0 B12R1.385 CCCNc1cc(c(cn1)Br)Br 7ab8198992d1af75c3a2e80e175cfbcd [0,0,0,0,0,0|4,0,0]=4 1 B12R1.385 CCCNc1cc(c(cn1)Br)C 1e013b6706e9c54417cfc0ecde2703ad [0,0,0,0,0,0|4,0,0]=4 2 B12R1.385 CCCNc1cc(c(cn1)Br)Cl 1bfd521b6ceac7dc381f727d9c1bd47a [0,0,0,0,0,0|4,0,0]=4 3 B12R1.385 CCCNc1cc(c(cn1)Br)F 913ba1574fbf0a5ba2f45a6be5ccc307 [0,0,0,0,0,0|4,0,0]=4 4 B12R1.385 CCCNc1cc(c(cn1)C)Br 64f1c98a27a3f4b3397f589e36b8d3b9 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.385 CCCNc1cc(c(cn1)C)C 2e02e58180cef581654402e53270f130 [0,0,0,0,0,0|4,0,0]=4 6 B12R1.385 CCCNc1cc(c(cn1)C)Cl 5caaa99d6de794af8a3b16caf51b06ed [0,0,0,0,0,0|4,0,0]=4 7 B12R1.385 CCCNc1cc(c(cn1)C)F a72407fdb275bd15679e5cd4d7263bb9 [0,0,0,0,0,0|4,0,0]=4 8 B12R1.385 CCCNc1cc(c(cn1)C)I 63571f8f76d00e358dca64c836bb7d17 [0,0,0,0,0,0|4,0,0]=4 9 B12R1.385 CCCNc1cc(c(cn1)Cl)Br 1de7a82d6e4863b905e0f19887627314 [0,0,0,0,0,0|4,0,0]=4 10 B12R1.385 CCCNc1cc(c(cn1)Cl)C c9519a69e82c1cf5f97cb53f53a0ccf0 [0,0,0,0,0,0|4,0,0]=4 11 B12R1.385 CCCNc1cc(c(cn1)Cl)Cl e2f46a50e88822acdbdc345f97628a07 [0,0,0,0,0,0|4,0,0]=4 12 B12R1.385 CCCNc1cc(c(cn1)Cl)F 53fee23206a9ed11dbbab94ba764ca85 [0,0,0,0,0,0|4,0,0]=4 13 B12R1.385 CCCNc1cc(c(cn1)Cl)I 60ad4c73e2fdf2f522ed0fa5bc22dea1 [0,0,0,0,0,0|4,0,0]=4 14 B12R1.385 CCCNc1cc(c(cn1)F)Br 10edc1cb9c066046f883b230fe113465 [0,0,0,0,0,0|4,0,0]=4 15 B12R1.385 CCCNc1cc(c(cn1)F)C 7086bc50149ca85d675898988c68235a [0,0,0,0,0,0|4,0,0]=4 16 B12R1.385 CCCNc1cc(c(cn1)F)Cl 75bf7620776e6a244c0b76dc90422ecd [0,0,0,0,0,0|4,0,0]=4 17 B12R1.385 CCCNc1cc(c(cn1)F)F 214ed2fe92e747b967e5c042345541b1 [0,0,0,0,0,0|4,0,0]=4 18 B12R1.385 CCCNc1cc(c(cn1)F)I cbdc843e57e48273448b97ad7bf7d523 [0,0,0,0,0,0|4,0,0]=4 19 B12R1.385 CCCNc1cc(c(cn1)I)Br 802035579372248110abb5df348f022f [0,0,0,0,0,0|4,0,0]=4 20 B12R1.385 CCCNc1cc(c(cn1)I)C 580143b3d3d57f3587f00c359a541f88 [0,0,0,0,0,0|4,0,0]=4 21 B12R1.385 CCCNc1cc(c(cn1)I)Cl 6d6c23f7333a6d82edba7d0c7ae23d78 [0,0,0,0,0,0|4,0,0]=4 22 B12R1.385 CCCNc1cc(c(cn1)I)F 7de8545650821fbf216ab666a7b2da12 [0,0,0,0,0,0|4,0,0]=4 23 B12R1.385 CCCNc1cc(c(cn1)N)N e76024e84f6a8b495f30506102c1b2fc [0,0,0,0,0,0|4,0,0]=4 24 B12R1.385 CCCNc1cc(c(nn1)Cl)C 2c226065706b3812adfc9cb97b1812cd [0,0,0,0,0,0|3,0,1]=4 25 B12R1.385 CCCOc1cc(c(cn1)Br)Br de93ebb584f5d15cfcd2fe1e3821198a [0,0,0,0,0,0|4,0,0]=4 26 B12R1.385 CCCOc1cc(c(cn1)Br)C d29862498ce6092132deef076651f016 [0,0,0,0,0,0|4,0,0]=4 27 B12R1.385 CCCOc1cc(c(cn1)Br)Cl 561d97d09bd3ee3be46919bbde02ef3b [0,0,0,0,0,0|4,0,0]=4 28 B12R1.385 CCCOc1cc(c(cn1)Br)F b8211c09fc3d2ef1bc0b6e768177fc0f [0,0,0,0,0,0|4,0,0]=4 29 B12R1.385 CCCOc1cc(c(cn1)C)Br 6dfd822add7a6e958aacaee9685145ce [0,0,0,0,0,0|4,0,0]=4 30 B12R1.385 CCCOc1cc(c(cn1)C)C 62d88444e96920c812d6b0e91b501433 [0,0,0,0,0,0|4,0,0]=4 31 B12R1.385 CCCOc1cc(c(cn1)C)I 159d024fe7ab5d36a0b31def22742b48 [0,0,0,0,0,0|4,0,0]=4 32 B12R1.385 CCCOc1cc(c(cn1)Cl)Br 84f204459e915d3202030e16d87d8aa5 [0,0,0,0,0,0|4,0,0]=4 33 B12R1.385 CCCOc1cc(c(cn1)Cl)C 6a110691277bc4086edc119685ba8391 [0,0,0,0,0,0|4,0,0]=4 34 B12R1.385 CCCOc1cc(c(cn1)F)Br 31032788e22b4bc99f59d0ca20028024 [0,0,0,0,0,0|4,0,0]=4 35 B12R1.385 CCCOc1cc(c(cn1)F)C 9b5465800c0afcb5a8366f1665196637 [0,0,0,0,0,0|4,0,0]=4 36 B12R1.385 CCCOc1cc(c(cn1)F)I ee37b4c72a167e69297b3acbddf4aa6d [0,0,0,0,0,0|4,0,0]=4 37 B12R1.385 CCCOc1cc(c(cn1)I)C 969990fe35d23cb4b48e87945074ef9a [0,0,0,0,0,0|4,0,0]=4 38 B12R1.385 CCCOc1cc(c(cn1)I)Cl 1b12f1e26e24f095ad08c8ec6b7f3398 [0,0,0,0,0,0|4,0,0]=4 39 B12R1.385 CCOCc1cc(c(cn1)Br)Br a64b87a599d6485922bdf05c5b698087 [0,0,0,0,0,0|4,0,0]=4 40 B12R1.385 CCOCc1cc(c(cn1)Br)C fca53140f58ea0761ac2884d809e3964 [0,0,0,0,0,0|4,0,0]=4 41 B12R1.385 CCOCc1cc(c(cn1)Br)Cl a4f9730b5e51924863891eaa9385acdb [0,0,0,0,0,0|4,0,0]=4 42 B12R1.385 CCOCc1cc(c(cn1)C)Br 21b444b17eedf82f4449d564efb83402 [0,0,0,0,0,0|4,0,0]=4 43 B12R1.385 CCOCc1cc(c(cn1)C)C 4c2febf3907e6808412a4fdb3f43df40 [0,0,0,0,0,0|4,0,0]=4 44 B12R1.385 CCOCc1cc(c(cn1)C)Cl 83053d5227cb042a20c1599d2a371e2b [0,0,0,0,0,0|4,0,0]=4 45 B12R1.385 CCOCc1cc(c(cn1)Cl)Cl 306a1a04ad484fb9b8867cf08295c722 [0,0,0,0,0,0|4,0,0]=4 46 B12R1.385 CCOCc1cc(c(cn1)F)Br 5e86a2e3357ebb7ca1aea8b20c588669 [0,0,0,0,0,0|4,0,0]=4 47 B12R1.385 CCOCc1cc(c(cn1)F)C 972365095c4a9eeabac5012960a25fb0 [0,0,0,0,0,0|4,0,0]=4 48 B12R1.385 CCOCc1cc(c(cn1)F)Cl a17c6b06ea27492404f46fe80f20b0d9 [0,0,0,0,0,0|4,0,0]=4 49 B11R1.1 CCCNc1ccc(=O)[nH]c1 788491b37865b7508a806e3465be9c1e [1,0,0,0,0,0|2,0,0]=3 50 B11R1.1 CCCNc1ccc(cn1)Br 21ad52c0b7cad2f16279c41b12c3dd20 [1,0,0,0,0,0|3,0,0]=4 51 B11R1.1 CCCNc1ccc(cn1)C 49b1b111cca17d95ac5b969044ae90fe [1,0,0,0,0,0|3,0,0]=4 52 B11R1.1 CCCNc1ccc(cn1)Cl a95c01f05e53613156fba3b0f8d7f780 [1,0,0,0,0,0|3,0,0]=4 53 B11R1.1 CCCNc1ccc(cn1)F bd191ccc5254163826bb8b5b65ee6ba9 [1,0,0,0,0,0|3,0,0]=4 54 B11R1.1 CCCNc1ccc(cn1)I 3117f77f4a2d396d13ad23c0ed5be14e [1,0,0,0,0,0|3,0,0]=4 55 B11R1.1 CCCNc1ccc(nn1)Br ccdcddb968ec068533be8b8680a79244 [1,0,0,0,0,0|2,0,1]=4 56 B11R1.1 CCCNc1ccc(nn1)C 4a47f404f21e29fa778a561433c0b743 [1,0,0,0,0,0|2,0,1]=4 57 B11R1.1 CCCNc1ccc(nn1)Cl 7ecc7b5a3c836aee1090e838fbe3ae62 [1,0,0,0,0,0|2,0,1]=4 