=4 142 B18R3.305 OCc1cc(c2cc[nH]c2c1)C3=CCCC3 AIFCHEM-6426358523 [0,1,0,0,1,0|0,0,0]=2 143 B18R3.92301 Cc1cc2nc[nH]c2c(c1C)C3=CCNC3 AIFCHEM-94549192614 [0,1,0,0,1,0|1,0,1]=4 144 B18R3.394747 Cc1cc(c2cc[nH]c2c1)c3ccn(n3)C AIFCHEM-6404613189 [0,1,0,0,1,0|1,0,1]=4 145 B20R3.145206 O=c1ccc2cc(cc(c2[nH]1)C3=CCCNC3)F AIFCHEM-6451767384 [0,1,0,0,0,1|2,0,0]=4 146 B20R3.2785813 CN1CCC=C(C1)c2cc(cc3c2cccc3)N AIFCHEM-6252375454 [0,1,0,0,0,1|2,0,0]=4 147 B20R3.2785813 Cc1cc(c2ncccc2c1)C3=CCCN(C3)C AIFCHEM-6296010458 [0,1,0,0,0,1|1,0,0]=3 148 B20R3.460820 N#Cc1cc(c2cc[nH]c2c1)C3=CCCCCC3 AIFCHEM-6294485335 [0,1,0,0,0,1|1,0,1]=4 149 B20R3.460820 OCc1cc(c2cc[nH]c2c1)C3=CCCCCC3 AIFCHEM-6429456436 [0,1,0,0,0,1|1,0,0]=3 150 B20R3.742 CN1CC=C(CC1)c2cc(cc3c2cc[nH]3)CO AIFCHEM-6456823473 [0,2,0,0,0,0|2,0,0]=4 151 B20R3.742 COc1cc(c2cc[nH]c2c1)C3=CCC(CC3)N AIFCHEM-94531773339 [0,2,0,0,0,0|1,0,0]=3 152 B20R3.742 N#Cc1cc(c2cc[nH]c2c1)C3=CCC(CC3)O AIFCHEM-6375477688 [0,2,0,0,0,0|1,0,1]=4 153 B20R3.15840 NC(=O)c1cc(c2cc[nH]c2c1)C3=CCCNC3 AIFCHEM-6407279609 [0,2,0,0,0,0|0,0,1]=3 154 B20R3.22847 CN1CCC=C(C1)c2cc(cc3c2cc[nH]3)C#N AIFCHEM-6294249249 [0,2,0,0,0,0|0,0,1]=3 155 B20R3.22847 COc1cc(c2cn[nH]c2c1)C3=CCCN(C3)C AIFCHEM-6365856100 [0,2,0,0,0,0|1,0,0]=3 156 B20R3.12659 Cc1cc(c2cc[nH]c2c1)C3=CCC(CC3)(C)C AIFCHEM-6470729081 [0,2,0,0,0,0|1,0,0]=3 157 B20R3.109841 CCC1CC=C(CC1)c2cc(cc3c2cc[nH]3)C AIFCHEM-6390278732 [0,2,0,0,0,0|1,0,0]=3 158 B18R3.6550 Cc1cc(cc2c1cc[nH]2)C3=CCSCC3 AIFCHEM-6367874248 [0,0,1,1,0,0|2,0,0]=4 159 B18R3.6550 Cc1cc(cc2c1cn[nH]2)C3=CCCNC3 AIFCHEM-6349316924 [0,0,1,1,0,0|1,0,0]=3 160 B18R3.6550 Nc1cc(cc2c1cc[nH]2)C3=CCCNC3 AIFCHEM-5797707418 [0,0,1,1,0,0|1,0,0]=3 161 B18R3.6550 Oc1cc(cc2c1cn[nH]2)C3=CCCNC3 AIFCHEM-6364165485 [0,0,1,1,0,0|2,0,0]=4 162 B18R3.6125 Cc1cc(c2cc[nH]c2c1)C=C3CCCC3 AIFCHEM-6476239777 [0,0,1,1,0,0|1,0,0]=3 163 B18R3.6125 