0 B19R2.4360 Cc1cccc(NCCNc2cccc(C)c2)c1 Amb6358243 [0,0,0,0,0,0|3,0,0]=3 1 B19R2.4360 Cc1cccc(OCCOc2cccc(C)c2)c1 Amb4010888 [0,0,0,0,0,0|3,0,0]=3 2 B19R2.4360 Clc1cccc(NCCNc2cccc(Cl)c2)c1 Amb20080224 [0,0,0,0,0,0|3,1,0]=4 3 B18R2.6483 Fc1cccc(CCNCc2ccccn2)c1 Amb2231717 [1,0,0,0,0,0|3,0,0]=4 4 B18R2.6483 Fc1cccc(OCOCc2ccccc2)c1 Amb27593731 [1,0,0,0,0,0|3,0,0]=4 5 B18R2.6483 Nc1cccc(OCCCc2ccccc2)c1 Amb2094488 [1,0,0,0,0,0|3,0,0]=4 6 B18R2.6483 Nc1cccc(OCCCc2ccccc2)c1 Amb6251493 [1,0,0,0,0,0|3,0,0]=4 7 B18R2.6483 Nc1cccc(OCCOc2ccccc2)c1 Amb2081954 [1,0,0,0,0,0|3,0,0]=4 8 B18R2.6483 Nc1cccc(OCCSc2ccccc2)c1 Amb8868233 [1,0,0,0,0,0|3,0,0]=4 9 B18R2.6483 Nc1cccc(OCCSc2ncccn2)c1 Amb9027480 [1,0,0,0,0,0|3,0,0]=4 10 B18R2.6483 Nc1ccnc(NCCCc2ccccc2)c1 Amb32419269 [1,0,0,0,0,0|2,0,0]=3 11 B20R2.3429 Cc1cccc(OCCOc2cccc(C#N)c2)c1 Amb5770953 [0,1,0,0,0,0|3,0,0]=4 12 B20R2.4657 Cc1cccc(NC(=O)CNc2cccc(F)c2)c1 Amb6711915 [0,1,0,0,0,0|2,0,1]=4 13 B20R2.4657 Cc1cccc(NC(=O)COc2cccc(N)c2)c1 Amb6250039 [0,1,0,0,0,0|2,0,1]=4 14 B20R2.4657 Cc1cccc(NCC(=O)Nc2cccc(F)c2)c1 Amb6706730 [0,1,0,0,0,0|2,0,1]=4 15 B20R2.4657 Nc1cccc(NC(=O)COc2cccc(F)c2)c1 Amb1137445 [0,1,0,0,0,0|2,0,1]=4 16 B20R2.71918 Cc1cccc(OCCNc2ccc(Cl)c(Cl)c2)c1 Amb17292915 [0,1,0,0,0,0|3,0,0]=4 17 B20R3.2785872 Cc1ccc2c(c1)NCCN2c3cccc(Br)c3 Amb31164207 [0,0,0,1,0,0|2,1,0]=4 18 B20R3.2785872 Cc1ccc2c(c1)NCCN2c3cccc(F)c3 Amb31186506 [0,0,0,1,0,0|2,0,0]=3 19 B20R3.2785872 Cc1cccc(N2CCNc3cc(C)ccc32)c1 Amb31120370 [0,0,0,1,0,0|3,0,0]=4 20 B18R2.3895 Cc1cnc(CCCOc2cccc(N)c2)s1 Amb17479521 [0,0,0,0,1,0|3,0,0]=4 21 B18R2.6482 Cc1cc(CCOc2cccc(N)c2)ncn1 Amb18868326 [0,0,0,0,1,0|2,0,0]=3 22 B18R2.6482 Cc1cccc(CCCc2cccc(N)c2)c1 Amb13953223 [0,0,0,0,1,0|3,0,0]=4 23 B18R2.6482 Cc1cccc(CCOc2cccc(N)c2)c1 Amb17247783 [0,0,0,0,1,0|2,0,0]=3 24 B18R2.6482 