58 B11R1.1 CCCNc1ccc(nn1)F dd7d3bea14bb07d9e27ae9cdfe38c20b [1,0,0,0,0,0|2,0,1]=4 59 B11R1.1 CCCNc1ccc(nn1)I 8e7333ea5a9771bb7ada2e8999ebdfb9 [1,0,0,0,0,0|2,0,1]=4 60 B11R1.1 CCCNc1cnc(=O)[nH]c1 0854fbbcdbee8171e8e481d0e1b76d06 [1,0,0,0,0,0|3,0,0]=4 61 B11R1.1 CCCOc1ccc(cn1)C a2aa3425c184ebbd01762c44679803c0 [1,0,0,0,0,0|3,0,0]=4 62 B11R1.1 CCCOc1ccc(cn1)Cl 0c1b7fe9f246d104ebcbc468a16004c1 [1,0,0,0,0,0|3,0,0]=4 63 B11R1.1 CCCOc1ccc(cn1)F 6a93fffcdab2ace921c013c1d2a630f1 [1,0,0,0,0,0|3,0,0]=4 64 B11R1.1 CCCOc1ccc(cn1)I ca1682e59f74f1735f8a64800a62750a [1,0,0,0,0,0|3,0,0]=4 65 B11R1.1 CCCOc1ccc(nn1)Br ca5d040c8581350c48d8935145ece88b [1,0,0,0,0,0|2,0,1]=4 66 B11R1.1 CCCOc1ccc(nn1)C c27dff73ed2f7d87764f5d3661cdeb9f [1,0,0,0,0,0|2,0,1]=4 67 B11R1.1 CCCOc1ccc(nn1)Cl 489433f97f5e5f36cd4875eb8c146641 [1,0,0,0,0,0|2,0,1]=4 68 B11R1.1 CCNCc1ccc(=O)[nH]c1 1254ebee348ff16c368fd1d2a91b5fef [1,0,0,0,0,0|2,0,0]=3 69 B11R1.1 CCNCc1ccc(cn1)Br 882a30c5c31be62d8df2ad05ade9700e [1,0,0,0,0,0|3,0,0]=4 70 B11R1.1 CCNCc1ccc(cn1)C ce28a7edd6e5cb339d15632619449df9 [1,0,0,0,0,0|3,0,0]=4 71 B11R1.1 CCNCc1ccc(cn1)Cl a8b3098af6f06b71ef76b0a789adb905 [1,0,0,0,0,0|3,0,0]=4 72 B11R1.1 CCNCc1ccc(cn1)F 8ce16a3c3b9cfcc722411ae28895539b [1,0,0,0,0,0|3,0,0]=4 73 B11R1.1 CCNCc1ccc(nn1)C eb19abdb6fa5bbee3b70e5fa3639bbb5 [1,0,0,0,0,0|2,0,1]=4 74 B11R1.1 CCNCc1ccc(nn1)Cl 5d8791c87f02ef2da6feeee59195419f [1,0,0,0,0,0|2,0,1]=4 75 B11R1.1 CCOCc1ccc(cn1)Br 7fa2d6660ca0fac0c5d496c90646d302 [1,0,0,0,0,0|3,0,0]=4 76 B11R1.1 CCOCc1ccc(cn1)C d87497b35c5f44e142aec59de5813e88 [1,0,0,0,0,0|3,0,0]=4 77 B11R1.1 CCOCc1ccc(cn1)Cl 6991b553b81a946d1923a2d827bfdbc3 [1,0,0,0,0,0|3,0,0]=4 78 B11R1.1 CCOCc1ccc(cn1)F c13b565598015e639c197d30e6fbe232 [1,0,0,0,0,0|3,0,0]=4 79 B11R1.1 CCOCc1ccc(cn1)I 401d1ae041509fd6bf393ad89597efa1 [1,0,0,0,0,0|3,0,0]=4 80 B11R1.1 CCOCc1ccc(nn1)C 25715347b166dc0e3fa1b4f7090bb697 [1,0,0,0,0,0|2,0,1]=4 81 B11R1.1 CCOCc1ccc(nn1)Cl ac07200b3f9b3b1058c1d205c3caafe5 [1,0,0,0,0,0|2,0,1]=4 82 B11R1.1 COCNc1ccc(=O)[nH]c1 b4a2449cedb2e1b491a9c0d57d7f1632 [1,0,0,0,0,0|3,0,0]=4 83 B11R1.1 CSCNc1ccc(=O)[nH]c1 62ab78a03567958267bec0430980ef6f [1,0,0,0,0,0|3,0,0]=4 84 B11R1.1 O=c1ccc(c[nH]1)CNCF 81573997f05b604cb580bebded221a40 [1,0,0,0,0,0|3,0,0]=4 85 B11R1.1 O=c1ccc(c[nH]1)CNCO bb83acf187d7f19d584f105f6810294f [1,0,0,0,0,0|3,0,0]=4 86 B11R1.1 O=c1ccc(c[nH]1)NCCF 13d733c4340b5fcf5d893368e9689af6 [1,0,0,0,0,0|3,0,0]=4 87 B11R1.1 O=c1ccc(c[nH]1)NCCO 410d745dee12fa60b560903e314fdf23 [1,0,0,0,0,0|3,0,0]=4 88 B11R1.1 O=c1ccc(c[nH]1)NCCS 