0 B15R2.17700 C#CCNC1CCc2nc(sc2C1)Br bf1673b9345936ae3517238297b041c4 [0,0,0,0,0,0|1,0,2]=3 1 B15R2.17700 C#CCOC1CCc2nc(sc2C1)Cl 0c87e058edb85b55335b0e1f8aa69248 [0,0,0,0,0,0|2,0,2]=4 2 B15R2.17700 C=CCNC1CCc2nc(sc2C1)Br cac70fc96a088bb55367c88c8cb03700 [0,0,0,0,0,0|1,0,2]=3 3 B15R2.17700 C=CCOC1CCc2nc(sc2C1)Cl b0e2c6d80a54aed6fab10f34413032c0 [0,0,0,0,0,0|2,0,2]=4 4 B15R2.17700 CCCCN1CCc2nc(sc2C1)C e72f316ceccbead87a86343f80865be5 [0,0,0,0,0,0|3,0,0]=3 5 B15R2.17700 CCCCN1CCc2nc(sc2C1)Cl 13a700c5e82db1645f6b52712c7d10f2 [0,0,0,0,0,0|3,0,0]=3 6 B15R2.17700 CCCNC1CCc2nc(nn2C1)C e962372dd2cfaeb705308f0cd89a0d7a [0,0,0,0,0,0|3,0,0]=3 7 B15R2.17700 CCCNC1CCc2nc(sc2C1)Br 5abe7b568ea60e39c3625e53964bea1a [0,0,0,0,0,0|1,0,0]=1 8 B15R2.17700 CCCNC1CCc2nn(cc2C1)C af9484eb97af367473f8539d981796ce [0,0,0,0,0,0|3,0,0]=3 9 B15R2.17700 CCCNc1cc2sc(nc2cn1)N a6fb1acbb82a94b1839776dfcc3161f2 [0,0,0,0,0,0|1,0,3]=4 10 B15R2.17700 CCCNc1ccc2nc(sc2c1)N ba343ff46bebf4c597da242ea94ba69a [0,0,0,0,0,0|0,0,4]=4 11 B15R2.17700 CCCNc1ccc2nc(sc2n1)N 96d269bf35a1e7a9ceb41e23e6bc41d1 [0,0,0,0,0,0|1,0,3]=4 12 B15R2.17700 CCCNc1cnc2nc(sc2c1)N bd9676315c9721029b46cc62cf0a2d4c [0,0,0,0,0,0|1,0,3]=4 13 B15R2.17700 CCCOC1CCc2nc(sc2C1)Cl 94d0828971605f971025ae13386f6354 [0,0,0,0,0,0|2,0,0]=2 14 B15R2.17700 CCOCN1CCc2nc(sc2C1)C 3bb0a76d2b9bcabb8fd6ebce8f49ad35 [0,0,0,0,0,0|4,0,0]=4 15 B15R2.17700 COCCN1CCc2nc(sc2C1)C 0c57adf79fb32f23f37ce4f8a68ef8f2 [0,0,0,0,0,0|4,0,0]=4 16 B15R2.17700 COCCN1CCc2nc(sc2C1)Cl 7a1102cf529745e1cafdedb8abf67cf7 [0,0,0,0,0,0|4,0,0]=4 17 B15R2.17700 COCNC1CCc2nc(nn2C1)C 5843dd39df4c04525212ccc977ef68d0 [0,0,0,0,0,0|4,0,0]=4 18 B15R2.17700 COCNC1CCc2nc(sc2C1)Br fb71b07d8096ebe5cdff4f0dafbc9022 [0,0,0,0,0,0|2,0,0]=2 19 B15R2.17700 COCNC1CCc2nn(cc2C1)C bd2e8f5d772e326b28205b82af7ef177 [0,0,0,0,0,0|4,0,0]=4 20 B15R2.17700 COCOC1CCc2nc(sc2C1)Cl 1615b37a8df2509cf75ddc85abe335ff [0,0,0,0,0,0|3,0,0]=3 21 B15R2.17700 CSCCN1CCc2nc(sc2C1)C bcbf4e56f9c9aef3da11db05f7f10fcb [0,0,0,0,0,0|4,0,0]=4 22 B15R2.17700 CSCCN1CCc2nc(sc2C1)Cl 2fd8494fb8a11e5b69a250db4dc32e96 [0,0,0,0,0,0|4,0,0]=4 23 B15R2.17700 CSCNC1CCc2nc(nn2C1)C a62e1420068f886c9183fb8eb2b34d7c [0,0,0,0,0,0|4,0,0]=4 24 B15R2.17700 CSCNC1CCc2nc(sc2C1)Br a9b00dc271c1bd3f8ce3f8b769a9a427 [0,0,0,0,0,0|2,0,0]=2 25 B15R2.17700 CSCNC1CCc2nn(cc2C1)C 25c57b234c8057da08cd08d5320b862c [0,0,0,0,0,0|4,0,0]=4 26 B15R2.17700 CSCOC1CCc2nc(sc2C1)Cl 62cd11a77f101d9079728c06fdbbd24e [0,0,0,0,0,0|3,0,0]=3 27 B15R2.17700 Cc1nc2c(s1)CN(CC2)CCCF fc06f5ae0a5091984d43f959fbbc8902 [0,0,0,0,0,0|4,0,0]=4 28 B15R2.17700 Cc1nc2c(s1)CN(CC2)CCCO 3b5c95203ead60c4ac5cf329bed50d87 [0,0,0,0,0,0|4,0,0]=4 29 B15R2.17700 Cc1nc2c(s1)CN(CC2)CCCS 9ab89e2b20a340cd508c8ecadbf4c90e [0,0,0,0,0,0|4,0,0]=4 30 B15R2.17700 Cc1nc2n(n1)CC(CC2)NCCF 9f03634ae8fa9368fbd439f823b0b650 [0,0,0,0,0,0|4,0,0]=4 31 B15R2.17700 Cc1nc2n(n1)CC(CC2)NCCO 166c2257741645ebc0f171c061288ab7 [0,0,0,0,0,0|4,0,0]=4 32 B15R2.17700 Cc1nc2n(n1)CC(CC2)NCCS 5581f42b8bb305bb5f9378d991596fd9 [0,0,0,0,0,0|4,0,0]=4 33 B15R2.17700 Cn1cc2c(n1)CCC(C2)NCCF fca75aa28614794f52a84e02868c58a0 [0,0,0,0,0,0|4,0,0]=4 34 B15R2.17700 Cn1cc2c(n1)CCC(C2)NCCO 046799362179af86d2b98f2c9f2f7719 [0,0,0,0,0,0|4,0,0]=4 35 B15R2.17700 Cn1cc2c(n1)CCC(C2)NCCS ee3dd9d339a8da598d2d734b8428a225 [0,0,0,0,0,0|4,0,0]=4 36 B15R2.17700 FCCCN1CCc2nc(sc2C1)Cl b94bad523b9f316a2eb3771b37ee3f96 [0,0,0,0,0,0|4,0,0]=4 37 B15R2.17700 FCCNC1CCc2nc(sc2C1)Br 7fa6c0f5c33fb9a24a919a9752ce78ff [0,0,0,0,0,0|2,0,0]=2 38 B15R2.17700 FCCOC1CCc2nc(sc2C1)Cl 9b6473b7c02bdcc6ab18b71378365dab [0,0,0,0,0,0|3,0,0]=3 39 B15R2.17700 N#CCNC1CCc2nc(sc2C1)Br 35f55fd4cd1c1f792cca8498325d67b3 [0,0,0,0,0,0|2,0,1]=3 40 B15R2.17700 N#CCOC1CCc2nc(sc2C1)Cl 3c6656adea2efdf370d1d534ccdb4eb5 [0,0,0,0,0,0|3,0,1]=4 41 B15R2.17700 O=CCNC1CCc2nc(sc2C1)Br d1d81df7bae9d6eaf77cfeb27b112088 [0,0,0,0,0,0|2,0,1]=3 42 B15R2.17700 O=CCOC1CCc2nc(sc2C1)Cl f91d6318f7631cc02d366660b09f26bb [0,0,0,0,0,0|3,0,1]=4 43 B15R2.17700 OCCCN1CCc2nc(sc2C1)Cl 0596e42a9d595be060740b6e0ebb51d4 [0,0,0,0,0,0|4,0,0]=4 44 B15R2.17700 OCCNC1CCc2nc(sc2C1)Br 5c6ad1a169da7f1d3a00c840283e0924 [0,0,0,0,0,0|2,0,0]=2 45 B15R2.17700 SCCCN1CCc2nc(sc2C1)Cl 229e93e78d73babe4e544a7039bbc421 [0,0,0,0,0,0|4,0,0]=4 46 B15R2.17700 SCCNC1CCc2nc(sc2C1)Br b920fe9d568194ca385a31795aaa5d44 [0,0,0,0,0,0|2,0,0]=2 47 B15R2.17700 SCCOC1CCc2nc(sc2C1)Cl eaa17bc9fa7911687d561aabe8e7638b [0,0,0,0,0,0|3,0,0]=3 48 B14R2.991 CCCCN1CCc2ncsc2C1 c7e3e49811de97836fd37a7c952387f7 [1,0,0,0,0,0|2,0,0]=3 49 B14R2.991 CCCNC1CCc2[nH]ncc2C1 4cb6826c72b7ecc6486dbc189e0eb805 [1,0,0,0,0,0|2,0,1]=4 50 B14R2.991 CCCNC1CCc2ccnn2C1 163640343a983bbf5af43bb73dd97630 [1,0,0,0,0,0|3,0,0]=4 51 B14R2.991 CCCNC1CCc2cn[nH]c2C1 f2c2a4caea1280c28a7b93e2e29edceb [1,0,0,0,0,0|3,0,0]=4 52 B14R2.991 CCCNC1CCc2nccn2C1 370d186635780c8093b448e3b4846dd7 [1,0,0,0,0,0|2,0,0]=3 53 B14R2.991 CCCNC1CCc2ncnn2C1 17da40d7e4e3e2d32e8ab52f8669700a [1,0,0,0,0,0|2,0,0]=3 54 B14R2.991 CCCNC1CCn2nccc2C1 e56073148740d7e45d42157679fb8e08 [1,0,0,0,0,0|2,0,0]=3 55 B14R2.991 CCCOC1CCc2nccn2C1 c70a73e80fb8dcbb192c89efe7a9429f [1,0,0,0,0,0|3,0,0]=4 56 B14R2.991 CCCOC1CCc2ncnn2C1 2219f0a4ea638976c2d3a2ebb3506fdc [1,0,0,0,0,0|3,0,0]=4 57 B14R2.991 CCCOC1CCn2nccc2C1 d9c3c6b252a285732bc3786e6ad28c6d [1,0,0,0,0,0|3,0,0]=4 58 B14R2.991 CCOCN1CCc2ncsc2C1 76f6f5a875bdec547a1f52763415b19b [1,0,0,0,0,0|3,0,0]=4 59 B14R2.991 COCCN1CCc2ncsc2C1 44cb37aeae2bdc361c21b9b85cc45df5 [1,0,0,0,0,0|3,0,0]=4 60 B14R2.991 COCNC1CCc2nccn2C1 190365c23b8fae8f004cd980d6942e54 [1,0,0,0,0,0|3,0,0]=4 61 B14R2.991 COCNC1CCc2ncnn2C1 8d44ebed42a230545efc20c31fc1078d [1,0,0,0,0,0|3,0,0]=4 62 B14R2.991 COCNC1CCn2nccc2C1 dfddf7ffa309e212d475fcc87c73ca23 [1,0,0,0,0,0|3,0,0]=4 63 B14R2.991 CSCCN1CCc2ncsc2C1 85b974e088dfd18ffe4d961918da7abc [1,0,0,0,0,0|3,0,0]=4 64 B14R2.991 CSCNC1CCc2nccn2C1 d7c78685d8fcf5f1d39f98d8400f8b9d [1,0,0,0,0,0|3,0,0]=4 65 B14R2.991 CSCNC1CCc2ncnn2C1 1559d8c371287823418b7b10bfc46e1d [1,0,0,0,0,0|3,0,0]=4 66 B14R2.991 CSCNC1CCn2nccc2C1 31dc45255f9ad361930a4e549d578cb8 [1,0,0,0,0,0|3,0,0]=4 67 B14R2.991 FCCCN1CCc2ncsc2C1 34dfb9ae7768656832c2e15c19481d9a [1,0,0,0,0,0|3,0,0]=4 68 B14R2.991 FCCNC1CCc2nccn2C1 761c96989a9018dda4ded47d5ba8f0d4 [1,0,0,0,0,0|3,0,0]=4 69 B14R2.991 FCCNC1CCc2ncnn2C1 013e4710d80e86e551c44efac1ac4d17 [1,0,0,0,0,0|3,0,0]=4 70 B14R2.991 FCCNC1CCn2nccc2C1 33f5ea84cd9f2526db78ee53c75e4ec2 [1,0,0,0,0,0|3,0,0]=4 71 B14R2.991 OCCCN1CCc2ncsc2C1 6de16d723ff0ec2684d253dbaae8ea88 [1,0,0,0,0,0|3,0,0]=4 72 B14R2.991 OCCNC1CCc2nccn2C1 433d670daffa7420e538ae54afcc83c5 [1,0,0,0,0,0|3,0,0]=4 73 B14R2.991 OCCNC1CCc2ncnn2C1 3f41f131939e52e9f4ee577e3f03365f [1,0,0,0,0,0|3,0,0]=4 74 B14R2.991 OCCNC1CCn2nccc2C1 8ee5ac0304392b7952761cc4cba18e82 [1,0,0,0,0,0|3,0,0]=4 75 B14R2.991 SCCCN1CCc2ncsc2C1 d0a1a39047bbf60ebe9968457a86cc6e [1,0,0,0,0,0|3,0,0]=4 76 B14R2.991 SCCNC1CCc2nccn2C1 efd815ea3a3b50fe35a69f8de81dc4bb [1,0,0,0,0,0|3,0,0]=4 77 B14R2.991 SCCNC1CCc2ncnn2C1 8e583e1fcbc05d07157c055d36dc489e [1,0,0,0,0,0|3,0,0]=4 78 B14R2.991 SCCNC1CCn2nccc2C1 873e2ce0c3d372554cdc97cc17d723d1 [1,0,0,0,0,0|3,0,0]=4 79 B14R2.6400 CCCN1CCc2nc(sc2C1)C 80700801f0dc6cdd409da681c556e224 [1,0,0,0,0,0|2,0,0]=3 80 B14R2.6400 