Cc1ccnc(CCOc2cccc(N)c2)n1 Amb18868325 [0,0,0,0,1,0|2,0,0]=3 25 B18R2.6482 Nc1cccc(CCCc2cccc(F)c2)c1 Amb13953221 [0,0,0,0,1,0|3,0,0]=4 26 B18R2.6482 Nc1cccc(OCCc2cc(O)ncn2)c1 Amb18869037 [0,0,0,0,1,0|3,0,0]=4 27 B18R2.6482 Nc1cccc(OCCc2cccc(Cl)c2)c1 Amb17259637 [0,0,0,0,1,0|3,0,0]=4 28 B18R2.6482 Nc1cccc(OCCc2nccc(O)n2)c1 Amb18869035 [0,0,0,0,1,0|3,0,0]=4 29 B18R2.65831 Cn1ccnc1SCCOc2cccc(N)c2 Amb9027365 [0,0,0,0,1,0|3,0,0]=4 30 B20R2.4655 Cc1cccc(NCCCOc2cccc(C)c2)c1 Amb17306555 [0,0,0,0,0,1|2,0,0]=3 31 B20R2.4655 Cc1cccc(OCCCNc2cccc(Cl)c2)c1 Amb17307135 [0,0,0,0,0,1|3,0,0]=4 32 B20R2.4655 Cc1cccc(OCCCNc2cccc(F)c2)c1 Amb17306236 [0,0,0,0,0,1|3,0,0]=4 33 B17R2.2382 C(=C\c1ccccc1)/CNc2ccccn2 Amb17100159 [2,0,0,0,0,0|1,0,1]=4 34 B17R2.2382 c1ccc(CCCNc2ccccc2)cc1 Amb4313446 [2,0,0,0,0,0|2,0,0]=4 35 B17R2.2382 c1ccc(NCCNc2ccccc2)cc1 Amb2720079 [2,0,0,0,0,0|2,0,0]=4 36 B17R2.2382 c1ccc(OCCNc2ccccn2)cc1 Amb17100119 [2,0,0,0,0,0|0,0,0]=2 37 B17R2.2382 c1ccc(OCCNc2ccncc2)cc1 Amb24186955 [2,0,0,0,0,0|2,0,0]=4 38 B17R2.2382 c1ccc(OCCOc2ccccc2)cc1 Amb6356501 [2,0,0,0,0,0|2,0,0]=4 39 B19R2.906 CCc1cccc(OCCNc2ccccn2)c1 Amb17100322 [1,1,0,0,0,0|1,0,0]=3 40 B19R2.906 COc1cccc(NCCCc2ccccc2)c1 Amb4313467 [1,1,0,0,0,0|2,0,0]=4 41 B19R2.906 COc1cccc(NCCOc2ccccc2)c1 Amb4313495 [1,1,0,0,0,0|1,0,0]=3 42 B19R2.906 OCc1cccc(OCCOc2ccccc2)c1 Amb17257094 [1,1,0,0,0,0|2,0,0]=4 43 B19R2.4400 Cc1cccc(NCCCc2ccccc2)c1C Amb6617276 [1,1,0,0,0,0|2,0,0]=4 44 B19R2.4400 Cc1cccc(OCCNc2ccccn2)c1C Amb17100318 [1,1,0,0,0,0|1,0,0]=3 45 B19R2.4400 Clc1cccc(OCCNc2ccccn2)c1Cl Amb17100098 [1,1,0,0,0,0|0,1,0]=3 46 B19R2.11839 Cc1cc(OCCNc2ccccn2)ccc1Br Amb17100182 [1,1,0,0,0,0|1,0,0]=3 47 B19R2.11839 Cc1cc(OCCNc2ccccn2)ccc1Cl Amb17100172 [1,1,0,0,0,0|1,0,0]=3 48 B19R2.11839 Clc1ccc(NCCOc2ccccc2)cc1Cl Amb4313487 [1,1,0,0,0,0|2,0,0]=4 49 