4e8aa267317d950756513167f0b0c73d [1,0,0,0,0,0|3,0,0]=4 89 B11R1.24 CCCNc1cc(ccn1)Br f1c13a780ea072a97f4918a3ae5fe793 [1,0,0,0,0,0|3,0,0]=4 90 B11R1.24 CCCNc1cc(ccn1)C 9dd4b3ccbbc29296234e9ff62794f94d [1,0,0,0,0,0|3,0,0]=4 91 B11R1.24 CCCNc1cc(ccn1)Cl e2748ea47500b5c43ad80436ec365351 [1,0,0,0,0,0|3,0,0]=4 92 B11R1.24 CCCNc1cc(ccn1)F 19627d65edc699fb72ffad9630193c09 [1,0,0,0,0,0|3,0,0]=4 93 B11R1.24 CCCNc1cc(ccn1)I 84f5d93869eede5ea29829b3c07bd844 [1,0,0,0,0,0|3,0,0]=4 94 B11R1.24 CCCNc1cc(cnn1)Br 42aec590a5126706d3d8cb2beed0328e [1,0,0,0,0,0|2,0,1]=4 95 B11R1.24 CCCNc1cc(cnn1)C 5c62222ae5ea8ecaecb63882a2edac4f [1,0,0,0,0,0|2,0,1]=4 96 B11R1.24 CCCNc1cc(cnn1)Cl 3d453950b6aefff2f4ff234467d9a7af [1,0,0,0,0,0|2,0,1]=4 97 B11R1.24 CCCOc1cc(ccn1)Br 733fbc0062452a6d408b5de5a71ee204 [1,0,0,0,0,0|3,0,0]=4 98 B11R1.24 CCCOc1cc(ccn1)C e0a5b7a4ceaf137253b09aaa74d8a523 [1,0,0,0,0,0|3,0,0]=4 99 B11R1.24 CCCOc1cc(ccn1)Cl 9bec7845ed0cc2ec4528299e79a75327 [1,0,0,0,0,0|3,0,0]=4 100 B11R1.24 CCCOc1cc(ccn1)F 0dc309ef3e091b80292d2495314d3e88 [1,0,0,0,0,0|3,0,0]=4 101 B11R1.24 CCNCc1cc(ccn1)Br e896276c8fa14cddbcb38ebcdac27e5d [1,0,0,0,0,0|3,0,0]=4 102 B11R1.24 CCNCc1cc(ccn1)C 774f66d8e453a57270dc32842d55134b [1,0,0,0,0,0|3,0,0]=4 103 B11R1.24 CCNCc1cc(ccn1)Cl 5028728b9ac7ebc1c9518284f0807fbd [1,0,0,0,0,0|3,0,0]=4 104 B11R1.24 CCOCc1cc(ccn1)Br 0726b8a141caded4ec904623fca2ab22 [1,0,0,0,0,0|3,0,0]=4 105 B11R1.24 CCOCc1cc(ccn1)C 2d5b6d2e2d714975e85774b9da739956 [1,0,0,0,0,0|3,0,0]=4 106 B11R1.24 CCOCc1cc(ccn1)Cl 158638af681bb2c0924168dfb0c4809a [1,0,0,0,0,0|3,0,0]=4 107 B11R1.24 CCOCc1cc(ccn1)F a0a517bf4ebe3f482da9efb1f014fd4e [1,0,0,0,0,0|3,0,0]=4 108 B11R1.24 CCOCc1cc(ccn1)I 52a26a3ba97e706ba155b551bf3cce2f [1,0,0,0,0,0|3,0,0]=4 109 B11R1.24 CCOCc1cc(cnn1)C 1666bfdb580ffa9b164a53cf82d16080 [1,0,0,0,0,0|2,0,1]=4 110 B11R1.24 Oc1ccnc(c1)NCCS a3cd4fe526a7b40663b993ecde214579 [1,0,0,0,0,0|3,0,0]=4 111 B13R1.136 CCCNc1cc(c(=O)n(c1)C)Br 848bcad1de9091dbda0688530cd0100d [0,1,0,0,0,0|3,0,0]=4 112 B13R1.136 CCCNc1cc(c(=O)n(c1)C)C 3a66df33449e67c029900507175aa4f2 [0,1,0,0,0,0|3,0,0]=4 113 B13R1.136 CCCNc1cc(c(=O)n(c1)C)Cl bcf2359cc47075f468980d805d605162 [0,1,0,0,0,0|3,0,0]=4 114 B13R1.136 CCCNc1cc(c(=O)n(c1)C)F 4269766d48980d84b4bfd849486c3d65 [0,1,0,0,0,0|3,0,0]=4 115 B13R1.136 CCCNc1cc(c(=O)n(n1)C)C 7d9b88b56dd9f31c1b381703e03ba45d [0,1,0,0,0,0|2,0,0]=3 116 B13R1.136 Cc1cc(nn(c1=O)C)NCCBr 10f9a97ee1b2b805e12940c1c81a5f3b [0,1,0,0,0,0|3,0,0]=4 117 B13R1.136 Cc1cc(nn(c1=O)C)NCCF 0e450043380821cdc45ac7c780e8c968 [0,1,0,0,0,0|3,0,0]=4 118 B13R1.136 Cc1cc(nn(c1=O)C)NCCI 312f720cb1ced829ad480c09fe9afd11 [0,1,0,0,0,0|3,0,0]=4 119 B13R1.136 Cc1cc(nn(c1=O)C)NCCO c8801193de6747a25b8608594736138c [0,1,0,0,0,0|3,0,0]=4 120 B13R1.136 Cc1cc(nn(c1=O)C)NCCS 4604f0efd5136bd16243204bbf0a1c83 [0,1,0,0,0,0|3,0,0]=4 121 B13R1.575 CCCNc1cc(c(cn1)Br)CO 1210e57371c6eeadf7e15358661859fa [0,1,0,0,0,0|3,0,0]=4 122 B13R1.575 CCCNc1cc(c(cn1)Br)OC 1836de4981d976fb97b2e61013b8c7ca [0,1,0,0,0,0|3,0,0]=4 123 B13R1.575 CCCNc1cc(c(cn1)C)OC 48fab415d869e4043855a1cdd776385b [0,1,0,0,0,0|3,0,0]=4 124 B13R1.575 CCCNc1cc(c(cn1)Cl)OC d7086b9908ca1ae31105b329655d24ea [0,1,0,0,0,0|3,0,0]=4 125 B13R1.575 CCCNc1cc(c(cn1)I)OC cc7faae005f7a0e86e67c5418303f865 [0,1,0,0,0,0|3,0,0]=4 126 B13R1.575 CCCOc1cc(c(cn1)Cl)OC 6ffff1738215bb84840a3571cbd32c07 [0,1,0,0,0,0|3,0,0]=4 127 B13R1.575 CCOCc1cc(c(cn1)Br)OC 881bf8c6459504be0f48dc5d8b6c2664 [0,1,0,0,0,0|3,0,0]=4 128 B13R1.669 CCCCNc1c[nH]c(=O)c(n1)C 286f95641b8d326d80d8fdb5fd627881 [0,1,0,0,0,0|3,0,0]=4 129 B13R1.669 CCCCNc1cc(c(cn1)Br)Br b7880c89d9fa615140df6df0ef423d9a [0,1,0,0,0,0|3,0,0]=4 130 B13R1.669 CCCCNc1cc(c(cn1)Br)C 715361f361c523c0cfd728be331394a1 [0,1,0,0,0,0|3,0,0]=4 131 B13R1.669 CCCCNc1cc(c(cn1)Br)Cl 7c86796f436a223f85dd967b4fa1e656 [0,1,0,0,0,0|3,0,0]=4 132 B13R1.669 CCCCNc1cc(c(cn1)Br)F ba8f197dbe575ae254b99d4dc622e735 [0,1,0,0,0,0|3,0,0]=4 133 B13R1.669 CCCCNc1cc(c(cn1)C)Br 5661e85c0c9011f74e626e2ddec95855 [0,1,0,0,0,0|3,0,0]=4 134 B13R1.669 CCCCNc1cc(c(cn1)C)C 75225a9c888a85fc112476b2ac0c37ca [0,1,0,0,0,0|3,0,0]=4 135 B13R1.669 CCCCNc1cc(c(cn1)C)Cl cf7d99c8472c20e6064165be62351a79 [0,1,0,0,0,0|3,0,0]=4 136 B13R1.669 CCCCNc1cc(c(cn1)C)F 3f2c259e1d0fe5a2ba15f0a37e4e214b [0,1,0,0,0,0|3,0,0]=4 137 B13R1.669 CCCCNc1cc(c(cn1)C)I 4045cd9c52cf5ae22905042e0482db6b [0,1,0,0,0,0|3,0,0]=4 138 B13R1.669 CCCCNc1cc(c(cn1)Cl)Br f1bcbcf50bc1d077374bb293ff747896 [0,1,0,0,0,0|3,0,0]=4 139 B13R1.669 CCCCNc1cc(c(cn1)Cl)C b0e3d54aef17035417c64d6a9a3b6895 [0,1,0,0,0,0|3,0,0]=4 140 B13R1.669 CCCCNc1cc(c(cn1)Cl)Cl af2442224f49d514fcba16716f6f224d [0,1,0,0,0,0|3,0,0]=4 141 B13R1.669 CCCCNc1cc(c(cn1)Cl)F 0b7beb9a5175dfa367745db8461589ef [0,1,0,0,0,0|3,0,0]=4 142 B13R1.669 CCCCNc1cc(c(cn1)Cl)I 2b84a013f462ffa04f94ae3c32763ced [0,1,0,0,0,0|3,0,0]=4 143 B13R1.669 CCCCNc1cc(c(cn1)F)Br 17ba801eae4f458fe89a67c705928d31 [0,1,0,0,0,0|3,0,0]=4 144 B13R1.669 CCCCNc1cc(c(cn1)F)C d44fceb1e64c3b37ca44728831d3ef16 [0,1,0,0,0,0|3,0,0]=4 145 B13R1.669 CCCCNc1cc(c(cn1)F)Cl 4fe008247f51c3920ce6f50a81a6f2ec [0,1,0,0,0,0|3,0,0]=4 