0 B21R3.7337 O=C1N=C(Nc2ccccc2)N=C(N3CCCC3)N1 Amb22802792 [0,0,0,0,0,0|0,0,2]=2 1 B22R3.5292376 Cc1cc(N2CCC(N)C2)nc(Nc3ccccc3)n1 Amb22011408 [0,1,0,0,0,0|2,0,0]=3 2 B22R3.15317671 Cc1cc(N2CCCC2)nc(Nc3ccc(N)cc3)n1 Amb23585822 [0,1,0,0,0,0|2,0,0]=3 3 B22R3.15317671 Cc1nc(Nc2ccc(N)cc2)cc(N3CCCC3)n1 Amb22643083 [0,1,0,0,0,0|2,0,0]=3 4 B22R3.15317671 Nc1nc(Sc2ccc(F)cc2)cc(N3CCCC3)n1 Amb2435102 [0,1,0,0,0,0|3,0,0]=4 5 B20R3.5134 Cc1nc(-c2ccccc2)nc(C3CCCN3)n1 Amb18872171 [0,0,0,0,1,0|3,0,0]=4 6 B20R3.5134 Clc1cc(-c2ccccc2)nc(N3CCCC3)n1 Amb32424904 [0,0,0,0,1,0|2,0,0]=3 7 B20R3.5134 Clc1cc(-c2cccnc2)nc(N3CCCC3)n1 Amb32440302 [0,0,0,0,1,0|3,0,0]=4 8 B20R3.5134 Clc1cc(-c2ccncc2)nc(N3CCCC3)n1 Amb32440321 [0,0,0,0,1,0|3,0,0]=4 9 B20R3.5134 Nc1nc(-c2ccccc2)cc(N3CCCC3)n1 Amb10608637 [0,0,0,0,1,0|2,0,0]=3 10 B20R3.5134 O=C1C=C(c2ccccc2)N=C(N3CCCC3)N1 Amb18474542 [0,0,0,0,1,0|1,0,2]=4 11 B20R3.5134 Oc1cc(-c2cccnc2)nc(N3CCCC3)n1 Amb32440324 [0,0,0,0,1,0|2,0,0]=3 12 B20R3.5134 Oc1cc(-c2ccncc2)nc(N3CCCC3)n1 Amb20407742 [0,0,0,0,1,0|2,0,0]=3 13 B22R3.255 Cc1cc(N2CCNCC2)nc(Nc3ccccc3)n1 Amb22011399 [0,0,0,0,0,1|2,0,0]=3 14 B22R3.255 Cc1cc(Oc2ccccc2)nc(N3CCNCC3)n1 Amb21984282 [0,0,0,0,0,1|3,0,0]=4 15 B22R3.255 Cc1cc(Sc2ccccc2)nc(N3CCNCC3)n1 Amb21984283 [0,0,0,0,0,1|3,0,0]=4 16 B22R3.255 Cc1nc(Oc2ccccc2)cc(N3CCNCC3)n1 Amb22643064 [0,0,0,0,0,1|3,0,0]=4 17 B22R3.255 Clc1cc(Nc2ccccc2)nc(N3CCCCC3)n1 Amb24053486 [0,0,0,0,0,1|2,0,0]=3 18 B22R3.255 Clc1nc(Nc2ccccc2)nc(N3CCOCC3)n1 Amb6395939 [0,0,0,0,0,1|1,0,0]=2 19 B22R3.255 Oc1nc(Nc2ccccc2)nc(N3CCOCC3)n1 Amb6338760 [0,0,0,0,0,1|0,0,0]=1 20 B21R3.206 NC1CCN(c2cc(Nc3ccccc3)ncn2)C1 Amb32440404 [1,1,0,0,0,0|1,0,0]=3 21 B21R3.206 NC1CCN(c2nccc(Nc3ccccc3)n2)C1 Amb32440378 [1,1,0,0,0,0|1,0,0]=3 22 B21R3.3662 N#Cc1cc(-c2ccccc2)nc(N3CCCC3)n1 Amb17160854 [0,1,0,0,1,0|2,0,0]=4 