CCCN1CCc2nc(sc2C1)Cl 2d35b326fe1a3edb4b4aeb5db9ad5590 [1,0,0,0,0,0|2,0,0]=3 81 B14R2.6400 CCNC1CCc2nc(nn2C1)C 396123472e5451487f8c5ddef7eeb9ca [1,0,0,0,0,0|3,0,0]=4 82 B14R2.6400 CCNC1CCc2nc(sc2C1)Br 15aa0081dfbfd93fdbb38ae062e91513 [1,0,0,0,0,0|1,0,0]=2 83 B14R2.6400 CCNC1CCc2nn(cc2C1)C 5fb4318ec606b775094a785ca399c0bb [1,0,0,0,0,0|3,0,0]=4 84 B14R2.6400 CCOC1CCc2nc(sc2C1)Cl 51e06f9d94537b61961d643ad6ccb7bd [1,0,0,0,0,0|2,0,0]=3 85 B14R2.6400 COCN1CCc2nc(sc2C1)C efed890b5d61c4fdf0cf420cdbacce83 [1,0,0,0,0,0|3,0,0]=4 86 B14R2.6400 COCN1CCc2nc(sc2C1)Cl 2f0f4f5af9f84dd9a1ca99270cd247b8 [1,0,0,0,0,0|3,0,0]=4 87 B14R2.6400 CSCN1CCc2nc(sc2C1)C 9805c64c485b0e376aaf360a11332629 [1,0,0,0,0,0|3,0,0]=4 88 B14R2.6400 CSCN1CCc2nc(sc2C1)Cl 2685d187b9ae05c9d0539627826b86d2 [1,0,0,0,0,0|3,0,0]=4 89 B14R2.6400 Cc1nc2c(s1)CN(CC2)CCF f0a513e9c150603637690f60767d5d3c [1,0,0,0,0,0|3,0,0]=4 90 B14R2.6400 Cc1nc2c(s1)CN(CC2)CCO a5a3467203f86a5b0cfdf43b12ab2cd1 [1,0,0,0,0,0|3,0,0]=4 91 B14R2.6400 Cc1nc2c(s1)CN(CC2)CCS e5d0ae97e295210cc43edcb0b06c5946 [1,0,0,0,0,0|3,0,0]=4 92 B14R2.6400 FCCN1CCc2nc(sc2C1)Cl f634126203f4dbf78473235df3346181 [1,0,0,0,0,0|3,0,0]=4 93 B14R2.6400 FCNC1CCc2nc(sc2C1)Br e6fc5ffc5cae8c6cc0bdd54c3ff9df5a [1,0,0,0,0,0|2,0,0]=3 94 B14R2.6400 FCOC1CCc2nc(sc2C1)Cl 4a1f97792b0eb0971d2d78e99875473d [1,0,0,0,0,0|3,0,0]=4 95 B14R2.6400 O=CNC1CCc2nc(sc2C1)Br aabf7d4b260c211899d856b4aa8340bc [1,0,0,0,0,0|2,0,1]=4 96 B14R2.6400 OCCN1CCc2nc(sc2C1)Cl cc0d749a0371392646aa246ce9e8e92f [1,0,0,0,0,0|3,0,0]=4 97 B14R2.6400 OCNC1CCc2nc(sc2C1)Br dd0dd1db612149f17b2e85f05d5a551d [1,0,0,0,0,0|2,0,0]=3 98 B14R2.6400 SCCN1CCc2nc(sc2C1)Cl d520e164e5d0e83532a2e7fcb1f64b87 [1,0,0,0,0,0|3,0,0]=4 99 B16R2.3892 C=C(Br)CNC1CCc2nc(sc2C1)Br a3c6e00e8677a1c375a10045cbcd8e68 [0,1,0,0,0,0|1,0,2]=4 100 B16R2.3892 C=C(C)CNC1CCc2nc(sc2C1)Br 524d60b8f50599b1daaf2b5e85249577 [0,1,0,0,0,0|1,0,1]=3 101 B16R2.3892 C=C(C)COC1CCc2nc(sc2C1)Cl 9985ca3ecfa98bf079f1182840d39c98 [0,1,0,0,0,0|2,0,1]=4 102 B16R2.3892 C=C(Cl)CNC1CCc2nc(sc2C1)Br 7c039ea25fc8371092c8044b0ab5f535 [0,1,0,0,0,0|1,0,2]=4 103 B16R2.3892 C=C(F)CNC1CCc2nc(sc2C1)Br c50edffdd5ab3053b39552b59115caee [0,1,0,0,0,0|1,0,2]=4 104 B16R2.3892 CC(C)CCN1CCc2nc(sc2C1)Cl 55faba44cf48601657122094cc3c8b3c [0,1,0,0,0,0|3,0,0]=4 105 B16R2.3892 CC(C)CNC1CCc2nc(sc2C1)Br d0bb4b684df44a3407cb3a62c8bded7a [0,1,0,0,0,0|1,0,0]=2 106 B16R2.3892 CC(C)CNC1CCc2nn(cc2C1)C 6beabe3b63f1a07d4ce1aad241c9d836 [0,1,0,0,0,0|3,0,0]=4 107 B16R2.3892 CC(C)COC1CCc2nc(sc2C1)Cl a6ce8036576a086ab313755e748ccd06 [0,1,0,0,0,0|2,0,0]=3 108 B16R2.3892 CC(O)CCN1CCc2nc(sc2C1)Cl 525567b7152d84b6195aa4d7c903ec21 [0,1,0,0,0,0|3,0,0]=4 109 B16R2.3892 CC(O)CNC1CCc2nc(sc2C1)Br 3fe7d5c315ba078ee1d86d46a9cbae73 [0,1,0,0,0,0|1,0,0]=2 110 B16R2.3892 CC(O)CNC1CCc2nn(cc2C1)C 37e33fc6e65f49bd25f4fec7b1987a52 [0,1,0,0,0,0|3,0,0]=4 111 B16R2.3892 CN(C)COC1CCc2nc(sc2C1)Cl 20b84fbded6da36abd9003e3373aadbc [0,1,0,0,0,0|3,0,0]=4 112 B16R2.3892 C[C@@H](O)CNC1CCc2nc(sc2C1)Br 48744d2183c07929d5efc829f7aabb04 [0,1,0,0,0,0|1,0,0]=2 113 B16R2.3892 C[C@@H](O)CNC1CCc2nn(cc2C1)C e7e41deca54584d87e64d0e734fa9249 [0,1,0,0,0,0|3,0,0]=4 114 B16R2.3892 C[C@H](O)CNC1CCc2nc(sc2C1)Br ed94b4e0b8b03984431ecc71d508bbaf [0,1,0,0,0,0|1,0,0]=2 115 B16R2.3892 C[C@H](O)CNC1CCc2nn(cc2C1)C 8f6dab18c710204b9a1ce8815353af4c [0,1,0,0,0,0|3,0,0]=4 116 B16R2.3892 Cc1nc2c(s1)CN(CC2)CCC(C)C 903767644e19eea0f14279f721fc9de4 [0,1,0,0,0,0|3,0,0]=4 117 B16R2.3892 Cc1nc2c(s1)CN(CC2)CCC(C)O 81419f5f132729f6ee8dc59d55a66193 [0,1,0,0,0,0|3,0,0]=4 118 B16R2.3892 Cc1nc2n(n1)CC(CC2)NCC(C)C 31f2f7d0377f19c5fc1051c8cfd41f8f [0,1,0,0,0,0|3,0,0]=4 119 B16R2.3892 Cc1nc2n(n1)CC(CC2)NCC(C)O a868d3aa3e3f31645bc2ae8a70184ed6 [0,1,0,0,0,0|3,0,0]=4 120 B16R2.3892 Cc1nc2n(n1)CC(CC2)NC[C@H](C)O dd9fe18524adc3c7ad2cf075a4085f2b [0,1,0,0,0,0|3,0,0]=4 121 B16R2.3892 FC(F)CNC1CCc2nc(sc2C1)Br 99ee5aa16cdc2b55a31d927ede5fbc7f [0,1,0,0,0,0|2,0,0]=3 122 B16R2.3892 FC(F)COC1CCc2nc(sc2C1)Cl 670ab125476e69e6d75e9c5438e73a0f [0,1,0,0,0,0|3,0,0]=4 123 B16R2.3892 NC(=O)CNC1CCc2nc(sc2C1)Br a801c1af98a71266e4deb8fe795d0ba4 [0,1,0,0,0,0|2,0,1]=4 124 B16R2.3892 O=C(O)CNC1CCc2nc(sc2C1)Br 7554e05943a08092f31dcf97937e7b85 [0,1,0,0,0,0|2,0,1]=4 125 B16R2.3892 O=[N+]([O-])CNC1CCc2nc(sc2C1)Br c0f6f04caab9f1c76d68953834a938fd [0,1,0,0,0,0|3,0,0]=4 126 B16R2.4322 C#CCCNC1CCc2nc(sc2C1)Br 756e514941e23622b1b4dc9830483dcd [0,1,0,0,0,0|1,0,1]=3 127 B16R2.4322 C#CCCOC1CCc2nc(sc2C1)Cl a567b14bdbf526d18698ae77487f7b45 [0,1,0,0,0,0|2,0,1]=4 128 B16R2.4322 C/C=C/CNC1CCc2nc(sc2C1)Br 89c2d95cdccb61ff74e98ecbb2670fd2 [0,1,0,0,0,0|1,0,1]=3 129 B16R2.4322 C/C=C/COC1CCc2nc(sc2C1)Cl 4539c7f59ea7d7ca076339c7f21712b8 [0,1,0,0,0,0|2,0,1]=4 130 B16R2.4322 C/C=C\CNC1CCc2nc(sc2C1)Br 38d76a6ab4f629d0f9109048254dd9f0 [0,1,0,0,0,0|1,0,1]=3 131 B16R2.4322 C/C=C\COC1CCc2nc(sc2C1)Cl 67276a50db64cdcffb4bafb57b71050a [0,1,0,0,0,0|2,0,1]=4 132 B16R2.4322 C=CCCNC1CCc2nc(sc2C1)Br 5801536382112608a828836c401ca489 [0,1,0,0,0,0|1,0,1]=3 133 B16R2.4322 C=CCCOC1CCc2nc(sc2C1)Cl a893f3493d4ffe4c26701cd15c512d87 [0,1,0,0,0,0|2,0,1]=4 134 B16R2.4322 CCCCCN1CCc2nc(sc2C1)C 6ea9022a55f899b73dd4b424675a7107 [0,1,0,0,0,0|3,0,0]=4 135 B16R2.4322 CCCCCN1CCc2nc(sc2C1)Cl beb1f2ef6274d50196134a7c185cf00b [0,1,0,0,0,0|3,0,0]=4 136 B16R2.4322 CCCCNC1CCc2nc(nn2C1)C b84798984e17b2ced27cee60969bd25c [0,1,0,0,0,0|3,0,0]=4 137 B16R2.4322 CCCCNC1CCc2nc(sc2C1)Br 199103b04bb169145beea2f8db0023bd [0,1,0,0,0,0|1,0,0]=2 138 B16R2.4322 CCCCNC1CCc2nn(cc2C1)C 97791f49af3aa33f53819eb5054c6696 [0,1,0,0,0,0|3,0,0]=4 139 B16R2.4322 CCCCOC1CCc2nc(sc2C1)Cl 7cb344e1360ece26568421ed920a4bba [0,1,0,0,0,0|2,0,0]=3 140 B16R2.4322 CCOCCN1CCc2nc(sc2C1)C e3947141680dbaea1abb0cbcf5bcb304 [0,1,0,0,0,0|3,0,0]=4 141 B16R2.4322 CCOCCN1CCc2nc(sc2C1)Cl 8c9d211d69164dacc01fe71d104c2609 [0,1,0,0,0,0|3,0,0]=4 142 B16R2.4322 CCOCNC1CCc2nc(sc2C1)Br ebd77c25089e8c0f7c5b3971376bf180 [0,1,0,0,0,0|1,0,0]=2 143 B16R2.4322 CCOCNC1CCc2nn(cc2C1)C 09519d58286d2e826815d64e5a627606 [0,1,0,0,0,0|3,0,0]=4 144 B16R2.4322 CCSCCN1CCc2nc(sc2C1)C 894a4018ddd70267c85278a18b04a34c [0,1,0,0,0,0|3,0,0]=4 145 B16R2.4322 CCSCCN1CCc2nc(sc2C1)Cl 218e6690742b144da83f2f6029efe71a [0,1,0,0,0,0|3,0,0]=4 146 B16R2.4322 COCCCN1CCc2nc(sc2C1)C e03568389344092126de899d72abea42 [0,1,0,0,0,0|3,0,0]=4 147 B16R2.4322 COCCCN1CCc2nc(sc2C1)Cl 642c5a7d8aaded731a27880830a2d0df [0,1,0,0,0,0|3,0,0]=4 148 B16R2.4322 COCCNC1CCc2nc(nn2C1)C 7723cf1f239e16d6f5a5fa08ab043abe [0,1,0,0,0,0|3,0,0]=4 149 B16R2.4322 COCCNC1CCc2nc(sc2C1)Br 70d614f019e816f52ee83b3ab424ab61 [0,1,0,0,0,0|1,0,0]=2 150 B16R2.4322 COCCNC1CCc2nn(cc2C1)C d55929a3068f1fe9e5568f219b65c10f [0,1,0,0,0,0|3,0,0]=4 151 B16R2.4322 COCCOC1CCc2nc(sc2C1)Cl 785fd151bf930b9f69dd54e4dcd5c6d7 [0,1,0,0,0,0|2,0,0]=3 152 B16R2.4322 CSCCCN1CCc2nc(sc2C1)C 783fc2576542e0812a1f7945908e5ec8 [0,1,0,0,0,0|3,0,0]=4 153 B16R2.4322 CSCCCN1CCc2nc(sc2C1)Cl 84426b4909920650a45ee100991af442 [0,1,0,0,0,0|3,0,0]=4 154 B16R2.4322 CSCCNC1CCc2nc(nn2C1)C c9476740a6b1d22fbc66d3bd2eff2dab [0,1,0,0,0,0|3,0,0]=4 155 B16R2.4322 CSCCNC1CCc2nc(sc2C1)Br 633790a869e63f01f1bafe1f801731b5 [0,1,0,0,0,0|1,0,0]=2 156 B16R2.4322 CSCCNC1CCc2nn(cc2C1)C a2c3b17720e207591acc889a1e228542 [0,1,0,0,0,0|3,0,0]=4 157 B16R2.4322 