146 B13R1.669 CCCCNc1cc(c(cn1)F)F 655c24bc740fa0544101aa082abef605 [0,1,0,0,0,0|3,0,0]=4 147 B13R1.669 CCCCNc1cc(c(cn1)F)I 0d70a0f2405df2fb23b483462d6a7f63 [0,1,0,0,0,0|3,0,0]=4 148 B13R1.669 CCCCNc1cc(c(cn1)I)Br cdb63ef1461ebb5a4dc07d4251264a00 [0,1,0,0,0,0|3,0,0]=4 149 B13R1.669 CCCCNc1cc(c(cn1)I)C 8e3887279ea7d5afb527039d3d8fbda1 [0,1,0,0,0,0|3,0,0]=4 150 B13R1.669 CCCCNc1cc(c(cn1)I)Cl bc9845556e1a6d51cc474aa2ab058012 [0,1,0,0,0,0|3,0,0]=4 151 B13R1.669 CCCCNc1cc(c(cn1)I)F 695ea07138979ffd636dd193690238fd [0,1,0,0,0,0|3,0,0]=4 152 B13R1.669 CCCCNc1cc(c(cn1)N)N c8bc40f0da34ece68270eed6d3dfb691 [0,1,0,0,0,0|3,0,0]=4 153 B13R1.669 CCCCNc1cc(c(nn1)Cl)C 2d89e90e687e31205eabbbcef1cc8db0 [0,1,0,0,0,0|2,0,1]=4 154 B13R1.669 CCCCNc1cc(c(nn1)N)N 67e1a93d44a925c0f6240c6202a4cd9b [0,1,0,0,0,0|2,0,1]=4 155 B13R1.669 CCCCNc1ccc(c(c1)O)C e47c1e4276a332a45cfc6c47b74e0fbb [0,1,0,0,0,0|3,0,0]=4 156 B13R1.669 CCCCNc1ccc(c(c1)O)F f76e05977b0cd4e6e39729c39dea86b2 [0,1,0,0,0,0|3,0,0]=4 157 B13R1.669 CCCCNc1ccc(c(c1)O)O deb8d7711339243195fd273015acd44b [0,1,0,0,0,0|2,0,1]=4 158 B13R1.669 CCCCOc1cc(c(cn1)Br)Br 61383e7d7f7f493a16d2f5d8da49da00 [0,1,0,0,0,0|3,0,0]=4 159 B13R1.669 CCCCOc1cc(c(cn1)Br)C 7feed7c402954310bdb629b05f21d7e9 [0,1,0,0,0,0|3,0,0]=4 160 B13R1.669 CCCCOc1cc(c(cn1)Br)Cl 29dde91d72adc143e27ad221d3387919 [0,1,0,0,0,0|3,0,0]=4 161 B13R1.669 CCCCOc1cc(c(cn1)Br)F b9a169904b5c5119b53747fbfd056050 [0,1,0,0,0,0|3,0,0]=4 162 B13R1.669 CCCCOc1cc(c(cn1)C)Br e7bdf679ca76466b2783b4fe23fb4960 [0,1,0,0,0,0|3,0,0]=4 163 B13R1.669 CCCCOc1cc(c(cn1)C)C f0375680a2847802423d799eb8f25ab4 [0,1,0,0,0,0|3,0,0]=4 164 B13R1.669 CCCCOc1cc(c(cn1)C)I aed6a6e3641626decc19b4e5be2ed475 [0,1,0,0,0,0|3,0,0]=4 165 B13R1.669 CCCCOc1cc(c(cn1)Cl)Br 715561a60183bd599ed2153aebe9ec0b [0,1,0,0,0,0|3,0,0]=4 166 B13R1.669 CCCCOc1cc(c(cn1)Cl)C 932686ce1f6d376da14de5c4bf1f7d9e [0,1,0,0,0,0|3,0,0]=4 167 B13R1.669 CCCCOc1cc(c(cn1)F)Br a98c3a0e7afe7cb41310bd6765b6ec7e [0,1,0,0,0,0|3,0,0]=4 168 B13R1.669 CCCCOc1cc(c(cn1)F)C e46b70a696b78315ccb655d170110870 [0,1,0,0,0,0|3,0,0]=4 169 B13R1.669 CCCCOc1cc(c(cn1)F)I 7e91acf7448b85be0453207708221ddf [0,1,0,0,0,0|3,0,0]=4 170 B13R1.669 CCCCOc1cc(c(cn1)I)C aeb0725ca1034b3658beb617313fc3cc [0,1,0,0,0,0|3,0,0]=4 171 B13R1.669 CCCCOc1cc(c(cn1)I)Cl f1059296cb97983412838af6ac439e08 [0,1,0,0,0,0|3,0,0]=4 172 B13R1.669 CCCOCc1cc(c(cn1)Br)Br 09633bda5f8baf8831126e16e13723cd [0,1,0,0,0,0|3,0,0]=4 173 B13R1.669 CCCOCc1cc(c(cn1)Br)C f7b5c11c9911248b543678bcaad4d460 [0,1,0,0,0,0|3,0,0]=4 174 B13R1.669 