23 B21R3.3662 NNc1cc(-c2ccccc2)nc(N3CCCC3)n1 Amb32424803 [0,1,0,0,1,0|2,0,0]=4 24 B21R3.141066 Cc1cc(-c2ccccc2)nc(N3CCC(N)C3)n1 Amb17515492 [0,1,0,0,1,0|2,0,0]=4 25 B21R3.141066 Cc1cc(N2CCC(N)C2)nc(-c3ccccc3)n1 Amb22011282 [0,1,0,0,1,0|2,0,0]=4 26 B21R3.141066 Cc1nc(-c2ccccc2)cc(N3CCC(N)C3)n1 Amb17515529 [0,1,0,0,1,0|2,0,0]=4 27 B21R3.141066 Cc1nc(-c2ccccc2)cc(N3CCC(O)C3)n1 Amb20409611 [0,1,0,0,1,0|2,0,0]=4 28 B21R3.141066 NC1CCN(c2nc(O)cc(-c3cccnc3)n2)C1 Amb32442793 [0,1,0,0,1,0|2,0,0]=4 29 B21R3.141066 NC1CCN(c2nc(O)cc(-c3ccncc3)n2)C1 Amb32442792 [0,1,0,0,1,0|2,0,0]=4 30 B21R3.3754251 Cc1ccc(-c2cc(O)nc(N3CCCC3)n2)cc1 Amb32440334 [0,1,0,0,1,0|1,0,0]=3 31 B21R3.3819684 Cc1cccc(-c2cc(O)nc(N3CCCC3)n2)c1 Amb32440335 [0,1,0,0,1,0|1,0,0]=3 32 B23R3.77 CCc1cc(N2CCNCC2)nc(Nc3ccccc3)n1 Amb22011430 [0,1,0,0,0,1|2,0,0]=4 33 B23R3.77 N\N=C1\N=C(Nc2ccccc2)N=C(N3CCCCC3)N1 Amb20027889 [0,1,0,0,0,1|1,0,1]=4 34 B23R3.656971 Cc1nc(Nc2ccccc2)nc(N3CCNCC3)c1C Amb22011133 [0,1,0,0,0,1|2,0,0]=4 35 B23R3.1329658 Clc1nc(Nc2ccc(Br)cc2)nc(N3CCOCC3)n1 Amb17741023 [0,1,0,0,0,1|1,0,0]=3 36 B23R3.7703605 Cc1cc(N2CCC(=O)CC2)nc(Nc3ccccc3)n1 Amb22011403 [0,1,0,0,0,1|2,0,0]=4 37 B23R3.7703605 Cc1cc(N2CCC(N)CC2)nc(Nc3ccccc3)n1 Amb22011401 [0,1,0,0,0,1|2,0,0]=4 38 B23R3.6109 CCc1cc(N2CCC(N)C2)nc(Nc3ccccc3)n1 Amb22011340 [0,2,0,0,0,0|2,0,0]=4 39 B23R3.49765 O=C(O)c1cc(N2CCCC2)nc(Cc3ccccc3)n1 Amb17488687 [0,2,0,0,0,0|2,0,0]=4 40 B23R3.7656474 Cc1nc(Nc2ccccc2)nc(N3CCC(N)C3)c1C Amb22011423 [0,2,0,0,0,0|2,0,0]=4 41 B23R3.4777900 COc1cccc(Nc2nc(Cl)nc(N3CCCC3)n2)c1 Amb23459723 [0,2,0,0,0,0|1,0,0]=3 42 B19R2.352 CCCCNc1nc(N)nc(-c2ccccc2)n1 Amb9901799 [0,0,1,0,1,0|1,0,0]=3 43 B19R2.352 CCCCNc1nc(O)cc(-c2ccccc2)n1 Amb21988166 [0,0,1,0,1,0|1,0,0]=3 44 B19R2.352 COCCNc1nc(O)cc(-c2ccccc2)n1 Amb21988177 [0,0,1,0,1,0|2,0,0]=4 