Cc1cc(c2cn[nH]c2c1)C=C3CCCC3 AIFCHEM-6209104982 [0,0,1,1,0,0|2,0,0]=4 164 B16R2.10937 Cc1cc(c(c(c1)C2=CCCC2)C=O)F AIFCHEM-6376359120 [0,0,1,0,1,0|2,0,0]=4 165 B16R3.5924 C1=C(CCC1)c2cccc3c2cc[nH]3 AIFCHEM-6425597280 [1,0,0,0,1,0|0,0,0]=2 166 B16R3.5924 C1=C(CCC1)c2cccc3c2cco3 AIFCHEM-6313955107 [1,0,0,0,1,0|1,0,0]=3 167 B16R3.5924 C1=C(CCC1)c2cccc3c2cns3 AIFCHEM-6322230327 [1,0,0,0,1,0|2,0,0]=4 168 B16R3.5924 C1=C(CCC1)c2cccc3c2ncs3 AIFCHEM-6419115703 [1,0,0,0,1,0|2,0,0]=4 169 B16R3.5924 C1=C(CCC1)c2cccc3c2occ3 AIFCHEM-6337519463 [1,0,0,0,1,0|2,0,0]=4 170 B16R3.5924 C1=C(CCC1)c2cccc3c2ocn3 AIFCHEM-6364307310 [1,0,0,0,1,0|1,0,1]=4 171 B16R3.5924 C1=C(CCC1)c2cncc3c2cc[nH]3 AIFCHEM-6381595756 [1,0,0,0,1,0|1,0,0]=3 172 B16R3.5924 C1=C(CCC1)c2cncc3c2cn[nH]3 AIFCHEM-6456623749 [1,0,0,0,1,0|2,0,0]=4 173 B16R3.5924 C1=C(CNC1)c2cccc3c2cn[nH]3 AIFCHEM-6457140508 [1,0,0,0,1,0|1,0,0]=3 174 B16R3.5924 C1=C(CNC1)c2cccc3c2cno3 AIFCHEM-6322287565 [1,0,0,0,1,0|2,0,0]=4 175 B16R3.5924 C1=C(CNC1)c2cccc3c2occ3 AIFCHEM-6309428112 [1,0,0,0,1,0|2,0,0]=4 176 B16R3.5924 C1=C(CNC1)c2cccn3c2ccn3 AIFCHEM-6351012814 [1,0,0,0,1,0|1,0,1]=4 177 B16R3.5924 C1=C(CNC1)c2nccc3c2cc[nH]3 AIFCHEM-6368380294 [1,0,0,0,1,0|1,0,0]=3 178 B16R3.5924 C1=C(COC1)c2ccnc3c2cc[nH]3 AIFCHEM-6405636398 [1,0,0,0,1,0|2,0,0]=4 179 B16R3.5924 C1=C(COC1)c2cncc3c2cc[nH]3 AIFCHEM-6381659090 [1,0,0,0,1,0|2,0,0]=4 180 B18R3.2108 C1=C(CCCC1)c2cccc3c2cccn3 AIFCHEM-94583243477 [1,0,0,0,0,1|1,0,1]=4 181 B18R3.2108 C1=C(CNCC1)c2cccc3c2CCNC3 AIFCHEM-94575660255 [1,0,0,0,0,1|0,0,2]=4 182 B18R3.1440748 C1=C(CCCCC1)c2cccc3c2ccs3 AIFCHEM-6454847042 [1,0,0,0,0,1|2,0,0]=4 183 B18R3.171 Fc1cc2[nH]ccc2cc1C3=CCCCC3 AIFCHEM-6308788622 [0,0,0,0,1,1|2,0,0]=4 184 B18R3.171 Fc1cc2[nH]ncc2cc1C3=CCCNC3 AIFCHEM-6193830749 [0,0,0,0,1,1|2,0,0]=4 185 B18R3.171 Oc1cc2[nH]ncc2cc1C3=CCCNC3 AIFCHEM-6335500674 [0,0,0,0,1,1|2,0,0]=4