CSCCOC1CCc2nc(sc2C1)Cl e8793d3e4b53eb10d8e57ae29ed75dec [0,1,0,0,0,0|2,0,0]=3 158 B16R2.4322 Cc1nc2c(s1)CN(CC2)CCCCF 22a368f138d5328b984dc7ebad1c1856 [0,1,0,0,0,0|3,0,0]=4 159 B16R2.4322 Cc1nc2c(s1)CN(CC2)CCCCO 54eecdaad83ea299a4b84ab6f4ff21a8 [0,1,0,0,0,0|3,0,0]=4 160 B16R2.4322 Cc1nc2n(n1)CC(CC2)NCCCF 8afc470aa2f612fc0dc704006f2494c1 [0,1,0,0,0,0|3,0,0]=4 161 B16R2.4322 Cc1nc2n(n1)CC(CC2)NCCCO f66dffbc4fd5afa595e84beb799f68e4 [0,1,0,0,0,0|3,0,0]=4 162 B16R2.4322 Cc1nc2n(n1)CC(CC2)NCCCS 23e084b8533c08b55da39151cfa27d53 [0,1,0,0,0,0|3,0,0]=4 163 B16R2.4322 Cl/C=C/CNC1CCc2nc(sc2C1)Br 7a561e820704fa40a760312ac10903bc [0,1,0,0,0,0|1,0,2]=4 164 B16R2.4322 Cl/C=C\CNC1CCc2nc(sc2C1)Br 6a5ae22228c8536db335b6b61e97fff0 [0,1,0,0,0,0|1,0,2]=4 165 B16R2.4322 Cn1cc2c(n1)CCC(C2)NCCCF 7ea16ad1e9892d3a094cc03741174b56 [0,1,0,0,0,0|3,0,0]=4 166 B16R2.4322 Cn1cc2c(n1)CCC(C2)NCCCO 09fe9ff668dfd40e6845216bf8abfa90 [0,1,0,0,0,0|3,0,0]=4 167 B16R2.4322 Cn1cc2c(n1)CCC(C2)NCCCS 96bdd306f57ae1a6e9f61e0a031b29af [0,1,0,0,0,0|3,0,0]=4 168 B16R2.4322 FCCCCN1CCc2nc(sc2C1)Cl 25810518230e18d508c27d35d9c97354 [0,1,0,0,0,0|3,0,0]=4 169 B16R2.4322 FCCCNC1CCc2nc(sc2C1)Br 57169425b2ff6e85bcade05e65b291aa [0,1,0,0,0,0|1,0,0]=2 170 B16R2.4322 FCCCOC1CCc2nc(sc2C1)Cl 1061a920f61dd1e7526a6eedbb9bee87 [0,1,0,0,0,0|2,0,0]=3 171 B16R2.4322 N#CCCNC1CCc2nc(sc2C1)Br 712b1d4688739d333ac363a81fd4c8cf [0,1,0,0,0,0|1,0,1]=3 172 B16R2.4322 N#CCCOC1CCc2nc(sc2C1)Cl d9f8477bc1838b292b1d4e48bacf373c [0,1,0,0,0,0|2,0,1]=4 173 B16R2.4322 O/C=C\CNC1CCc2nc(sc2C1)Br 75f4a55551d5ddefb8584158f1f40805 [0,1,0,0,0,0|1,0,2]=4 174 B16R2.4322 O=CCCNC1CCc2nc(sc2C1)Br 3efb0b901f8b4684bc5b7b57644b46cc [0,1,0,0,0,0|1,0,1]=3 175 B16R2.4322 O=CCCOC1CCc2nc(sc2C1)Cl 0939d3777d7501ec199e28e9ec0591ce [0,1,0,0,0,0|2,0,1]=4 176 B16R2.4322 OCCCCN1CCc2nc(sc2C1)Cl 7a631e79bfaa2dfb3d40ab05900d880d [0,1,0,0,0,0|3,0,0]=4 177 B16R2.4322 OCCCNC1CCc2nc(sc2C1)Br bccf21f0abea07b8cd2292358cd9e051 [0,1,0,0,0,0|1,0,0]=2 178 B16R2.4322 SCCCNC1CCc2nc(sc2C1)Br 9415c56c5e9f619f0b7b71edf676b523 [0,1,0,0,0,0|1,0,0]=2 179 B16R2.4322 SCCCOC1CCc2nc(sc2C1)Cl 2e8b9c3cbb67dbdc8251c9b69c744b94 [0,1,0,0,0,0|2,0,0]=3 180 B16R2.29707 CCCC(=O)N1CCc2nc(sc2C1)C 40b5fd2ce66638f12f5327ee9ddbb2b2 [0,1,0,0,0,0|3,0,0]=4 181 B16R2.29707 CCCC(=O)N1CCc2nc(sc2C1)Cl 5e631174a8e1901c1e960386bd9b75de [0,1,0,0,0,0|3,0,0]=4 182 B16R2.29707 CCCC(C)N1CCc2nc(sc2C1)C 81bb4b1f5ebabbe28a874ddfa9c39cfd [0,1,0,0,0,0|3,0,0]=4 183 B16R2.29707 CCCC(C)N1CCc2nc(sc2C1)Cl 7a6354abb74a3c213b0297221ef989c8 [0,1,0,0,0,0|3,0,0]=4 184 B16R2.176344 C#CC(C)NC1CCc2nc(sc2C1)Br 36457714fdaef6faaad472ce6e661ead [0,1,0,0,0,0|1,0,2]=4 185 B16R2.176344 C=CC(C)NC1CCc2nc(sc2C1)Br f1ed3b7b1ea943da1a44e13ab35fce1d [0,1,0,0,0,0|1,0,2]=4 186 B16R2.176344 CC(C=O)NC1CCc2nc(sc2C1)Br a20490326a06410b5e066369e78e0037 [0,1,0,0,0,0|2,0,1]=4 187 B16R2.176344 CC(CO)NC1CCc2nc(sc2C1)Br 5e411dbf01ad85658633bff9b8c5ad66 [0,1,0,0,0,0|2,0,0]=3 188 B16R2.176344 CCC(=O)NC1CCc2nc(sc2C1)Br 5523600d660c6664844d28cd5143e41e [0,1,0,0,0,0|1,0,1]=3 189 B16R2.176344 CCC(C)CN1CCc2nc(sc2C1)C 5d1cd8b2f54d02a51504ff85685cff4d [0,1,0,0,0,0|3,0,0]=4 190 B16R2.176344 CCC(C)CN1CCc2nc(sc2C1)Cl f91c882d0d679d43b864bb8a615581cb [0,1,0,0,0,0|3,0,0]=4 191 B16R2.176344 CCC(C)NC1CCc2nc(nn2C1)C 6ced34bfca5f76f3d88a90dbab6b8ca0 [0,1,0,0,0,0|3,0,0]=4 192 B16R2.176344 CCC(C)NC1CCc2nc(sc2C1)Br bd5b3e91a0caec3ddde6778e8523b135 [0,1,0,0,0,0|1,0,0]=2 193 B16R2.176344 CCC(C)NC1CCc2nn(cc2C1)C 7268161c3e38001ed02086ffc93c3e2c [0,1,0,0,0,0|3,0,0]=4 194 B16R2.176344 CCC(C)OC1CCc2nc(sc2C1)Cl e54eb63f99760092dc2fd170ad3c397e [0,1,0,0,0,0|2,0,0]=3 195 B16R2.176344 CCC(O)CN1CCc2nc(sc2C1)C 74be12dd9a2e654fb5efbf2a646a5472 [0,1,0,0,0,0|3,0,0]=4 196 B16R2.176344 CCC(O)CN1CCc2nc(sc2C1)Cl 239b5d98aac40e45cfcde75c03431f63 [0,1,0,0,0,0|3,0,0]=4 197 B16R2.176344 CC[C@@H](C)CN1CCc2nc(sc2C1)C b4f553d514e0c20fbb485472b2c25043 [0,1,0,0,0,0|3,0,0]=4 198 B16R2.176344 CC[C@@H](C)CN1CCc2nc(sc2C1)Cl 7186b95193dde9fe12d55089205fabac [0,1,0,0,0,0|3,0,0]=4 199 B16R2.176344 CC[C@H](C)CN1CCc2nc(sc2C1)C 93672e24541e4a1e7f346cf1465f72b3 [0,1,0,0,0,0|3,0,0]=4 200 B16R2.176344 CC[C@H](C)CN1CCc2nc(sc2C1)Cl a4e682b99573385e18e86f0a20df670f [0,1,0,0,0,0|3,0,0]=4 201 B16R2.176344 C[C@@H](CO)NC1CCc2nc(sc2C1)Br 229ccc488d70500e8dab6f541e0eab30 [0,1,0,0,0,0|2,0,0]=3 202 B16R2.176344 C[C@H](C=O)NC1CCc2nc(sc2C1)Br f4ccbcc682717f16a516d5d9e5af0f1f [0,1,0,0,0,0|2,0,1]=4 203 B16R2.176344 C[C@H](CO)NC1CCc2nc(sc2C1)Br ef51dfdf03d9380e61528faa30e4af6a [0,1,0,0,0,0|2,0,0]=3 204 B16R2.176344 O=C(CF)NC1CCc2nc(sc2C1)Br b89dd9f40e51d6a94a0c89ffb7f5e515 [0,1,0,0,0,0|2,0,1]=4 205 B16R2.176344 O=C(CO)NC1CCc2nc(sc2C1)Br 9ed2c36252bbec7bed56cea69528d685 [0,1,0,0,0,0|2,0,1]=4 206 B16R2.176344 O=C(CS)NC1CCc2nc(sc2C1)Br b4dbafaeb2a09c11c465162c43759706 [0,1,0,0,0,0|2,0,1]=4 207 B14R1.155 CCCCC(C)NCc1csc(n1)Br c9bef8826a430ae3f50dbd1356d340b1 [0,0,1,0,0,0|3,0,0]=4 208 B14R1.155 CCCCC(C)NCc1csc(n1)C a21195f447be2133828ef89caf821d65 [0,0,1,0,0,0|3,0,0]=4 209 B14R1.155 CCCCC(C)OCc1csc(n1)Br d37a4a2683e4ba02c1007664610a2abc [0,0,1,0,0,0|3,0,0]=4 210 B14R1.155 CCCCC(C)OCc1csc(n1)C 672f2ca9715e5c6402a80922f9f5b096 [0,0,1,0,0,0|3,0,0]=4 211 B14R1.155 CCCCC(C)OCc1csc(n1)Cl e62a7759295865f4c39ebdc4e05e1175 [0,0,1,0,0,0|3,0,0]=4 212 B14R1.155 CCCCN(C)CCc1csc(n1)C f1cb90161c3ecaeea68a1adc6899999f [0,0,1,0,0,0|3,0,0]=4 213 B14R1.155 CCCC[C@@H](C)NCc1csc(n1)Br f4346a73e48e11faefe3a8b23a3be516 [0,0,1,0,0,0|3,0,0]=4 214 B14R1.155 CCCC[C@@H](C)OCc1csc(n1)Br 917a8552aecdf79a2b32f63c3b9342e6 [0,0,1,0,0,0|3,0,0]=4 215 B14R1.155 CCCC[C@H](C)OCc1csc(n1)Br ff787fce2689892e696f9f588f38ca0b [0,0,1,0,0,0|3,0,0]=4 216 B14R1.155 CCCNC(=O)CCc1csc(n1)C 523c173eafc3d759ab279a2c8073fe29 [0,0,1,0,0,0|2,0,1]=4 217 B14R1.155 CCCNC(=O)CNc1csc(n1)N 7138b3081a3e89b2404042c6b29064f8 [0,0,1,0,0,0|2,0,1]=4 218 B14R1.155 C[C@H](CCCO)CNc1csc(n1)N bfb0d403e17d3be62940afe3fcafb7c0 [0,0,1,0,0,0|3,0,0]=4 219 B14R1.222 CCCCNCc1sc(nc1CC)C a2f46705c3a130dafeea21e0309c2459 [0,0,1,0,0,0|3,0,0]=4 220 B14R1.222 CCCCOCc1sc(nc1CC)C 052b3b5b144c7c383b893323ab03816e [0,0,1,0,0,0|3,0,0]=4 221 B14R1.466 CCCCC(CC)Nc1cnc(s1)Br e6821607d7004d2307a5eec6ea67f114 [0,0,1,0,0,0|3,0,0]=4 222 B14R1.466 CCCCC(CC)Nc1cnc(s1)C dcc612cd7941c05aa4ce69dac3a37320 [0,0,1,0,0,0|3,0,0]=4 223 B14R1.466 CCCCC(CO)Nc1cnc(s1)N ba06cc0fbc2b0b83d98adeb13de25a98 [0,0,1,0,0,0|3,0,0]=4 224 B14R1.466 CCCCN(CC)Cc1cnc(s1)Br 00f170b6157b8bd1875242465c193a61 [0,0,1,0,0,0|3,0,0]=4 225 B14R1.466 CCCCN(CC)Cc1cnc(s1)Cl 8c83b7de809e994da6b60dff63fd99d8 [0,0,1,0,0,0|3,0,0]=4 226 B14R1.466 CCCC[C@@H](CO)Nc1cnc(s1)N 9aba6bfd11009e26e19fcd086d05efb0 [0,0,1,0,0,0|3,0,0]=4 227 B14R1.466 CCCC[C@H](CO)Nc1cnc(s1)N a2cb36ce25bd752542b10238dc111b25 [0,0,1,0,0,0|3,0,0]=4 228 B14R1.3126 CCCCCCNc1nc(sc1C)C 60f4ec81c7c0685e2a8d887b1da7bc6c [0,0,1,0,0,0|3,0,0]=4 229 B14R1.3126 CCCCCOCc1nc(sc1C)Br 218dda3de96fab75478d73f1893aa6ae [0,0,1,0,0,0|3,0,0]=4 230 B14R1.3126 CCCCCOCc1nc(sc1C)C 24a4f3fd7429da90b4587695e9b0d984 [0,0,1,0,0,0|3,0,0]=4 231 B14R1.3126 CCCCOCCc1nc(sc1C)Br 4856370c5f1bd0b236c874ecf30740a6 [0,0,1,0,0,0|3,0,0]=4 232 B14R1.3126 CCCNCCCn1nc(cc1C)C df8ebfaa364e64759fa061cb01ac2378 [0,0,1,0,0,0|3,0,0]=4 233 B14R1.3126 