CCCOCc1cc(c(cn1)Br)Cl 72890cd37ab37b8044d606617fc4b555 [0,1,0,0,0,0|3,0,0]=4 175 B13R1.669 CCCOCc1cc(c(cn1)C)Br 181efbc519da2d594e4d8aec780c0208 [0,1,0,0,0,0|3,0,0]=4 176 B13R1.669 CCCOCc1cc(c(cn1)C)C d50114f15ec14b29538d35d6bd23c5c1 [0,1,0,0,0,0|3,0,0]=4 177 B13R1.669 CCCOCc1cc(c(cn1)C)Cl 72da4e8d64cdd1b8134cea2c7664382f [0,1,0,0,0,0|3,0,0]=4 178 B13R1.669 CCCOCc1cc(c(cn1)Cl)Cl 9e3c4b03753f5c02f7d0dfb66c9ee107 [0,1,0,0,0,0|3,0,0]=4 179 B13R1.669 CCCOCc1cc(c(cn1)F)Br ca901cd6422b288b0328f40698322c92 [0,1,0,0,0,0|3,0,0]=4 180 B13R1.669 CCCOCc1cc(c(cn1)F)C c6835219881c6b913ee3982fd730249b [0,1,0,0,0,0|3,0,0]=4 181 B13R1.669 CCCOCc1cc(c(cn1)F)Cl 71ee96fa350f05a5a9678fc023de2e11 [0,1,0,0,0,0|3,0,0]=4 182 B13R1.669 COCCNc1c[nH]c(=O)c(c1)F 2cb7c45cececd3cb08f8cd8c48e73154 [0,1,0,0,0,0|3,0,0]=4 183 B11R0.42 C=C(Br)C(=O)NCCCCCC 83001ce2c67f35747acade3dfa4a8623 [0,0,1,0,0,0|2,0,1]=4 184 B11R0.42 C=C(C)C(=O)NCCCCCC 68147d1975557dda6de2c0965669be47 [0,0,1,0,0,0|2,0,1]=4 185 B11R0.42 C=C(Cl)C(=O)NCCCCCC 5397766ddce183470ebf8197563210c9 [0,0,1,0,0,0|2,0,1]=4 186 B11R0.42 C=C(F)C(=O)NCCCCCC 90a5f5b8f5d692528445328f9fa25a09 [0,0,1,0,0,0|2,0,1]=4 187 B11R1.212 CCCNc1n[nH]c(c1Br)C e2f200a81b764c33ad9d3ac6684bf46f [0,0,0,0,1,0|3,0,0]=4 188 B11R1.212 CCCNc1n[nH]c(c1C)Br 279d7a02e4d74fd9869257dc124d1516 [0,0,0,0,1,0|3,0,0]=4 189 B11R1.212 CCCNc1n[nH]c(c1Cl)C fbe1ccdd78f3b361481621f269f2bdd0 [0,0,0,0,1,0|3,0,0]=4 190 B11R1.212 CCCOc1n[nH]c(c1Cl)C e2c1639558fa7cc63a98eb30b19cae4f [0,0,0,0,1,0|3,0,0]=4 191 B11R1.212 CCOCc1n[nH]c(=O)n1C 7270a4b4acbb7ab1ca40e713e453797c [0,0,0,0,1,0|3,0,0]=4 192 B11R1.212 CCOCc1n[nH]c(c1F)C 8a11d07e198a7746604f3a6b5bf70af0 [0,0,0,0,1,0|3,0,0]=4 193 B10R0.74 C=CC(=O)NCCCCCC 88ce4279cd9f4230d78384982723ab15 [1,0,1,0,0,0|1,0,1]=4 194 B10R0.74 C=CC(=O)NCOCCCC 327e7e67c9f9e961c425796e607b435a [1,0,1,0,0,0|2,0,0]=4 195 B10R0.75 C=C(Br)C(=O)NCCCCC 411c4c8903b3fa102e4208e7b57d5a8a [1,0,1,0,0,0|1,0,1]=4 196 B10R0.75 C=C(C)C(=O)NCCCCC 0d395da954277cf73f296326067ead17 [1,0,1,0,0,0|1,0,1]=4 197 B10R0.75 C=C(Cl)C(=O)NCCCCC 1710c21e76a8c29d969adb9b2c6f0f6f [1,0,1,0,0,0|1,0,1]=4 198 B10R0.75 C=C(F)C(=O)NCCCCC 66e95918fa63b8f2f47c91a2c6da8fef [1,0,1,0,0,0|1,0,1]=4 199 B10R0.78 CCCNC(=O)/C=C/C(=O)N f05e4e8ec21b75a60249a30f6480d351 [1,0,1,0,0,0|2,0,0]=4 200 B10R0.78 CCCNC(=O)/C=C\C(=O)N 71136ca8ef43dadeb10c3daa2b17a4ac [1,0,1,0,0,0|2,0,0]=4 201 B10R0.78 CCCNC(=O)C=CC(=O)N 716751936d8b136dbe6ae3a72dba6049 [1,0,1,0,0,0|2,0,0]=4 202 B10R1.1 CCNc1ccc(=O)[nH]c1 cda5f6466914b9089a8f399c4d41b9f1 [2,0,0,0,0,0|2,0,0]=4 