B19R2.11839 Clc1ccc(OCCNc2ccccn2)cc1Cl Amb17100100 [1,1,0,0,0,0|0,1,0]=3 50 B19R2.11854 Cc1cccc(NCCOc2ccc(Cl)cc2)c1 Amb17306548 [1,1,0,0,0,0|1,0,0]=3 51 B19R2.11854 Clc1ccc(OCCNc2cccc(Cl)c2)cc1 Amb17307128 [1,1,0,0,0,0|2,0,0]=4 52 B19R2.11854 Fc1cccc(NCCOc2ccc(Cl)cc2)c1 Amb17306229 [1,1,0,0,0,0|2,0,0]=4 53 B19R2.7671 Cc1cccc(C(O)CNc2cccc(F)c2)c1 Amb17159756 [0,1,0,0,1,0|2,0,0]=4 54 B19R2.7671 Cc1cccc(NCC(O)c2cccc(C)c2)c1 Amb17159143 [0,1,0,0,1,0|2,0,0]=4 55 B19R2.7671 Cc1cccc(NCC(O)c2cccc(Cl)c2)c1 Amb17163955 [0,1,0,0,1,0|1,1,0]=4 56 B19R2.7671 Cc1cccc(NCC(O)c2cccc(N)c2)c1 Amb18872481 [0,1,0,0,1,0|2,0,0]=4 57 B19R2.101612 Cc1ccc(C)c(CCOc2cccc(N)c2)c1 Amb17255707 [0,1,0,0,1,0|2,0,0]=4 58 B19R2.483874 Cc1cc(C)nc(CCOc2cccc(N)c2)n1 Amb18872789 [0,1,0,0,1,0|2,0,0]=4 59 B19R2.483874 Cc1cc(CCOc2cccc(N)c2)nc(C)n1 Amb18872790 [0,1,0,0,1,0|2,0,0]=4 60 B19R2.483874 Cc1cc(CCOc2cccc(N)c2)nc(O)n1 Amb18873705 [0,1,0,0,1,0|2,0,0]=4 61 B19R2.483874 Cc1cc(Cl)nc(CCOc2cccc(Cl)c2)n1 Amb17487067 [0,1,0,0,1,0|1,1,0]=4 62 B19R2.483874 Cc1cccc(OCCc2nc(C)cc(Cl)n2)c1 Amb17487049 [0,1,0,0,1,0|2,0,0]=4 63 B21R2.3548 COc1cccc(NCCCOc2cccc(C)c2)c1 Amb17306260 [0,1,0,0,0,1|2,0,0]=4 64 B21R2.103624 Cc1cccc(OCCCNc2cc(C)ccc2C)c1 Amb17306047 [0,1,0,0,0,1|2,0,0]=4 65 B21R2.103629 Cc1cccc(OCCCNc2ccc(C)c(C)c2)c1 Amb17306094 [0,1,0,0,0,1|2,0,0]=4 66 B21R2.103633 Cc1cccc(OCCCNc2cccc(C)c2C)c1 Amb17306019 [0,1,0,0,0,1|2,0,0]=4 67 B21R2.12134376 Cc1cc(C)cc(NCCCOc2cccc(C)c2)c1 Amb17306775 [0,1,0,0,0,1|2,0,0]=4 68 B21R2.35546 COc1ccc(CCCNc2cc(C)ccn2)cc1N Amb17464337 [0,2,0,0,0,0|2,0,0]=4 69 B19R2.101610 CC1=CC(=O)N(CCOc2cccc(N)c2)C=C1 Amb18041708 [0,0,1,1,0,0|2,0,0]=4 70 B19R3.102 Cc1ccc2c(c1)NCCN2c3ccccc3 Amb31163441 [1,0,0,1,0,0|2,0,0]=4 71 B19R3.9760 Nc1ccnc(N2CCCc3ccccc32)c1 Amb17343379 [1,0,0,1,0,0|2,0,0]=4 72 B17R2.5301 