CCCNCCCn1nc(nc1C)C ebe26368c3086fde6d70ca6fe57a5877 [0,0,1,0,0,0|3,0,0]=4 234 B14R1.3126 CCCOCCNc1nc(sc1C)C 73fb6d5b789b0e2005cf0cf1a26c2930 [0,0,1,0,0,0|3,0,0]=4 235 B14R1.3126 CCCOCCNc1nc(sc1C)N 39b384a25c496e070710bd2561a14848 [0,0,1,0,0,0|2,0,0]=3 236 B14R1.3126 CCOCCCNc1nc(sc1C)N 5073524d4666ccf14f9617ea7402072e [0,0,1,0,0,0|3,0,0]=4 237 B14R1.3126 COCCCCNc1nc(sc1C)N 9a5533fe97a1bcb7eaf4b7740f45d169 [0,0,1,0,0,0|3,0,0]=4 238 B14R1.3126 Cc1sc(nc1NCCCCCO)N 8277b2efa1466fa0cb8d1a7d3103ddd0 [0,0,1,0,0,0|3,0,0]=4 239 B14R1.3126 Cc1sc(nc1NCCOCCO)N a0c1cfeb684764884c9a5caf847a90bb [0,0,1,0,0,0|3,0,0]=4 240 B14R1.3126 Cc1sc(nc1NCCOCCS)N 2b382e5d69a5264b6766f74644b8ea67 [0,0,1,0,0,0|3,0,0]=4 241 B14R1.3337 CCCCC(C)Nc1sc(nc1C)N f6b4939e5bb3fd85a70f8c2b28986f38 [0,0,1,0,0,0|2,0,0]=3 242 B14R1.3337 CCCCN(C)Cc1sc(nc1C)C 0081fc26176403397afbfd08a8376cdc [0,0,1,0,0,0|3,0,0]=4 243 B14R1.3337 CCCC[C@@H](C)Nc1sc(nc1C)N 57a50bf229b8d21851dfe4723cf73d7d [0,0,1,0,0,0|2,0,0]=3 244 B14R1.3337 CCCNC(=O)Cc1sc(nc1C)C 0e2a98f2a5bf76fe7133122daccc76e5 [0,0,1,0,0,0|2,0,1]=4 245 B14R1.3337 CCCNC(=O)Cc1sc(nc1C)S ef011e202e1899ef4009fd7bfb443ce6 [0,0,1,0,0,0|2,0,1]=4 246 B14R1.3337 Cc1nc(sc1NC(C)CCCO)N da4452910a929cb8e5d5d12415453029 [0,0,1,0,0,0|3,0,0]=4 247 B14R1.3337 Cc1nc(sc1N[C@H](C)CCCO)N b135bb8284e0390bbc8187c85bb1b488 [0,0,1,0,0,0|3,0,0]=4 248 B16R3.3326 Cc1nc2c(s1)CN(CC2)CC3CC3 272d8bc5bcede13b990d7719c3122797 [0,0,0,1,0,0|3,0,0]=4 249 B16R3.3326 Cc1nc2n(n1)CC(CC2)NC3CC3 b725f7b0a6a424dd73fc043b34181525 [0,0,0,1,0,0|3,0,0]=4 250 B16R3.3326 Clc1nc2c(s1)CC(CC2)OC3CC3 be635c0d3c531241f357472bded24153 [0,0,0,1,0,0|2,0,0]=3 251 B16R3.3326 Clc1nc2c(s1)CN(CC2)CC3CC3 aebcb37ab2e62afec3e611fb738e3fb6 [0,0,0,1,0,0|3,0,0]=4 252 B16R3.3326 Cn1cc2c(n1)CCC(C2)NC3CC3 d887874fab673c4d3ee7f8c67d17dba8 [0,0,0,1,0,0|3,0,0]=4 253 B14R2.10527 CCCCN1Cc2nc(sc2C1)C 01d1c02f4ecec8ee5fab4e194686abe2 [0,0,0,0,1,0|3,0,0]=4 254 B16R2.1285 CCCNC1CCc2ccc(cc2C1)Br 129c30e5c6837b394ff79d384a95108e [0,0,0,0,0,1|3,0,0]=4 255 B16R2.1285 CCCNC1CCc2ccc(cc2C1)Cl ba9fdd64e85cfe4a2caec15841c294f4 [0,0,0,0,0,1|3,0,0]=4 256 B16R2.1285 CCCNC1CCc2ccc(cc2C1)F b294586761f6c862874089f502681102 [0,0,0,0,0,1|3,0,0]=4 257 B16R2.1285 CCCNC1CCc2ncc(cc2C1)Cl 0813f73e169dbb2c0f1d9f26cec0be75 [0,0,0,0,0,1|2,0,0]=3 258 B16R2.1285 CCCN[C@H]1CCc2ccc(cc2C1)Br 0cc05834aa6dc0b480dceccbd4273c10 [0,0,0,0,0,1|3,0,0]=4 259 B16R2.1285 COCNC1CCc2ncc(cc2C1)Cl 516d7f611c282a5000284f0a8eeb2140 [0,0,0,0,0,1|3,0,0]=4 260 B16R2.1285 CSCNC1CCc2ncc(cc2C1)Cl afbffb712ecc3e3078d7658504209109 [0,0,0,0,0,1|3,0,0]=4 261 B16R2.1285 FCCNC1CCc2ncc(cc2C1)Cl d12d4209170fc50d629df65136b494ae [0,0,0,0,0,1|3,0,0]=4 262 B16R2.1285 OCCNC1CCc2ncc(cc2C1)Cl afe3f9f39be130ccb2879130e9aef005 [0,0,0,0,0,1|3,0,0]=4 263 B16R2.1285 SCCNC1CCc2ncc(cc2C1)Cl 4a013edfcf8f7c02eb3a6df3cf20c3b7 [0,0,0,0,0,1|3,0,0]=4 264 B16R2.30336 CCCNC1CCc2cc(ccc2C1)Br 4ece57c62e096cc8ef5c7b79f27d2bd9 [0,0,0,0,0,1|3,0,0]=4 265 B16R2.30336 CCCNC1CCc2cc(ccc2C1)F e13fa0cf98f6676bc7f0864553945a26 [0,0,0,0,0,1|3,0,0]=4 266 B16R2.30336 CCCNC1CCc2nc(ncc2C1)C 50cbf8480e791c3078b639b0a3cc4ef6 [0,0,0,0,0,1|2,0,0]=3 267 B16R2.30336 CCCN[C@@H]1CCc2cc(ccc2C1)F ab04a09b2d917d5b2747d89ceeb5c537 [0,0,0,0,0,1|3,0,0]=4 268 B16R2.30336 CCCN[C@H]1CCc2cc(ccc2C1)F 67a925f28ca3f28d4fc36a14357fb15d [0,0,0,0,0,1|3,0,0]=4 269 B16R2.30336 COCNC1CCc2nc(ncc2C1)C 171596dc6174f49aaad504f8b11e2502 [0,0,0,0,0,1|3,0,0]=4 270 B16R2.30336 Cc1ncc2c(n1)CCC(C2)NCCF 8e7016bcc51520adb27f0eb347e9d379 [0,0,0,0,0,1|3,0,0]=4 271 B16R2.30336 Cc1ncc2c(n1)CCC(C2)NCCO 537db3b1fc334aa8bcbe97f507600490 [0,0,0,0,0,1|3,0,0]=4 272 B16R2.30336 Cc1ncc2c(n1)CCC(C2)NCCS f262fd5b92ff96b116b136e92d28771a [0,0,0,0,0,1|3,0,0]=4 273 B13R1.27 CCCOCCNc1csc(n1)N e6fe6249bf856665eda0fe44e3a97433 [1,0,1,0,0,0|2,0,0]=4 274 B13R1.41 CC(CCO)CNc1csc(n1)N 4c189049170126bd3da7a77635403d5a [1,0,1,0,0,0|2,0,0]=4 275 B13R1.41 CCCC(C)CNc1csc(n1)Br 1ced065fb75f478c93df7731da06eb9f [1,0,1,0,0,0|2,0,0]=4 276 B13R1.41 CCCC(C)NCc1csc(n1)Br 80722c032f594dbfd3a4dfe76914ee5e [1,0,1,0,0,0|2,0,0]=4 277 B13R1.41 CCCC(C)OCc1csc(n1)Br 3a6cffeecdb1f484d591d48dad0d2476 [1,0,1,0,0,0|2,0,0]=4 278 B13R1.41 CCCC(C)OCc1csc(n1)C e08ba5db46d15f482a1912970669593c [1,0,1,0,0,0|2,0,0]=4 279 B13R1.41 CCCC(C)OCc1csc(n1)Cl 7d27d22ca98e8f594c3f5789a83dad2b [1,0,1,0,0,0|2,0,0]=4 280 B13R1.41 CCCN(C)CCc1csc(n1)C 59f4a7773fa8411a49704814398366b6 [1,0,1,0,0,0|2,0,0]=4 281 B13R1.41 CCC[C@@H](C)OCc1csc(n1)Br c80c085ca88af8f65760ceb63d922bfe [1,0,1,0,0,0|2,0,0]=4 282 B13R1.41 CCC[C@H](C)NCc1csc(n1)Br d2d695230d6bbe7794e591426bdacb71 [1,0,1,0,0,0|2,0,0]=4 283 B13R1.41 CCC[C@H](C)OCc1csc(n1)Br d90c100990470f37191524855a6258e5 [1,0,1,0,0,0|2,0,0]=4 284 B13R1.41 CCOC(C)CNc1csc(n1)N adf72b8f6132edd8ed7f8194ec0d314d [1,0,1,0,0,0|2,0,0]=4 285 B13R1.153 CCCCC(C)NCc1cscn1 bf8f58ab22b6e731db93c66f36f67c25 [1,0,1,0,0,0|2,0,0]=4 286 B13R1.153 CCCCC(C)OCc1cscn1 3839947ed4897ffc78991c4423debcb7 [1,0,1,0,0,0|2,0,0]=4 287 B13R1.153 CCCCN(C)CCc1cscn1 662ed8b5e322b0f0a00bd4b555c6e460 [1,0,1,0,0,0|2,0,0]=4 288 B13R1.153 CCCC[C@@H](C)NCc1cscn1 47141fc043bf8d269eb3af5ad9094b9b [1,0,1,0,0,0|2,0,0]=4 289 B13R1.153 CCCC[C@@H](C)OCc1cscn1 89bca82a9295e09e3dc3213da1eadc78 [1,0,1,0,0,0|2,0,0]=4 290 B13R1.153 CCCC[C@H](C)OCc1cscn1 7c6b1b77ceccd4cc0fbc0f288cd13473 [1,0,1,0,0,0|2,0,0]=4 291 B13R1.153 CCCNC(=O)CCc1cscn1 0a8f010c972926bef8f6713a5cd2d647 [1,0,1,0,0,0|1,0,1]=4 292 B13R1.153 CCCNC(C)CCc1ccco1 b2554e166689c259a0153abc4a32b1d8 [1,0,1,0,0,0|2,0,0]=4 293 B13R1.153 CCCNC(C)CCn1cccn1 e932d3c6d7fba541ed2ad5d7bea87bd5 [1,0,1,0,0,0|2,0,0]=4 294 B13R1.137 CCCNCCc1ccnn1CC 58fa3f5d9aab031b20ac8c916666539c [1,0,1,0,0,0|2,0,0]=4 295 B13R1.137 CCCNCCn1ccnc1CC a9d220a28d88cdc2de3d090a831e4be8 [1,0,1,0,0,0|2,0,0]=4 296 B13R1.190 CCCCCNc1nc(sc1C)C 44c43709a895d24c14be043ce7ae2b9b [1,0,1,0,0,0|2,0,0]=4 297 B13R1.190 CCCCCNc1sc(nc1C)N 20454ced849ae359c4b050e3c64ba137 [1,0,1,0,0,0|2,0,0]=4 298 B13R1.190 CCCCOCc1nc(sc1C)Br 858c9dcf15570a30327d1d2cd63be037 [1,0,1,0,0,0|2,0,0]=4 299 B13R1.190 CCCCOCc1nc(sc1C)C 4e8f6b4c569a5f92ef22e210592bbbb9 [1,0,1,0,0,0|2,0,0]=4 300 B13R1.190 CCCNCCc1sc(nc1C)C 57dc19a02a7d0e6fcdfb5b7f89cfc9b1 [1,0,1,0,0,0|1,0,0]=3 301 B13R1.190 CCCOCCc1nc(sc1C)Br 2bb7a8e778a209cf9005380a4991d5d2 [1,0,1,0,0,0|2,0,0]=4 302 B13R1.190 CCCOCCc1sc(nc1C)C 1cb0d81c09e893ecac6281f9ea69b6d0 [1,0,1,0,0,0|2,0,0]=4 303 B13R1.190 CCOCCNc1nc(sc1C)N b4003658a5926b4e083202cd180af066 [1,0,1,0,0,0|2,0,0]=4 304 B13R1.190 COCCCNc1nc(sc1C)N ca58d18f34e91c6a066b6991b95a6297 [1,0,1,0,0,0|2,0,0]=4 305 B13R1.190 COCNCCc1sc(nc1C)C 90ddb3ec642941911f7b78e5d7377648 [1,0,1,0,0,0|2,0,0]=4 306 B13R1.190 CSCNCCc1sc(nc1C)C 9d2805cffe797e74d1d2e1e5ec4d32b4 [1,0,1,0,0,0|2,0,0]=4 307 B13R1.190 Cc1nc(c(s1)CCNCCF)C b3261631ed9c6186d3f4b5e71c816549 [1,0,1,0,0,0|2,0,0]=4 308 B13R1.190 Cc1nc(c(s1)CCNCCO)C 43b1e3b7a0a6482939a393a8866cd495 [1,0,1,0,0,0|2,0,0]=4 309 B13R1.190 Cc1nc(c(s1)CCNCCS)C d4c64ebeaa8f1a0c1db1e449365a2b9a [1,0,1,0,0,0|2,0,0]=4 310 B13R1.190 Cc1sc(nc1NCCCCO)N 9e7d3b908683d776194aa0056f21f7ee [1,0,1,0,0,0|2,0,0]=4 311 B13R1.660 CCCNCc1sc(nc1CC)C 94f3157c3bc74630eb692211390c0d34 [1,0,1,0,0,0|1,0,0]=3 312 B13R1.660 CCCOCc1sc(nc1CC)C 0b087943a16cce66de2d9e218a6f24c2 [1,0,1,0,0,0|2,0,0]=4 313 B13R1.660 CCc1nc(sc1CNCCBr)C 50da5473112946424e38f24124fa162a [1,0,1,0,0,0|2,0,0]=4 314 B13R1.660 CCc1nc(sc1CNCCF)C 3cc64427f5404bfe9a37e655aa0b5a10 [1,0,1,0,0,0|2,0,0]=4 315 B13R1.660 CCc1nc(sc1CNCCO)C 8d138bb5ebc29a4c8819068fe8ae86eb [1,0,1,0,0,0|2,0,0]=4 316 B13R1.660 CCc1nc(sc1CNCCS)C c749fef905d072e7873d23650f59716b [1,0,1,0,0,0|2,0,0]=4 317 B13R1.660 CCc1nc(sc1CNCOC)C 784556b3b161340fe3dcd7f8d519fc58 [1,0,1,0,0,0|2,0,0]=4 318 B13R1.660 CCc1nc(sc1CNCSC)C aa69f1fa5c78475e25e39b36d12aea96 [1,0,1,0,0,0|2,0,0]=4 319 B13R1.43 CCCCC(C)Nc1cnc(s1)N 3ee048efe4d0633fd9e7cfa44e30dc3a [1,0,1,0,0,0|2,0,0]=4 320 B13R1.43 CCCC[C@@H](C)Nc1cnc(s1)N e64fb1789ef484a562e79c6aaf484813 [1,0,1,0,0,0|2,0,0]=4 321 B13R1.78 CCC(COC)Nc1cnc(s1)N 982095b05c16baef763248edca2270a7 [1,0,1,0,0,0|2,0,0]=4 322 B13R1.78 CCCC(CC)Nc1cnc(s1)Br c058d702d1e6063541a73e029f8004aa [1,0,1,0,0,0|2,0,0]=4 323 B13R1.78 CCCC(CC)Nc1cnc(s1)C 2ff5e272b72fc3fd4e7d0d36493c7249 [1,0,1,0,0,0|2,0,0]=4 324 B13R1.78 CCCC(CC)Nc1cnc(s1)S 51faa4f3b3c083c9ede8713f29c0d89f [1,0,1,0,0,0|2,0,0]=4 325 B13R1.78 CCCC(CO)Nc1cnc(s1)N d111c5177848e0660c59d1eb7140f292 [1,0,1,0,0,0|2,0,0]=4 326 B13R1.78 CCCN(CC)Cc1cnc(s1)Br 80a6763142bfcf538aecac15ed35f63c [1,0,1,0,0,0|2,0,0]=4 327 B13R1.78 CCCN(CC)Cc1cnc(s1)Cl e30cb4c1c1bd878b5ddd4a247e82d2a1 [1,0,1,0,0,0|2,0,0]=4 328 B13R1.78 CCC[C@@H](CO)Nc1cnc(s1)N 0177c843bbe4b8ddb4ea3b6908ef0a3b [1,0,1,0,0,0|2,0,0]=4 329 B13R1.78 CCC[C@H](CO)Nc1cnc(s1)N 0a3f61ffde889e3e5bfcd418a730413e [1,0,1,0,0,0|2,0,0]=4 330 B13R1.372 CCCCC(CC)Nc1cncs1 9617f2e50ed3a73d7e60c3b8ffbdf718 [1,0,1,0,0,0|2,0,0]=4 331 B13R1.654 CCCCCOCc1ncsc1C b95b2a6a7c4aa527da12e16a11f2f796 [1,0,1,0,0,0|2,0,0]=4 332 B13R1.654 CCCCOCCc1ncsc1C c6d8de8232e78601cf8bcb03e5267f9c [1,0,1,0,0,0|2,0,0]=4 333 B13R1.654 CCCNCCCc1nccn1C 61cafdc68972b944f2b80bbf17eba9f9 [1,0,1,0,0,0|2,0,0]=4 334 B13R1.654 CCCNCCCc1scnc1C 9d50001341013eb0b28dee4f47ab84e6 [1,0,1,0,0,0|2,0,0]=4 335 B13R1.654 CCCNCCCn1nccc1C 7d9ed3cda2251308cec571c4b39f602c [1,0,1,0,0,0|2,0,0]=4 336 B13R1.654 CCCOCCNc1ncsc1C da7d54596593538df6d726c34b312304 [1,0,1,0,0,0|2,0,0]=4 337 B13R1.686 CCCCC(C)Nc1scnc1C a5f6761f319853f91ca821885c25ff2f [1,0,1,0,0,0|2,0,0]=4 338 B13R1.686 CCCCN(C)Cc1scnc1C e0cb31db78a466cef24533de8f6f69fe [1,0,1,0,0,0|2,0,0]=4 339 B13R1.686 CCCNC(=O)Cc1scnc1C 03614eab8e78835f71f881df425557ca [1,0,1,0,0,0|1,0,1]=4 340 B13R1.686 CCCNC(C)Cc1ccnn1C d778d0b2aa06d044b4be1a463b053463 [1,0,1,0,0,0|2,0,0]=4 341 B13R1.690 CCCC(C)Nc1sc(nc1C)N f05ea8a93bf74c58f74b782ec7755f0a [1,0,1,0,0,0|1,0,0]=3 342 B13R1.690 CCCN(C)Cc1sc(nc1C)C 8423efed771ddee7db2040755b2037a4 [1,0,1,0,0,0|2,0,0]=4 343 B13R1.690 CCC[C@H](C)Nc1sc(nc1C)N 676c3725db8252ecda2f1c6e7d6ea12e [1,0,1,0,0,0|1,0,0]=3 344 B13R1.690 COCC(C)Nc1sc(nc1C)N 11c8b5f8a2d89bf54292be5144a72e23 [1,0,1,0,0,0|2,0,0]=4 345 B13R1.690 COC[C@@H](C)Nc1sc(nc1C)N a6bdb6c6794632f541415bd1e7cbb5f4 [1,0,1,0,0,0|2,0,0]=4 346 B13R1.690 COC[C@H](C)Nc1sc(nc1C)N 90cf84bfd85c0d26290198c792db8b2a [1,0,1,0,0,0|2,0,0]=4 347 B13R1.690 Cc1nc(sc1NC(C)CCO)N 531bf224de1cf1664a4f11ec92ee21c4 [1,0,1,0,0,0|2,0,0]=4 348 B13R1.690 Cc1nc(sc1N[C@@H](C)CCO)N 1d8e273f172eb56121363c6c739c8c4a [1,0,1,0,0,0|2,0,0]=4 349 B13R1.690 Cc1nc(sc1N[C@H](C)CCO)N ff2e4e024f0c9100028346518e578235 [1,0,1,0,0,0|2,0,0]=4 350 B13R2.449 CCCN1CCc2ncsc2C1 56d1844ef19b6d0bdd895be285a20877 [2,0,0,0,0,0|1,0,0]=3 351 B13R2.449 CCNC1CCc2nccn2C1 10a94cb610cb8b820442d7b51037e72e [2,0,0,0,0,0|2,0,0]=4 352 B13R2.449 CCNC1CCc2ncnn2C1 fedb0559136818af220f65853ecc766e [2,0,0,0,0,0|2,0,0]=4 353 B13R2.449 CCNC1CCn2nccc2C1 9dbaabc8eb5d4ca1dec7bcf9bfe838fa [2,0,0,0,0,0|2,0,0]=4 354 B13R2.449 COCN1CCc2ncsc2C1 f1f4d341895b7d52593af90d49478e78 [2,0,0,0,0,0|2,0,0]=4 355 B13R2.449 CSCN1CCc2ncsc2C1 84fd53f200b1de68313d6cc8bb831cad [2,0,0,0,0,0|2,0,0]=4 356 B13R2.449 FCCN1CCc2ncsc2C1 388974a8168e39e5278dc2d4fd9295c0 [2,0,0,0,0,0|2,0,0]=4 357 B13R2.449 OCCN1CCc2ncsc2C1 858feb700475aa3c7f4535265b93a549 [2,0,0,0,0,0|2,0,0]=4 358 B13R2.449 SCCN1CCc2ncsc2C1 fff6fcf450e051031debb3bca289349c [2,0,0,0,0,0|2,0,0]=4 359 B13R2.2121 CCN1CCc2nc(sc2C1)C f22370dee749f6f575d68f1248003c04 [2,0,0,0,0,0|2,0,0]=4 360 B13R2.2121 CCN1CCc2nc(sc2C1)Cl 6aaf1ffc9d5a26fba980d61be4db0dea [2,0,0,0,0,0|2,0,0]=4 361 B15R1.233 CCCCCNc1sc(nc1C(C)C)N 5c8acb8e53b020517d9179d898fee2cd [0,1,1,0,0,0|2,0,0]=4 362 B15R1.3517 CCCCCNCc1sc(nc1CC)C a7a547b8df290877b837517991cdbe73 [0,1,1,0,0,0|2,0,0]=4 363 B15R1.3517 CCCCCOCc1sc(nc1CC)C ae24f41908c6c7d1c3a851087ee209b9 [0,1,1,0,0,0|2,0,0]=4 364 B15R1.3519 CCCOCCNc1nc(sc1C)NC ad2c93246d4d012b2a947b403d0fa672 [0,1,1,0,0,0|2,0,0]=4 365 B15R1.3969 CCCCCCN(C)c1nc(sc1C)N b9b13a15fefaea1cd4aa6180e55e8435 [0,1,1,0,0,0|2,0,0]=4 366 B15R1.5365 CCCCCCCNc1nc(sc1C)C 1d9d10f7201db07ee2ec384089c0e149 [0,1,1,0,0,0|2,0,0]=4 367 B15R1.5365 CCCCCCOCc1nc(sc1C)Br 39af4a4cd95eaabf24b71e845b6b24ab [0,1,1,0,0,0|2,0,0]=4 368 B15R1.5365 CCCCCCOCc1nc(sc1C)C 50efd745ea65d8ebbcaeabfdcf4455b8 [0,1,1,0,0,0|2,0,0]=4 369 B15R1.5365 CCCCOCCNc1nc(sc1C)N ce8c4398e3ceee6432f58b4498f46473 [0,1,1,0,0,0|2,0,0]=4 370 B15R1.5365 CCCOCCCNc1nc(sc1C)C 05e4bba31911c93822415703d571e1a8 [0,1,1,0,0,0|2,0,0]=4 371 B15R1.5365 CCCOCCCNc1nc(sc1C)N c27fd087d5f33dbf7d65edb01c1df023 [0,1,1,0,0,0|1,0,0]=3 372 B15R1.5365 CCCOCCOCc1nc(sc1C)Br 372ccf6faea481cdc4e55aff9a5f8046 [0,1,1,0,0,0|2,0,0]=4 373 B15R1.5365 CCCOCCOCc1nc(sc1C)C 69eae45b0f6fc102e63e9aec95367c7a [0,1,1,0,0,0|2,0,0]=4 374 B15R1.5365 CCSCCCCNc1nc(sc1C)N 3ab3cb500fbdfcc7d08197d844b22524 [0,1,1,0,0,0|2,0,0]=4 375 B15R1.5365 COCCCCCNc1nc(sc1C)N bbdc6f7753151e3397d89a89414f028d [0,1,1,0,0,0|2,0,0]=4 376 B15R1.5365 COCCOCCNc1nc(sc1C)N 7c026ad4a3a14be71a70bdec14b4790c [0,1,1,0,0,0|2,0,0]=4 377 B15R1.5365 Cc1sc(nc1NCCCCCCO)N 80c7c27bfb45fd53df63b5f99b781087 [0,1,1,0,0,0|2,0,0]=4 378 B15R1.5365 Cc1sc(nc1NCCCOCCO)N 4a6a17e9bb5870397f5bea190a529237 [0,1,1,0,0,0|2,0,0]=4 379 B15R1.5365 Cc1sc(nc1NCCOCCCO)N 799bedd898655b5adabd345e7e149147 [0,1,1,0,0,0|2,0,0]=4 380 B15R1.11505 CCC(=O)NCCNc1nc(sc1C)N f6a6bc331653aeef3ed1e39a868c4de0 [0,1,1,0,0,0|1,0,1]=4 381 B15R1.11702 CCC(C)CC(C)Nc1sc(nc1C)N 4daee40aac5c8c372305d45b123d8f08 [0,1,1,0,0,0|2,0,0]=4 382 B15R1.22767 Cc1nc(sc1NC(C)CCC(C)C)N 9a9e401e4eb1deceed57faf8864d0cf5 [0,1,1,0,0,0|2,0,0]=4 383 B15R2.1350 CCCC(=O)N1CCc2ncsc2C1 5637ebefac9a7f61ee39baa63d5c68da [1,1,0,0,0,0|2,0,0]=4 384 B15R2.1393 CCCNC1CCc2n[nH]c(c2C1)C deafc39f9db7f03bfdc0e0cb639165ae [1,1,0,0,0,0|2,0,0]=4 385 B15R2.2123 CCCCCN1CCc2ncsc2C1 f282d92d50648256eb6ee879542a52e0 [1,1,0,0,0,0|2,0,0]=4 386 B15R2.2123 CCCCNC1CCc2nccn2C1 346d5e6b2631cc95f04f2a589bbca331 [1,1,0,0,0,0|2,0,0]=4 387 B15R2.2123 CCCCNC1CCc2ncnn2C1 5a533967b19f6a24f0c7ac13bd93462b [1,1,0,0,0,0|2,0,0]=4 388 B15R2.2123 CCCCNC1CCn2nccc2C1 702d513a3b15b9d2790b857250e6188b [1,1,0,0,0,0|2,0,0]=4 389 B15R2.2123 CCOCCN1CCc2ncsc2C1 785cc628740ff0cd1f3be15e9932b4b0 [1,1,0,0,0,0|2,0,0]=4 390 B15R2.2123 CCOCNC1CCc2nccn2C1 eab77b63b3fa910cc65567423b93558e [1,1,0,0,0,0|2,0,0]=4 391 B15R2.2123 CCOCNC1CCn2nccc2C1 6ff5b03f9ecceeedbe97d55016350b1b [1,1,0,0,0,0|2,0,0]=4 392 B15R2.2123 CCSCCN1CCc2ncsc2C1 0633803cb717b58ce07805d9f68ac811 [1,1,0,0,0,0|2,0,0]=4 393 B15R2.2123 COCCCN1CCc2ncsc2C1 