0 B19R3.292 Nc1cc2ccccc2cc1C=C3CCCC3 AIFCHEM-94543835818 [0,1,0,0,0,0|2,0,1]=4 1 B19R3.50998 CC1CCN(C1)Cc2ccc3ccccc3c2 AIFCHEM-5683302534 [0,1,0,0,0,0|3,0,0]=4 2 B19R3.50998 C[C@@H]1CCN(C1)Cc2ccc3ccccc3c2 AIFCHEM-5867973056 [0,1,0,0,0,0|3,0,0]=4 3 B19R3.50998 C[C@H]1CCN(C1)Cc2ccc3ccccc3c2 AIFCHEM-5608965558 [0,1,0,0,0,0|3,0,0]=4 4 B19R3.54903 Oc1ccc2ccc(cc2c1)C=C3CCCC3 AIFCHEM-6430015237 [0,1,0,0,0,0|2,0,1]=4 5 B19R3.55014 Fc1ccc2cc(ccc2c1)C=C3CCCC3 AIFCHEM-6366073829 [0,1,0,0,0,0|2,0,1]=4 6 B19R3.171666 Oc1cc(cc2c1cccc2)C=C3CCCC3 AIFCHEM-6456436574 [0,1,0,0,0,0|2,0,1]=4 7 B19R3.2183900 Cc1c(ccc2c1cccc2)C=C3CCCC3 AIFCHEM-6345667079 [0,1,0,0,0,0|2,0,1]=4 8 B19R3.2183900 Oc1c(ccc2c1cccc2)C=C3CCCC3 AIFCHEM-6334687546 [0,1,0,0,0,0|2,0,1]=4 9 B19R3.2991659 Cc1cccc2c1cc(cc2)C=C3CCCC3 AIFCHEM-6333401978 [0,1,0,0,0,0|2,0,1]=4 10 B19R3.2991659 Nc1cccc2c1cc(cc2)C=C3CCCC3 AIFCHEM-6058093196 [0,1,0,0,0,0|2,0,1]=4 11 B17R2.5879 CCCCC=Cc1ccc2ccccc2c1 AIFCHEM-6322077027 [0,0,1,0,0,0|2,0,1]=4 12 B17R3.1917 C1=C(CCC1)c2ccc3ccccc3c2 AIFCHEM-6322667786 [0,0,0,0,1,0|2,0,0]=3 13 B17R3.1917 C1=C(CCO1)c2ccc3ccccc3c2 AIFCHEM-6373795709 [0,0,0,0,1,0|3,0,0]=4 14 B17R3.1917 c1cc2cc(ccc2cn1)c3ncn[nH]3 AIFCHEM-94535587548 [0,0,0,0,1,0|2,0,1]=4 15 B17R3.1917 c1ccc2cc(ccc2c1)c3ccon3 AIFCHEM-6444813830 [0,0,0,0,1,0|2,0,1]=4 16 B17R3.1917 c1ccc2cc(ccc2c1)c3ncns3 AIFCHEM-6350071252 [0,0,0,0,1,0|2,0,1]=4 17 B17R3.123564 C(=C1CCC1)c2cc3ccccc3cn2 AIFCHEM-6430302387 [0,0,0,0,1,0|2,0,1]=4 18 B17R3.123564 c1ccc2cc(ccc2c1)CN3CCC3 AIFCHEM-5996385166 [0,0,0,0,1,0|2,0,0]=3 19 B19R3.19215 C(=C1CCOCC1)c2ccc3ccccc3c2 AIFCHEM-6355606662 [0,0,0,0,0,1|2,0,1]=4 20 B19R3.62425 c1cc2cc(ccc2cn1)CNc3ncc[nH]3 AIFCHEM-94580261371 [0,0,0,0,0,1|1,0,2]=4 21 B19R3.62425 c1ccc2cc(ccc2c1)CNc3cscn3 AIFCHEM-94557119152 [0,0,0,0,0,1|2,0,1]=4 22 B19R3.62425 c1ccc2cc(ccc2c1)CNc3ncco3 AIFCHEM-6259821367 [0,0,0,0,0,1|1,0,2]=4 23 B19R3.62425 c1ccc2nc(ccc2c1)CNc3ncc[nH]3 AIFCHEM-94580263937 [0,0,0,0,0,1|1,0,2]=4 24 B19R3.62425 