45 B21R2.3181 CCCCNc1nc(O)cc(CSc2ccccc2)n1 Amb21988168 [0,0,1,0,0,1|2,0,0]=4 46 B21R3.3114 c1ccc(Nc2cc(N3CCNCC3)ncn2)cc1 Amb13881445 [1,0,0,0,0,1|1,0,0]=3 47 B21R3.3114 c1ccc(Nc2ccnc(N3CCNCC3)n2)cc1 Amb32440364 [1,0,0,0,0,1|1,0,0]=3 48 B21R3.3114 c1ccc(Oc2ccnc(N3CCNCC3)n2)cc1 Amb21984185 [1,0,0,0,0,1|2,0,0]=4 49 B21R3.3114 c1ccc(Sc2ccnc(N3CCNCC3)n2)cc1 Amb21984187 [1,0,0,0,0,1|2,0,0]=4 50 B21R3.3121 c1ccc(CNc2cc(N3CCCC3)ccn2)cc1 Amb26864977 [1,0,0,0,0,1|2,0,0]=4 51 B21R3.203 Cc1cc(-c2ccccc2)nc(N3CCNCC3)n1 Amb18560998 [0,0,0,0,1,1|2,0,0]=4 52 B21R3.203 Cc1cc(N2CCNCC2)nc(-c3ccccc3)n1 Amb841284 [0,0,0,0,1,1|2,0,0]=4 53 B21R3.203 Cc1nc(-c2ccccc2)cc(N3CCNCC3)n1 Amb5724360 [0,0,0,0,1,1|2,0,0]=4 54 B21R3.203 Cc1nc(-c2ccccc2)nc(C3CCCNC3)n1 Amb18878226 [0,0,0,0,1,1|2,0,0]=4 55 B21R3.203 Cc1nc(-c2ccccc2)nc(C3CCNCC3)n1 Amb18878227 [0,0,0,0,1,1|2,0,0]=4 56 B21R3.203 Clc1cc(N2CCCCC2)nc(-c3ccccc3)n1 Amb6751825 [0,0,0,0,1,1|2,0,0]=4 57 B21R3.203 Clc1cc(N2CCOCC2)nc(-c3ccccc3)n1 Amb2432000 [0,0,0,0,1,1|2,0,0]=4 58 B21R3.203 Clc1nc(-c2ccccc2)cc(N3CCOCC3)n1 Amb31308357 [0,0,0,0,1,1|2,0,0]=4 59 B21R3.203 Oc1cc(-c2cccnc2)nc(N3CCCCC3)n1 Amb32440282 [0,0,0,0,1,1|2,0,0]=4 60 B21R3.203 Oc1cc(-c2cccnc2)nc(N3CCNCC3)n1 Amb32442783 [0,0,0,0,1,1|2,0,0]=4 61 B21R3.203 Oc1cc(-c2ccncc2)nc(N3CCCCC3)n1 Amb32440283 [0,0,0,0,1,1|2,0,0]=4 62 B21R3.203 Oc1cc(-c2ccncc2)nc(N3CCNCC3)n1 Amb32442785 [0,0,0,0,1,1|2,0,0]=4 63 B21R3.7342 Oc1cc(-c2ccccc2)nc(NC3CCCC3)n1 Amb21988188 [0,0,0,0,1,1|2,0,0]=4 64 B23R3.14769 Brc1cc(N2CCOCC2)nc(NCc3ccccc3)n1 Amb28344103 [0,0,0,0,0,2|2,0,0]=4 65 B23R3.14769 Clc1nc(NCc2ccccc2)nc(N3CCOCC3)n1 Amb6394972 [0,0,0,0,0,2|1,0,0]=3 66 B23R3.14769 Nc1nc(NCc2ccccc2)nc(N3CCCCC3)n1 Amb6398161 [0,0,0,0,0,2|1,0,0]=3 67 B23R3.109489 Cc1cc(N2CCCNCC2)nc(Nc3ccccc3)n1 Amb22011402 [0,0,0,0,0,2|2,0,0]=4