8a32d9dbd0f2114eb2869507530353e8 [1,1,0,0,0,0|2,0,0]=4 394 B15R2.2123 COCCNC1CCc2nccn2C1 c911c5c8dcf1dfccb7668f4759b56668 [1,1,0,0,0,0|2,0,0]=4 395 B15R2.2123 COCCNC1CCc2ncnn2C1 04ae08fd0002035dc43cb633180f5a35 [1,1,0,0,0,0|2,0,0]=4 396 B15R2.2123 COCCNC1CCn2nccc2C1 1600901892e872c2583ec40013c12355 [1,1,0,0,0,0|2,0,0]=4 397 B15R2.2123 CSCCCN1CCc2ncsc2C1 c9fca496b3bc271225d1dbde8358b7f7 [1,1,0,0,0,0|2,0,0]=4 398 B15R2.2123 CSCCNC1CCc2nccn2C1 87f99157e1c47004ac42a1fb202a8822 [1,1,0,0,0,0|2,0,0]=4 399 B15R2.2123 CSCCNC1CCc2ncnn2C1 9b6d654d35c2a6e30d1c609463d50d0c [1,1,0,0,0,0|2,0,0]=4 400 B15R2.2123 CSCCNC1CCn2nccc2C1 621da29ded19174436395ab24a43beef [1,1,0,0,0,0|2,0,0]=4 401 B15R2.2123 FCCCCN1CCc2ncsc2C1 e1852640da23cefceef75db2c856d708 [1,1,0,0,0,0|2,0,0]=4 402 B15R2.2123 FCCCNC1CCc2nccn2C1 c85169624d0f415b463f9a5d89c6d93f [1,1,0,0,0,0|2,0,0]=4 403 B15R2.2123 FCCCNC1CCc2ncnn2C1 e41245e2b586b03b4628948864e21ae5 [1,1,0,0,0,0|2,0,0]=4 404 B15R2.2123 FCCCNC1CCn2nccc2C1 1add8ec1d87ff211c24852212f2e1b42 [1,1,0,0,0,0|2,0,0]=4 405 B15R2.2123 OCCCCN1CCc2ncsc2C1 45e881410e3334892787b8abe91d0839 [1,1,0,0,0,0|2,0,0]=4 406 B15R2.2123 OCCCNC1CCc2nccn2C1 cf76d1c0e0ddf5cdeec2dadefb19e2f2 [1,1,0,0,0,0|2,0,0]=4 407 B15R2.2123 OCCCNC1CCc2ncnn2C1 7b63f48a7e5fc949e92ce14da0865b56 [1,1,0,0,0,0|2,0,0]=4 408 B15R2.2123 OCCCNC1CCn2nccc2C1 ff8bda919b3931d457411cb3333e0096 [1,1,0,0,0,0|2,0,0]=4 409 B15R2.2123 SCCCNC1CCc2nccn2C1 37bf986bbd400fdcf4077919debf539c [1,1,0,0,0,0|2,0,0]=4 410 B15R2.2123 SCCCNC1CCc2ncnn2C1 93d87dcf68bb97b78b22e654ad1f232e [1,1,0,0,0,0|2,0,0]=4 411 B15R2.2123 SCCCNC1CCn2nccc2C1 348097dc74eef99835bc6b5a4cc16f98 [1,1,0,0,0,0|2,0,0]=4 412 B15R2.4343 CCC(C)CN1CCc2ncsc2C1 7b289cf38c91a9da831c8dd5bb980c14 [1,1,0,0,0,0|2,0,0]=4 413 B15R2.4343 CCC(C)NC1CCc2nccn2C1 4d2bbc7851952a90c0608328868d794c [1,1,0,0,0,0|2,0,0]=4 414 B15R2.4343 CCC(C)NC1CCc2ncnn2C1 b9ea284d0b4f97381686820ac1c16073 [1,1,0,0,0,0|2,0,0]=4 415 B15R2.4343 CCC(C)NC1CCn2nccc2C1 67ec4f95c4e9deb01da7e7d584ab99c2 [1,1,0,0,0,0|2,0,0]=4 416 B15R2.4343 CCC(O)CN1CCc2ncsc2C1 026b352c315fdafd8bb6b492f93ce589 [1,1,0,0,0,0|2,0,0]=4 417 B15R2.4343 CC[C@@H](C)CN1CCc2ncsc2C1 1cc91f9131b84f2d85a4350d4aa40749 [1,1,0,0,0,0|2,0,0]=4 418 B15R2.4343 CC[C@H](C)CN1CCc2ncsc2C1 6417d16c45e9b23ebbe47bef2fd76e48 [1,1,0,0,0,0|2,0,0]=4 419 B15R2.7688 CC(C)CCN1CCc2ncsc2C1 abcf146f3c8b938bd987bf13abd8b040 [1,1,0,0,0,0|2,0,0]=4 420 B15R2.7688 CC(C)CNC1CCc2nccn2C1 9085ed5e310eba695558159fe96f0ec8 [1,1,0,0,0,0|2,0,0]=4 421 B15R2.7688 CC(C)CNC1CCc2ncnn2C1 3ae5f2af2f30b6fdc08d2dcbbc9dfbf9 [1,1,0,0,0,0|2,0,0]=4 422 B15R2.7688 CC(C)CNC1CCn2nccc2C1 a55a682e3824aef40d16e49113015e04 [1,1,0,0,0,0|2,0,0]=4 423 B15R2.7688 CC(O)CCN1CCc2ncsc2C1 55ba8bdc1e62b040e68b927146a15263 [1,1,0,0,0,0|2,0,0]=4 424 B15R2.7688 CC(O)CNC1CCc2nccn2C1 ff6c855c0a5748d49b60348364ad2657 [1,1,0,0,0,0|2,0,0]=4 425 B15R2.7688 CC(O)CNC1CCc2ncnn2C1 946494bccc3963a86f4804492c82e816 [1,1,0,0,0,0|2,0,0]=4 426 B15R2.7688 CC(O)CNC1CCn2nccc2C1 b6d455eb11d2bf7ba39dabc32825acd4 [1,1,0,0,0,0|2,0,0]=4 427 B15R2.7688 C[C@@H](O)CNC1CCc2nccn2C1 e7873a907a60b5230a70b42ec8fdf184 [1,1,0,0,0,0|2,0,0]=4 428 B15R2.7688 C[C@@H](O)CNC1CCn2nccc2C1 ba10b23f6eb0014fcbe70d84357e0d20 [1,1,0,0,0,0|2,0,0]=4 429 B15R2.7688 C[C@H](O)CNC1CCc2nccn2C1 b37f3d0b43c55f1240fda129af615d8d [1,1,0,0,0,0|2,0,0]=4 430 B15R2.7688 C[C@H](O)CNC1CCc2ncnn2C1 6776dcc0807037fb71834fca198c4833 [1,1,0,0,0,0|2,0,0]=4 431 B15R2.7688 C[C@H](O)CNC1CCn2nccc2C1 a6d688bcb342d7d8b7541c2e241abdf0 [1,1,0,0,0,0|2,0,0]=4 432 B15R2.926 CC(=O)NC1CCc2nc(sc2C1)Br 59aba5e945b7871a2f693446d69880f7 [1,1,0,0,0,0|1,0,1]=4 433 B15R2.926 CC(C)CN1CCc2nc(sc2C1)Cl 6f5bf26b2b882c988d11aef641cbb86a [1,1,0,0,0,0|2,0,0]=4 434 B15R2.926 CC(C)NC1CCc2nc(sc2C1)Br cd80325ac7f549cdb326df962acc0117 [1,1,0,0,0,0|1,0,0]=3 435 B15R2.926 CC(C)OC1CCc2nc(sc2C1)Cl 6a0e49586200fabd391f43e01168f587 [1,1,0,0,0,0|2,0,0]=4 436 B15R2.926 CC(O)CN1CCc2nc(sc2C1)Cl 4c4e7f0f8ee8944ce5087a96d269f586 [1,1,0,0,0,0|2,0,0]=4 437 B15R2.926 C[C@@H](O)CN1CCc2nc(sc2C1)Cl 313611b9dc925d8fc475c15732bbc299 [1,1,0,0,0,0|2,0,0]=4 438 B15R2.926 C[C@H](O)CN1CCc2nc(sc2C1)Cl d25d33edbf8d57cdf65b74912b1c226a [1,1,0,0,0,0|2,0,0]=4 439 B15R2.926 Cc1nc2c(s1)CN(CC2)CC(C)C 9dee3ec2be1741595d21ec38ccf4d528 [1,1,0,0,0,0|2,0,0]=4 440 B15R2.926 Cc1nc2c(s1)CN(CC2)CC(C)O 89876850e5956040e3bb34adfe6ec794 [1,1,0,0,0,0|2,0,0]=4 441 B15R2.926 Cc1nc2c(s1)CN(CC2)C[C@@H](C)O ca955c8412af44b9321e3ca018b4aaac [1,1,0,0,0,0|2,0,0]=4 442 B15R2.926 Cc1nc2c(s1)CN(CC2)C[C@H](C)O 7c6a543e45cf7eb90c5cb9581841d8bb [1,1,0,0,0,0|2,0,0]=4 443 B15R2.19280 CCC(C)N1CCc2nc(sc2C1)C 37ab3a5d51cdafc8ea6cafc57376e7a9 [1,1,0,0,0,0|2,0,0]=4 444 B15R2.19280 CCC(C)N1CCc2nc(sc2C1)Cl 008f716c7fc9ab93a8e3e34ff2f20ff8 [1,1,0,0,0,0|2,0,0]=4 445 B17R2.2015 CCCCNC1CCc2ncc(cc2C1)Cl e3071363e176c4c358efca3e9eaec206 [0,1,0,0,0,1|2,0,0]=4 446 B17R2.2015 CCOCNC1CCc2ncc(cc2C1)Cl f52dc998484d84966669c269f2697fc1 [0,1,0,0,0,1|2,0,0]=4 447 B17R2.2015 COCCNC1CCc2ncc(cc2C1)Cl 45d792f647d110f00ce090244eb93b1b [0,1,0,0,0,1|2,0,0]=4 448 B17R2.2015 CSCCNC1CCc2ncc(cc2C1)Cl 77d6be6f7273c1bf57fc827cf2eca2d2 [0,1,0,0,0,1|2,0,0]=4 449 B17R2.2015 FCCCNC1CCc2ncc(cc2C1)Cl f1049a751bd60d322cfd496ca4a6bd41 [0,1,0,0,0,1|2,0,0]=4 450 B17R2.2015 OCCCNC1CCc2ncc(cc2C1)Cl 01ca3167998b1281a4ff866bc68bbdb1 [0,1,0,0,0,1|2,0,0]=4 451 B17R2.2015 SCCCNC1CCc2ncc(cc2C1)Cl 39459d993a020f82cc0f24150f18047d [0,1,0,0,0,1|2,0,0]=4 452 B17R2.9611 CCC(C)NC1CCc2ncc(cc2C1)Cl 7e4b61050216e6e4093bf0d1640d260b [0,1,0,0,0,1|2,0,0]=4 453 B17R2.19729 CC(C)CNC1CCc2ncc(cc2C1)Cl 0966d797fe21f72532446857a41d6dbc [0,1,0,0,0,1|2,0,0]=4 454 B17R2.19729 CC(O)CNC1CCc2ncc(cc2C1)Cl 09792cac58c4a832bef11fbf7e28a50e [0,1,0,0,0,1|2,0,0]=4 455 B17R2.19729 C[C@@H](O)CNC1CCc2ncc(cc2C1)Cl d3ebe1da94b08ca427a167bb20288907 [0,1,0,0,0,1|2,0,0]=4 456 B17R2.19729 C[C@H](O)CNC1CCc2ncc(cc2C1)Cl 10e7d949389a2ac34307531a6df608af [0,1,0,0,0,1|2,0,0]=4 457 B17R2.19759 Cc1ncc2c(n1)CCC(C2)NCC(C)C 605a06b3ea04ebbc72e3f094d9848ebd [0,1,0,0,0,1|2,0,0]=4 458 B17R2.19759 Cc1ncc2c(n1)CCC(C2)NCC(C)O b161f945fbe265168be3be182f3ce27d [0,1,0,0,0,1|2,0,0]=4 459 B17R2.19759 Cc1ncc2c(n1)CCC(C2)NC[C@H](C)O 2b049c2390ef23b22dca0eb41b6e4e9a [0,1,0,0,0,1|2,0,0]=4 460 B17R2.73925 CCCCNC1CCc2nc(ncc2C1)C c39320985fa3cd97cf35f52affb89309 [0,1,0,0,0,1|2,0,0]=4 461 B17R2.73925 COCCNC1CCc2nc(ncc2C1)C a5d105f2b6171a49cef8d30def11ef70 [0,1,0,0,0,1|2,0,0]=4 462 B17R2.73925 CSCCNC1CCc2nc(ncc2C1)C fd5edd4d2b8cb45cf2933a2117a6f1e6 [0,1,0,0,0,1|2,0,0]=4 463 B17R2.73925 Cc1ncc2c(n1)CCC(C2)NCCCF 3c35ec796d7752147b00c109b1d75d16 [0,1,0,0,0,1|2,0,0]=4 464 B17R2.73925 Cc1ncc2c(n1)CCC(C2)NCCCO 79604c9e9f87552a526c8b7e355c7331 [0,1,0,0,0,1|2,0,0]=4 465 B17R2.73925 Cc1ncc2c(n1)CCC(C2)NCCCS 113e8b3c5bcb23450bbe76fbb45ff7f3 [0,1,0,0,0,1|2,0,0]=4 466 B17R2.364440 CCC(C)NC1CCc2nc(ncc2C1)C d8866badaa430908214ea124a37df36a [0,1,0,0,0,1|2,0,0]=4 467 B17R2.4858 CC(=O)C(C)NC1CCc2nc(sc2C1)Br 733b485e0ae1e600d4fee6e28f12707b [0,2,0,0,0,0|1,0,1]=4 468 B17R2.4858 CC(C)C(C)NC1CCc2nc(sc2C1)Br 4abc37863901aab9d36f79fa57ee4772 [0,2,0,0,0,0|1,0,0]=3 469 B17R2.4858 CC(C)C(C)OC1CCc2nc(sc2C1)Cl 92157e92902973b5f8bb1a274f579383 [0,2,0,0,0,0|2,0,0]=4 470 B17R2.4858 CC(F)C(=O)NC1CCc2nc(sc2C1)Br 