Brc1cccc(NCCc2ccccc2)c1 Amb6696593 [1,0,0,0,1,0|2,0,0]=4 73 B17R2.5301 Brc1cccc(OCCc2ccccc2)c1 Amb6628830 [1,0,0,0,1,0|1,1,0]=4 74 B17R2.5301 Cc1cccc(NCCc2ccccc2)c1 Amb6684422 [1,0,0,0,1,0|1,0,0]=3 75 B17R2.5301 Clc1cccc(NCCc2ccccc2)c1 Amb6649485 [1,0,0,0,1,0|2,0,0]=4 76 B17R2.5301 Fc1cccc(CNCc2ccccn2)c1 Amb6699027 [1,0,0,0,1,0|2,0,0]=4 77 B17R2.5301 Fc1cccc(NCCc2ccccc2)c1 Amb6695783 [1,0,0,0,1,0|2,0,0]=4 78 B17R2.5301 Nc1cccc(OCCc2ccccc2)c1 Amb1119309 [1,0,0,0,1,0|2,0,0]=4 79 B17R2.5301 Nc1cccc(OCCc2ccccc2)c1 Amb2111108 [1,0,0,0,1,0|2,0,0]=4 80 B17R2.5301 Nc1cccc(OCCc2ccccn2)c1 Amb1995305 [1,0,0,0,1,0|1,0,0]=3 81 B17R2.5301 Nc1cccc(OCCc2ccccn2)c1 Amb8009862 [1,0,0,0,1,0|1,0,0]=3 82 B17R2.5301 Nc1cccc(OCCc2ncccn2)c1 Amb18225413 [1,0,0,0,1,0|2,0,0]=4 83 B17R2.5301 Nc1ccnc(NCCc2ccccc2)c1 Amb17340020 [1,0,0,0,1,0|1,0,0]=3 84 B17R2.5301 Nc1ccnc(NCCc2ccncc2)c1 Amb32419286 [1,0,0,0,1,0|2,0,0]=4 85 B17R2.5301 Oc1cccc(OCCc2ccccc2)c1 Amb8837429 [1,0,0,0,1,0|2,0,0]=4 86 B17R2.5296 Cc1cnc(CCOc2cccc(N)c2)o1 Amb18226162 [0,0,0,0,2,0|2,0,0]=4 87 B17R2.5296 Cc1cnc(CCOc2cccc(N)c2)s1 Amb17479518 [0,0,0,0,2,0|2,0,0]=4 88 B17R2.5296 Nc1cc(CCOc2cccc(F)c2)no1 Amb17245339 [0,0,0,0,2,0|2,0,0]=4 89 B17R2.3373 Cn1ccnc1CCOc2cccc(N)c2 Amb18866862 [0,0,0,0,2,0|2,0,0]=4 90 B17R2.5300 Cc1cc(CCc2cccc(Br)c2)ncn1 Amb18888041 [0,0,0,0,2,0|1,1,0]=4 91 B17R2.5300 Cc1cc(CCc2cccc(N)c2)ncn1 Amb18225188 [0,0,0,0,2,0|2,0,0]=4 92 B17R2.5300 Cc1cc(COc2cccc(N)c2)ncn1 Amb18225410 [0,0,0,0,2,0|2,0,0]=4 93 B17R2.5300 Cc1cccc(CNc2cc(N)ccn2)c1 Amb18981505 [0,0,0,0,2,0|2,0,0]=4 94 B17R2.5300 Cc1cccc(CNc2cccc(C)c2)c1 Amb6684411 [0,0,0,0,2,0|2,0,0]=4 95 B17R2.5300 Cc1cccc(CNc2cccc(F)c2)c1 Amb6695772 [0,0,0,0,2,0|2,0,0]=4 96 B17R2.5300 Cc1cccc(COc2cccc(N)c2)c1 Amb1112224 [0,0,0,0,2,0|2,0,0]=4 97 B17R2.5300 Cc1cccc(COc2cccc(O)c2)c1 