c1cnc2cc(ccc2c1)CNc3ncc[nH]3 AIFCHEM-94580263574 [0,0,0,0,0,1|1,0,2]=4 25 B16R2.2441 CCCNCc1cc2ccccc2cn1 AIFCHEM-94521370168 [1,0,1,0,0,0|2,0,0]=4 26 B16R2.2441 CCCNCc1ccc2cccnc2c1 AIFCHEM-94521369807 [1,0,1,0,0,0|2,0,0]=4 27 B16R2.2441 CCCNCc1ccc2cnccc2c1 AIFCHEM-5790865856 [1,0,1,0,0,0|2,0,0]=4 28 B16R2.2441 CCCNCc1cnc2ccccc2c1 AIFCHEM-94569017222 [1,0,1,0,0,0|2,0,0]=4 29 B16R2.2441 FCCNCc1ccc2ccncc2c1 AIFCHEM-5801161160 [1,0,1,0,0,0|2,0,0]=4 30 B16R2.2441 OCCNCc1ccc2ccncc2c1 AIFCHEM-6431914168 [1,0,1,0,0,0|2,0,0]=4 31 B16R2.5347 CCN(C)Cc1ccc2ccccc2c1 AIFCHEM-94563259919 [1,0,1,0,0,0|2,0,0]=4 32 B18R2.33945 CCCNC(=O)Cc1ccc2ncccc2c1 AIFCHEM-94521379206 [0,1,1,0,0,0|2,0,0]=4 33 B18R3.3824 Cn1cnnc1c2ccc3ccccc3c2 AIFCHEM-6421367495 [0,1,0,0,1,0|1,0,1]=4 34 B18R3.4383 Cc1c(ccc2c1cccc2)c3ncn[nH]3 AIFCHEM-94574257355 [0,1,0,0,1,0|1,0,1]=4 35 B18R3.4383 Oc1c(ccc2c1cccc2)C3=CCCC3 AIFCHEM-6317958610 [0,1,0,0,1,0|2,0,0]=4 36 B18R3.6367 Oc1cc2ccccc2cc1c3ncc[nH]3 AIFCHEM-6407480935 [0,1,0,0,1,0|0,0,2]=4 37 B18R3.89733 Oc1cccc2c1cc(cc2)c3ncc[nH]3 AIFCHEM-6449758482 [0,1,0,0,1,0|0,0,2]=4 38 B18R3.6185 Oc1cc2ccccc2cc1CN3CCC3 AIFCHEM-6079123649 [0,1,0,0,1,0|2,0,0]=4 39 B18R3.32120 Oc1ccc2ccc(cc2c1)C=C3CCC3 AIFCHEM-6457222454 [0,1,0,0,1,0|1,0,1]=4 40 B18R3.100898 Nc1cc(cc2c1cccc2)C=C3CCC3 AIFCHEM-5797676024 [0,1,0,0,1,0|1,0,1]=4 41 B18R3.422385 Brc1c(ccc2c1cccc2)CN3CCC3 AIFCHEM-5996133632 [0,1,0,0,1,0|2,0,0]=4 42 B18R3.422385 Oc1c(ccc2c1cccc2)CN3CCC3 AIFCHEM-5997210326 [0,1,0,0,1,0|2,0,0]=4 43 B18R3.834563 Nc1cccc2c1cc(cc2)C=C3CCC3 AIFCHEM-6038626301 [0,1,0,0,1,0|1,0,1]=4 44 B20R3.12812 Oc1cc2ccccc2cc1CNc3ncc[nH]3 AIFCHEM-5662842799 [0,1,0,0,0,1|0,0,2]=4 45 B20R3.12812 Oc1cc2ccccc2cc1CNc3nnn[nH]3 AIFCHEM-94589704956 [0,1,0,0,0,1|2,0,0]=4 46 B20R3.93114 Brc1ccc2cc(ccc2c1)CNc3nnn[nH]3 AIFCHEM-94589702166 [0,1,0,0,0,1|2,0,0]=4 47 B20R3.2857533 Oc1c(ccc2c1cccc2)CNc3ncc[nH]3 AIFCHEM-94580264082 [0,1,0,0,0,1|0,0,2]=4 48 B20R3.105088 c1ccc2cc(ccc2c1)CNCc3ncn[nH]3 AIFCHEM-6170263046 [0,0,0,0,0,2|1,0,1]=4