03d5cd3616bfbdedd917bcf3091a01ba [0,2,0,0,0,0|1,0,1]=4 471 B17R2.4858 CC(O)C(=O)NC1CCc2nc(sc2C1)Br 374556e418e7d36d4d97180ccc64ec3e [0,2,0,0,0,0|1,0,1]=4 472 B17R2.4858 CC(S)C(=O)NC1CCc2nc(sc2C1)Br 8a2874b50b11d253cdbebe14df6f0452 [0,2,0,0,0,0|1,0,1]=4 473 B17R2.4858 C[C@@H](F)C(=O)NC1CCc2nc(sc2C1)Br 584f425a853e042af130ea08c8d9fbaf [0,2,0,0,0,0|1,0,1]=4 474 B17R2.4858 C[C@@H](O)C(=O)NC1CCc2nc(sc2C1)Br 02ed4ebfd43c35fe5aeaab7fdf0e275e [0,2,0,0,0,0|1,0,1]=4 475 B17R2.4858 C[C@H](F)C(=O)NC1CCc2nc(sc2C1)Br 10cd00dfce435f7be19328ff547a1227 [0,2,0,0,0,0|1,0,1]=4 476 B17R2.4858 C[C@H](O)C(=O)NC1CCc2nc(sc2C1)Br a0f16833e735e04574d78875b558dc5b [0,2,0,0,0,0|1,0,1]=4 477 B17R2.37098 CC(C)(C)CNC1CCc2nc(sc2C1)Br 2a0a340ba809b04cee398f3b23ea3a74 [0,2,0,0,0,0|1,0,0]=3 478 B17R2.37098 CC(C)(C)COC1CCc2nc(sc2C1)Cl 49dbe557876d4610c40c1af514938235 [0,2,0,0,0,0|2,0,0]=4 479 B17R2.37098 CC(C)(F)CNC1CCc2nc(sc2C1)Br 6ec76e5b07aadce628f1a3e74d4c18a7 [0,2,0,0,0,0|1,0,0]=3 480 B17R2.37098 CC(C)(F)COC1CCc2nc(sc2C1)Cl d47fc3152ef586a1fc323ccafbe2060e [0,2,0,0,0,0|2,0,0]=4 481 B17R2.37098 CC(C)(O)CNC1CCc2nc(sc2C1)Br 85c06987fe679d578a60c8f6b1b931f1 [0,2,0,0,0,0|1,0,0]=3 482 B17R2.37098 CC(C)(O)COC1CCc2nc(sc2C1)Cl 69297a0b0c94de9e4d061b14c693eaea [0,2,0,0,0,0|2,0,0]=4 483 B17R2.37098 CC(F)(F)CNC1CCc2nc(sc2C1)Br ba14e9111fb5030071109675f3abfa40 [0,2,0,0,0,0|1,0,0]=3 484 B17R2.37098 CS(=O)(=O)CNC1CCc2nc(sc2C1)Br 0416c76eb1560665a529364f1b21b3aa [0,2,0,0,0,0|2,0,0]=4 485 B17R2.37098 FC(F)(F)CNC1CCc2nc(sc2C1)Br 6e8bdf44baef3bcac46b84ec14a60f6c [0,2,0,0,0,0|2,0,0]=4 486 B17R2.60983 C=C(CC)CNC1CCc2nc(sc2C1)Br 1338899add6fb0f49ebaa8453b229b2f [0,2,0,0,0,0|1,0,0]=3 487 B17R2.60983 C=C(CC)COC1CCc2nc(sc2C1)Cl 884492f67dfe227d80645f33586c7335 [0,2,0,0,0,0|2,0,0]=4 488 B17R2.60983 C=C(CNC1CCc2nc(sc2C1)Br)OC eb80f50db121705f70437e2605571aae [0,2,0,0,0,0|1,0,1]=4 489 B17R2.60983 C=C(CO)CNC1CCc2nc(sc2C1)Br 6ed1bd1f20ccc2362db3014a18ead364 [0,2,0,0,0,0|1,0,1]=4 490 B17R2.60983 CC(C#N)CNC1CCc2nc(sc2C1)Br 7806de55a5e4ce7fbb311fd3d400eaee [0,2,0,0,0,0|1,0,0]=3 491 B17R2.60983 CC(C#N)COC1CCc2nc(sc2C1)Cl e6cdd7d81f7c43fd568b5ce8aa29ab8a [0,2,0,0,0,0|2,0,0]=4 492 B17R2.60983 CC(CO)CNC1CCc2nc(sc2C1)Br c9e5c691cce4c9ad72ef9bb6ad4945c5 [0,2,0,0,0,0|1,0,0]=3 493 B17R2.60983 CCC(=O)CNC1CCc2nc(sc2C1)Br 7858792cb43f24e949846c796e80fd7a [0,2,0,0,0,0|1,0,0]=3 494 B17R2.60983 CCC(=O)COC1CCc2nc(sc2C1)Cl 4dd8c23da65de6df8bf590c7364c880c [0,2,0,0,0,0|2,0,0]=4 495 B17R2.60983 CCC(C)CNC1CCc2nc(sc2C1)Br 4ed6ef4c4c7151651fd338e46d30d932 [0,2,0,0,0,0|1,0,0]=3 496 B17R2.60983 CCC(C)COC1CCc2nc(sc2C1)Cl 0b18b84acec8cd903cff58f7cac1a8f7 [0,2,0,0,0,0|2,0,0]=4 497 B17R2.60983 CCC(O)CNC1CCc2nc(sc2C1)Br 2a20da49a85637e2cb447e7935c671d9 [0,2,0,0,0,0|1,0,0]=3 498 B17R2.60983 CC[C@@H](C)CNC1CCc2nc(sc2C1)Br 3e57c5f54f806d4a65a35d28197f4957 [0,2,0,0,0,0|1,0,0]=3 499 B17R2.60983 CC[C@@H](C)COC1CCc2nc(sc2C1)Cl 1481fba5afa2fcd32a4941e4b1cc7c03 [0,2,0,0,0,0|2,0,0]=4 500 B17R2.60983 CC[C@H](C)CNC1CCc2nc(sc2C1)Br 60e3c57098e1cbae52f58d62dc3939a2 [0,2,0,0,0,0|1,0,0]=3 501 B17R2.60983 CC[C@H](C)COC1CCc2nc(sc2C1)Cl 359c4c14e3d6e2558f9a6b07dfd79cdf [0,2,0,0,0,0|2,0,0]=4 502 B17R2.60983 CNC(=O)CNC1CCc2nc(sc2C1)Br c5c854b670aed9b2808395ca60389e0f [0,2,0,0,0,0|1,0,1]=4 503 B17R2.60983 COC(=O)CNC1CCc2nc(sc2C1)Br ff29fe27d10447aa4207fd421e835ab4 [0,2,0,0,0,0|1,0,1]=4 504 B17R2.60983 COC(C)CNC1CCc2nc(sc2C1)Br 8eadf4272e3039116a1fb5d091936fa5 [0,2,0,0,0,0|1,0,0]=3 505 B17R2.60983 COC(C)COC1CCc2nc(sc2C1)Cl af7581d1f6bf2dc57de9261662071b52 [0,2,0,0,0,0|2,0,0]=4 506 B17R2.60983 CO[C@@H](C)CNC1CCc2nc(sc2C1)Br ad9a9a0aa56e01060b8079513f8adc16 [0,2,0,0,0,0|1,0,0]=3 507 B17R2.60983 CO[C@@H](C)COC1CCc2nc(sc2C1)Cl 5a9815ca8c84cf001610d8a11b40d67d [0,2,0,0,0,0|2,0,0]=4 508 B17R2.60983 CO[C@H](C)CNC1CCc2nc(sc2C1)Br 596fb5004b7c551ccff3febd1bdefd02 [0,2,0,0,0,0|1,0,0]=3 509 B17R2.60983 CO[C@H](C)COC1CCc2nc(sc2C1)Cl 8c70d7d1bdc9d059a13da579a3748ed7 [0,2,0,0,0,0|2,0,0]=4 510 B17R2.60983 C[C@@H](CO)CNC1CCc2nc(sc2C1)Br 7b54f1dabbfa5c7c1d6a6c47edcb7ddc [0,2,0,0,0,0|1,0,0]=3 511 B17R2.60983 C[C@H](CO)CNC1CCc2nc(sc2C1)Br 96a34518f994797d22486706c257fc3d [0,2,0,0,0,0|1,0,0]=3 512 B17R2.60983 O=C(CO)CNC1CCc2nc(sc2C1)Br dc305c4d8a16a41c1ef9eddc9a0b3f76 [0,2,0,0,0,0|1,0,1]=4 513 B17R2.60983 OC(CF)CNC1CCc2nc(sc2C1)Br 1cc1bb97d0a4a6bf85de11028c7dc935 [0,2,0,0,0,0|1,0,0]=3 514 B17R2.60983 OCC(O)CNC1CCc2nc(sc2C1)Br a9474d309726bc9c25043e66e87cdfe6 [0,2,0,0,0,0|1,0,0]=3 515 B17R2.60983 OCC(O)COC1CCc2nc(sc2C1)Cl 86da75b01c4952469a27d21f0931d0e9 [0,2,0,0,0,0|2,0,0]=4 516 B17R2.60983 OC[C@@H](O)CNC1CCc2nc(sc2C1)Br 16b35c4b7c65cbf26010ff69ef3e6230 [0,2,0,0,0,0|1,0,0]=3 517 B17R2.60983 OC[C@@H](O)COC1CCc2nc(sc2C1)Cl b504544d2535e4181cf572dd198ca394 [0,2,0,0,0,0|2,0,0]=4 518 B17R2.60983 OC[C@H](O)CNC1CCc2nc(sc2C1)Br 96518eea2efba297bb0f17b368f21a71 [0,2,0,0,0,0|1,0,0]=3 519 B17R2.60983 OC[C@H](O)COC1CCc2nc(sc2C1)Cl 52abce0726bc2ba5e5e4856a6278eb71 [0,2,0,0,0,0|2,0,0]=4 520 B17R2.4859 C/C(=C/CNC1CCc2nc(sc2C1)Br)/I abe04901c6918e4e6b7d72a9ef512880 [0,2,0,0,0,0|1,0,1]=4 521 B17R2.4859 C/C(=C\CNC1CCc2nc(sc2C1)Br)/Cl 0945690a6f605643e1089aa50067cfd7 [0,2,0,0,0,0|1,0,1]=4 522 B17R2.4859 C=C(C)CCNC1CCc2nc(sc2C1)Br f6f83327ed632b199585b5dc29a63c05 [0,2,0,0,0,0|1,0,0]=3 523 B17R2.4859 C=C(C)CCOC1CCc2nc(sc2C1)Cl 2f11d01151b826d32113d2191de22762 [0,2,0,0,0,0|2,0,0]=4 524 B17R2.4859 CC(=CCNC1CCc2nc(sc2C1)Br)C de458ac35941f068876c06af523b3f39 [0,2,0,0,0,0|1,0,1]=4 525 B17R2.4859 CC(=CCNC1CCc2nc(sc2C1)Br)Cl bf816c264ced34465c4c2f7728e53d1b [0,2,0,0,0,0|1,0,1]=4 526 B17R2.4859 CC(=CCNC1CCc2nc(sc2C1)Br)I edec4e3746d3ca253f469e547bbb72a7 [0,2,0,0,0,0|1,0,1]=4 527 B17R2.4859 CC(=O)CCNC1CCc2nc(sc2C1)Br f8f1eb0bccb1dc6f4f0a3c1944c86381 [0,2,0,0,0,0|1,0,0]=3 528 B17R2.4859 CC(=O)CCOC1CCc2nc(sc2C1)Cl 162a56cb40867f8aefa47004284900e7 [0,2,0,0,0,0|2,0,0]=4 529 B17R2.4859 CC(=O)OCNC1CCc2nc(sc2C1)Br 020004461e1d64664c5ef24998004abf [0,2,0,0,0,0|1,0,1]=4 530 B17R2.4859 CC(C)CCNC1CCc2nc(sc2C1)Br e7289982f38228d9f478a253a2e9a10b [0,2,0,0,0,0|1,0,0]=3 531 B17R2.4859 CC(C)CCOC1CCc2nc(sc2C1)Cl 00b4f95e0b892ee4547d031d65a9722d [0,2,0,0,0,0|2,0,0]=4 532 B17R2.4859 CC(C)OCNC1CCc2nc(sc2C1)Br 0d50d8c973d430d56811d65007fc4800 [0,2,0,0,0,0|1,0,0]=3 533 B17R2.4859 CC(C)OCOC1CCc2nc(sc2C1)Cl ee0e2504f2c92fa412902bf2876787f0 [0,2,0,0,0,0|2,0,0]=4 534 B17R2.4859 CC(O)CCNC1CCc2nc(sc2C1)Br 9d73c3a0172141619d16e96e102c68fd [0,2,0,0,0,0|1,0,0]=3 535 B17R2.4859 CN(C)CCNC1CCc2nc(sc2C1)Br 7bd3002aefb5f03f015c2da1d588f62f [0,2,0,0,0,0|1,0,0]=3 536 B17R2.4859 CN(C)CCOC1CCc2nc(sc2C1)Cl b17808484fbd29b543938515c60e3709 [0,2,0,0,0,0|2,0,0]=4 537 B17R2.4859 CS(=O)CCNC1CCc2nc(sc2C1)Br d5e139b8d801150017ff26aa339c26be [0,2,0,0,0,0|1,0,0]=3 538 B17R2.4859 CS(=O)CCOC1CCc2nc(sc2C1)Cl 771bcc0e0322cfb7bf79a954fff08fe0 [0,2,0,0,0,0|2,0,0]=4 539 B17R2.4859 NC(=O)CCNC1CCc2nc(sc2C1)Br 536ad6f24a99418f22f4a2126f47f12f [0,2,0,0,0,0|1,0,1]=4 540 B17R2.4859 O=C(O)CCNC1CCc2nc(sc2C1)Br a324b13816774cf195f24b5a2e54e67a [0,2,0,0,0,0|1,0,1]=4 541 B17R2.22331 C#CCCCNC1CCc2nc(sc2C1)Br 4ae4c80fc7a69a2a49afbb6365d14fab [0,2,0,0,0,0|1,0,0]=3 542 B17R2.22331 C#CCCCOC1CCc2nc(sc2C1)Cl 189589682e1453ba3f717f76582290b9 [0,2,0,0,0,0|2,0,0]=4 543 B17R2.22331 