Amb8837425 [0,0,0,0,2,0|2,0,0]=4 98 B17R2.5300 Cc1cccc(NCc2cccc(Br)c2)c1 Amb6684401 [0,0,0,0,2,0|1,1,0]=4 99 B17R2.5300 Cc1cccc(NCc2cccc(Cl)c2)c1 Amb4303632 [0,0,0,0,2,0|1,1,0]=4 100 B17R2.5300 Cc1cccc(NCc2cccc(F)c2)c1 Amb6684408 [0,0,0,0,2,0|1,0,0]=3 101 B17R2.5300 Cc1cccc(NCc2cccc(O)c2)c1 Amb3549188 [0,0,0,0,2,0|2,0,0]=4 102 B17R2.5300 Cc1ccnc(CCc2cccc(Br)c2)n1 Amb18888040 [0,0,0,0,2,0|1,1,0]=4 103 B17R2.5300 Cc1ccnc(CCc2cccc(N)c2)n1 Amb18866467 [0,0,0,0,2,0|2,0,0]=4 104 B17R2.5300 Cc1ccnc(COc2cccc(N)c2)n1 Amb18225409 [0,0,0,0,2,0|2,0,0]=4 105 B17R2.5300 Fc1cccc(CNc2cccc(F)c2)c1 Amb6695765 [0,0,0,0,2,0|2,0,0]=4 106 B17R2.5300 Fc1cccc(COc2cc(Cl)ccn2)c1 Amb22236308 [0,0,0,0,2,0|2,0,0]=4 107 B17R2.5300 Fc1cccc(CSc2cc(Cl)ccn2)c1 Amb22236309 [0,0,0,0,2,0|2,0,0]=4 108 B17R2.5300 Nc1cccc(COc2cccc(F)c2)c1 Amb6245061 [0,0,0,0,2,0|2,0,0]=4 109 B17R2.5300 Nc1cccc(COc2cccc(F)c2)c1 Amb7969467 [0,0,0,0,2,0|2,0,0]=4 110 B17R2.5300 Nc1ccnc(CCc2cccc(F)c2)n1 Amb18570088 [0,0,0,0,2,0|2,0,0]=4 111 B17R2.5300 Nc1ccnc(COc2cccc(F)c2)n1 Amb18067494 [0,0,0,0,2,0|2,0,0]=4 112 B17R2.5300 Nc1ccnc(NCc2cccc(Cl)c2)c1 Amb18299324 [0,0,0,0,2,0|1,1,0]=4 113 B17R2.5300 Nc1ccnc(NCc2cccc(F)c2)c1 Amb18981470 [0,0,0,0,2,0|1,0,0]=3 114 B19R2.4361 Cc1cccc(CNCCOc2ccccn2)c1 Amb19920096 [1,0,0,0,0,1|2,0,0]=4 115 B19R2.4361 Cc1cccc(CNCCOc2ccccn2)c1 Amb29844489 [1,0,0,0,0,1|2,0,0]=4 116 B19R2.4361 Cc1cccc(NCCCOc2ccccc2)c1 Amb17306552 [1,0,0,0,0,1|1,0,0]=3 117 B19R2.4361 Cc1cccc(OCCCNc2ccccc2)c1 Amb17307116 [1,0,0,0,0,1|2,0,0]=4 118 B19R2.4361 Clc1cccc(NCCCOc2ccccc2)c1 Amb17307132 [1,0,0,0,0,1|2,0,0]=4 119 B19R2.4361 Fc1cccc(NCCCOc2ccccc2)c1 Amb17306233 [1,0,0,0,0,1|2,0,0]=4 120 B19R2.4361 Nc1cccc(OCCCNc2ccccn2)c1 Amb17100209 [1,0,0,0,0,1|1,0,0]=3 121 B21R2.4735 Cc1cccc(NCCCCOc2cccc(C)c2)c1 Amb17306559 [0,0,0,0,0,2|2,0,0]=4