C=CCCCNC1CCc2nc(sc2C1)Br 78765f869bfb41f4ea64cc9e16e3b415 [0,2,0,0,0,0|1,0,0]=3 544 B17R2.22331 C=CCCCOC1CCc2nc(sc2C1)Cl 37823e1cb5e0696d61d8008ad44aaff8 [0,2,0,0,0,0|2,0,0]=4 545 B17R2.22331 CC/C=C/CNC1CCc2nc(sc2C1)Br 48e552748bca5c5844a3a176b4a173be [0,2,0,0,0,0|1,0,0]=3 546 B17R2.22331 CC/C=C/COC1CCc2nc(sc2C1)Cl 6ea2539406dd8ef9f0e5c8a0ce368a30 [0,2,0,0,0,0|2,0,0]=4 547 B17R2.22331 CCCCCNC1CCc2nc(sc2C1)Br ffdd73a6b047fa40b525362565406b1d [0,2,0,0,0,0|1,0,0]=3 548 B17R2.22331 CCCCCOC1CCc2nc(sc2C1)Cl 71e04810a2dc74c91f4d7678404d73c4 [0,2,0,0,0,0|2,0,0]=4 549 B17R2.22331 CCOCCNC1CCc2nc(sc2C1)Br a6123f4f6eb5a1895a5c132527390926 [0,2,0,0,0,0|1,0,0]=3 550 B17R2.22331 CCOCCOC1CCc2nc(sc2C1)Cl 5a6af63b4c84636734487c9c5a107e90 [0,2,0,0,0,0|2,0,0]=4 551 B17R2.22331 CCSCCNC1CCc2nc(sc2C1)Br 7201707a8046d546856ad112c20cb1fa [0,2,0,0,0,0|1,0,0]=3 552 B17R2.22331 CCSCCOC1CCc2nc(sc2C1)Cl c5f75770ea003df52e772e072c5e7bd6 [0,2,0,0,0,0|2,0,0]=4 553 B17R2.22331 COCCCNC1CCc2nc(sc2C1)Br d6aca821a1ec878e24fc2edecb950716 [0,2,0,0,0,0|1,0,0]=3 554 B17R2.22331 COCCCOC1CCc2nc(sc2C1)Cl ea3f52061f8781a9a42156eec961c89d [0,2,0,0,0,0|2,0,0]=4 555 B17R2.22331 CSCCCNC1CCc2nc(sc2C1)Br fcdd44dba2056ddaef9ea2896863cf2f [0,2,0,0,0,0|1,0,0]=3 556 B17R2.22331 CSCCCOC1CCc2nc(sc2C1)Cl 06d5331beea75410faa6aca1b69451c5 [0,2,0,0,0,0|2,0,0]=4 557 B17R2.22331 FCCCCNC1CCc2nc(sc2C1)Br 2c8a038dd9ee19c5ca98243f481d91b1 [0,2,0,0,0,0|1,0,0]=3 558 B17R2.22331 FCCCCOC1CCc2nc(sc2C1)Cl b3856a8e9302ad581a51a7984baebb34 [0,2,0,0,0,0|2,0,0]=4 559 B17R2.22331 N#CCCCNC1CCc2nc(sc2C1)Br 1c02236eaa5ef2b1f04456006a992487 [0,2,0,0,0,0|1,0,0]=3 560 B17R2.22331 N#CCCCOC1CCc2nc(sc2C1)Cl 9a872882c0769fe346619d7e97c516c1 [0,2,0,0,0,0|2,0,0]=4 561 B17R2.22331 O=CCCCNC1CCc2nc(sc2C1)Br 22680eb22c9f36210d69ed38715ead27 [0,2,0,0,0,0|1,0,0]=3 562 B17R2.22331 O=CCCCOC1CCc2nc(sc2C1)Cl 32b6cda98ba1c602d005029eb397de1f [0,2,0,0,0,0|2,0,0]=4 563 B17R2.22331 OCCCCNC1CCc2nc(sc2C1)Br 86cb4ab01b71e694aac51af7cc4234f3 [0,2,0,0,0,0|1,0,0]=3 564 B17R2.74598 CCCNC(=O)N1CCc2nc(sc2C1)C ea7119a4131ffb3b3cff25bdfe3c169f [0,2,0,0,0,0|2,0,0]=4 565 B17R2.74598 CCCNC(=O)N1CCc2nc(sc2C1)Cl 204c8da27fcbfabf4525cbdb82676373 [0,2,0,0,0,0|2,0,0]=4 566 B17R2.74598 CCCNC(=S)N1CCc2nc(sc2C1)C 7e761ee2f9131f0fe5c773346568130b [0,2,0,0,0,0|2,0,0]=4 567 B17R2.74598 CCCNC(=S)N1CCc2nc(sc2C1)Cl b3da2f8f7754237eeef4cea68099c76d [0,2,0,0,0,0|2,0,0]=4 568 B17R2.75079 CC(CC#N)NC1CCc2nc(sc2C1)Br 4cba2321b30b962c3478e5cfa5ff3d35 [0,2,0,0,0,0|1,0,1]=4 569 B17R2.75079 CC(CCO)NC1CCc2nc(sc2C1)Br f104e34e019db6dc5ce273101e863011 [0,2,0,0,0,0|1,0,0]=3 570 B17R2.75079 CCCC(=O)NC1CCc2nc(sc2C1)Br e69287ca8add92754931204e929cfef3 [0,2,0,0,0,0|1,0,0]=3 571 B17R2.75079 CCCC(C)NC1CCc2nc(sc2C1)Br 1287ab4953531fe49dea018c6d170b17 [0,2,0,0,0,0|1,0,0]=3 572 B17R2.75079 COCC(=O)NC1CCc2nc(sc2C1)Br d2cf18889a8c664a94f9c6143023fa39 [0,2,0,0,0,0|1,0,1]=4 573 B17R2.75079 COCC(C)NC1CCc2nc(sc2C1)Br 60427a1162f75fa8f2bc485611c723b7 [0,2,0,0,0,0|1,0,0]=3 574 B17R2.75079 COCC(C)OC1CCc2nc(sc2C1)Cl f5cb87df4b52792cd66df8db0ce4d4a7 [0,2,0,0,0,0|2,0,0]=4 575 B17R2.75079 CSCC(=O)NC1CCc2nc(sc2C1)Br 30e5874c2ab078e537863bd870b0aac0 [0,2,0,0,0,0|1,0,1]=4 576 B17R2.75079 O=C(CCF)NC1CCc2nc(sc2C1)Br abcfa97b4d6363c890a9c90b1ab04261 [0,2,0,0,0,0|1,0,1]=4 577 B17R2.75079 O=C(CCO)NC1CCc2nc(sc2C1)Br d14d12c1ae245e2d196a86aa65168212 [0,2,0,0,0,0|1,0,1]=4 578 B17R2.75079 O=C(CCS)NC1CCc2nc(sc2C1)Br ea00eaff3ec6c3207f0475a2272a776e [0,2,0,0,0,0|1,0,1]=4 579 B17R2.287218 CCC(C=O)NC1CCc2nc(sc2C1)Br 8e98dee194c345fb6ebaa51f63b6f1d4 [0,2,0,0,0,0|1,0,0]=3 580 B17R2.287218 CCC(C=O)OC1CCc2nc(sc2C1)Cl bbb5631431c209699e4986c7eab8000e [0,2,0,0,0,0|2,0,0]=4 581 B17R2.287218 CCC(CC)NC1CCc2nc(sc2C1)Br 61d483160e8dc9f293a45ef45a7380ff [0,2,0,0,0,0|1,0,0]=3 582 B17R2.287218 CCC(CC)OC1CCc2nc(sc2C1)Cl 1159d3b4ce5a93bae0ea652c8c13d023 [0,2,0,0,0,0|2,0,0]=4 583 B17R2.287218 CCC(CO)NC1CCc2nc(sc2C1)Br a3b00dfa87d7e27d357a074bf7accb46 [0,2,0,0,0,0|1,0,0]=3 584 B17R2.287218 OCC(CO)NC1CCc2nc(sc2C1)Br 9d80d77650d8c690cff4cd5391dc8130 [0,2,0,0,0,0|2,0,0]=4 585 B15R2.283 Nc1nc(cs1)NCC2CCCCO2 b7db16b52725e801c9a6c874b627e42c [0,0,1,1,0,0|2,0,0]=4 586 B15R2.1289 CCCN1CCc2cc(sc2CC1)Br 069b130059d69031d3f5a1d720ae3359 [0,0,1,1,0,0|2,0,0]=4 587 B15R2.7099 Cc1sc(nc1NCCOC2CC2)N 1847fc0f7d9bd64c17ac19004188fbca [0,0,1,1,0,0|2,0,0]=4 588 B15R2.7103 Cc1sc(nc1NCCN2CCC2)N e44a0c626865320002a6573a562e3188 [0,0,1,1,0,0|1,0,0]=3 589 B15R2.7104 Cc1sc(nc1NCC2CCCC2)N af584349df0d8f0d6e012f46f01679b2 [0,0,1,1,0,0|2,0,0]=4 590 B15R2.7104 Cc1sc(nc1NCC2CCCO2)N 96c3d2e3a4726a62488e7ff9978c55fe [0,0,1,1,0,0|2,0,0]=4 591 B15R2.7104 Cc1sc(nc1NC[C@@H]2CCCO2)N 6dc0762920c30b7e3feaf33da14f3bfb [0,0,1,1,0,0|2,0,0]=4 592 B15R2.7104 Cc1sc(nc1NC[C@H]2CCCO2)N 34c26c0e00418afe7f9f21898fa1289a [0,0,1,1,0,0|2,0,0]=4 593 B15R3.4379 c1cc2n(n1)CCC(C2)NC3CC3 f31ba8b65cc3ed1bbbd2b8e3e24a7438 [1,0,0,1,0,0|2,0,0]=4 594 B15R3.4379 c1cn2c(n1)CCC(C2)NC3CC3 4f05f324a43b5364e69c46353e01ae39 [1,0,0,1,0,0|2,0,0]=4 595 B15R3.4379 c1nc2c(s1)CN(CC2)CC3CC3 9976fcf5d025e1cb97222fe190dd1cf3 [1,0,0,1,0,0|2,0,0]=4 596 B15R3.530 Cc1nc2c(s1)CN(CC2)C3CC3 3d2dfc449951242fd27217e0c593038d [1,0,0,1,0,0|2,0,0]=4 597 B17R3.18499 Clc1cnc2c(c1)CC(CC2)NC3CC3 ca52af19a48af9756e11b5830a5459ad [0,0,0,1,0,1|2,0,0]=4 598 B17R3.4406 Brc1nc2c(s1)CC(CC2)NCC3CC3 ad54bb734e3dc2c02fb3a39695e4372e [0,1,0,1,0,0|1,0,0]=3 599 B17R3.4406 Clc1nc2c(s1)CC(CC2)OCC3CC3 09f88a8cd709e53dcfb146a9715abdd7 [0,1,0,1,0,0|2,0,0]=4 600 B17R3.4404 Clc1nc2c(s1)CC(CC2)OC3CCC3 1c7a078a168b35f8e1c0735929497db0 [0,1,0,1,0,0|2,0,0]=4 601 B17R3.4404 Clc1nc2c(s1)CC(CC2)OC3COC3 aa3ad22fe29243a30ecb0fb85b5b3a60 [0,1,0,1,0,0|2,0,0]=4 602 B13R1.25 CCCNC(CC)c1ccc(s1)Cl 34b5454b81c1fc18f1de39192686ee5c [0,0,1,0,1,0|2,0,0]=4 603 B13R1.680 CCCCN(C)c1sc(nc1C)N 77ebea5307dd09f0abee8fe67b4b79f2 [0,0,1,0,1,0|2,0,0]=4 604 B13R2.164 CCCCN1Cc2ncsc2C1 105f6a5297f7840804924b78f61d1628 [1,0,0,0,1,0|2,0,0]=4 605 B13R2.468 CCCNC1CCc2c1ccs2 18b4beb371bd9bf1886c81c42bb5d3f8 [1,0,0,0,1,0|2,0,0]=4 606 B13R2.4515 CCCN1Cc2nc(sc2C1)C 85e77048457d0b3356835668c23f30eb [1,0,0,0,1,0|2,0,0]=4 607 B15R1.156 CCCCC(C)COCc1csc(n1)Br 073651429bc90a0f6ef3c9e6a738b5f9 [0,0,1,0,0,1|2,0,0]=4 608 B15R1.156 CCCCC(C)COCc1csc(n1)C 4789a6437aa6700c707d329f09fc98d3 [0,0,1,0,0,1|2,0,0]=4 609 B15R1.156 CCCCC(C)NCCc1csc(n1)C bba65b7e365ca1fb55b4fbaf20c16871 [0,0,1,0,0,1|2,0,0]=4 610 B15R1.156 CCCCC(C)OCCc1csc(n1)Br f3c253af79a6f19fb5fd83f5d1bdcc7f [0,0,1,0,0,1|2,0,0]=4 611 B15R1.156 CCCCC(C)OCCc1csc(n1)C 73a228d8b85fa73f6a4b017a624e5eaf [0,0,1,0,0,1|2,0,0]=4 612 B15R1.156 CCCCN(C)CCNc1csc(n1)N d63e9cb0fcfda3c7d14315f456152b4b [0,0,1,0,0,1|2,0,0]=4 613 B15R1.156 CCCC[C@@H](C)NCCc1csc(n1)C 861ab03d55d658b39c5c0eb663389fe3 [0,0,1,0,0,1|2,0,0]=4 614 B15R1.156 CCCC[C@@H](C)OCCc1csc(n1)C 47768bb510fe1aa6b9959ee79abca170 [0,0,1,0,0,1|2,0,0]=4 615 B15R1.156 CCCC[C@H](C)OCCc1csc(n1)C 641ceea1679130fe58065fd1e6309c24 [0,0,1,0,0,1|2,0,0]=4 616 B15R2.1282 CCNC1CCc2ncc(cc2C1)Cl 8bc0492e2c0e1387c12daa8e58a4e724 [1,0,0,0,0,1|2,0,0]=4 617 B15R2.10252 CCNC1CCc2nc(ncc2C1)C 98511d3d505b374c698266741ace1aae [1,0,0,0,0,1|2,0,0]=4 618 B15R2.17719 CCCNC1CCc2c1cc(cn2)Cl 5f351ba976ed0414fbcb77033c8ee1fb [0,0,0,0,1,1|2,0,0]=4