203 B10R1.17 CCCNc1ccccn1 d0e3424364e1c8a55b80e6e83d3696ba [2,0,0,0,0,0|2,0,0]=4 204 B10R1.17 CCCNc1cccnn1 563334c6dadea743653cde03719d759b [2,0,0,0,0,0|1,0,1]=4 205 B10R1.17 CCCOc1ccccn1 6e04423b9fd777130a88eaa9fd38fe0c [2,0,0,0,0,0|2,0,0]=4 206 B10R1.17 CCNCc1ccccn1 18cfef8413e038075fdfe85720c8bb60 [2,0,0,0,0,0|2,0,0]=4 207 B10R1.17 CCNCc1cccnn1 d81bd9bf1bc516576c473bbc4cf064a6 [2,0,0,0,0,0|1,0,1]=4 208 B10R1.17 CCOCc1ccccn1 0c63694580ac3136b3801886d248907b [2,0,0,0,0,0|2,0,0]=4 209 B10R1.17 CCOCc1cccnn1 a18ecdaafc84bd92138525fb2f4ad399 [2,0,0,0,0,0|1,0,1]=4 210 B12R0.49 C/C=C(\O)/C(=O)NCCCCCC 94af456fd706a8858ebc297c6cfe6973 [0,1,1,0,0,0|1,0,1]=4 211 B12R0.49 C=C(CO)C(=O)NCCCCCC ebe7fc68532266bffa9d6b5a5764a866 [0,1,1,0,0,0|1,0,1]=4 212 B12R1.1 C=CCCNc1ccc(=O)[nH]n1 d76fbf31f6df4dcc7dc7822dd68f7241 [1,1,0,0,0,0|0,0,2]=4 213 B12R1.1 CC=CCNc1ccc(=O)[nH]n1 5de2aee36e68ad9d6da84f5734b00601 [1,1,0,0,0,0|0,0,2]=4 214 B12R1.1 CCCCNc1ccc(=O)[nH]c1 02a79ca1969806667926017962f8be99 [1,1,0,0,0,0|1,0,0]=3 215 B12R1.1 CCCCNc1ccc(cn1)Br 2147d0487acab31419a643db0484fa62 [1,1,0,0,0,0|2,0,0]=4 216 B12R1.1 CCCCNc1ccc(cn1)C 998adba6fba82ff0970d6030353c7365 [1,1,0,0,0,0|2,0,0]=4 217 B12R1.1 CCCCNc1ccc(cn1)Cl 042111bb41580bf256eb9f12ba97b780 [1,1,0,0,0,0|2,0,0]=4 218 B12R1.1 CCCCNc1ccc(cn1)F 746733710bba02fd4d704c1e085b8b50 [1,1,0,0,0,0|2,0,0]=4 219 B12R1.1 CCCCNc1ccc(cn1)I 0047bdc6626e6145afb77fb61f2e6165 [1,1,0,0,0,0|2,0,0]=4 220 B12R1.1 CCCCNc1ccc(nn1)Br a9fff27580e3f9c250b070a9d2c0f643 [1,1,0,0,0,0|1,0,1]=4 221 B12R1.1 CCCCNc1ccc(nn1)C 819abe29a7c4500598eeef7c83e21a92 [1,1,0,0,0,0|1,0,1]=4 222 B12R1.1 CCCCNc1ccc(nn1)Cl c9222429e6cb0ff831e8f87dd11d9fdf [1,1,0,0,0,0|1,0,1]=4 223 B12R1.1 CCCCNc1ccc(nn1)F 150c24be939eed0ba44211f762e92e7a [1,1,0,0,0,0|1,0,1]=4 224 B12R1.1 CCCCNc1ccc(nn1)I b6b38c916f5f85c1b58c423a55b0726d [1,1,0,0,0,0|1,0,1]=4 225 B12R1.1 CCCCNc1cnc(=O)[nH]c1 d204c4041ab86421e1d470a52cfa9de1 [1,1,0,0,0,0|2,0,0]=4 226 B12R1.1 CCCCOc1ccc(cn1)C 73f80a64d75c76f1625ecd7b6bf60afd [1,1,0,0,0,0|2,0,0]=4 227 B12R1.1 CCCCOc1ccc(cn1)Cl 2f3f36b0755b6968d932427b919a5191 [1,1,0,0,0,0|2,0,0]=4 228 B12R1.1 CCCCOc1ccc(cn1)F 714f99d2bf60a4e198c8d7fc7d3992d6 [1,1,0,0,0,0|2,0,0]=4 229 B12R1.1 CCCCOc1ccc(cn1)I 7a11f6fcbd5b72cfe1708e440ade4c11 [1,1,0,0,0,0|2,0,0]=4 230 B12R1.1 CCCCOc1ccc(nn1)Br 25379e0e46fb781ebc35280e9f275b88 [1,1,0,0,0,0|1,0,1]=4 231 B12R1.1 CCCCOc1ccc(nn1)C 3a6df5dd384d7741ccac0f09303c9283 [1,1,0,0,0,0|1,0,1]=4 232 B12R1.1 CCCCOc1ccc(nn1)Cl 69a3577748fb4f9d7650779cec66c9f2 [1,1,0,0,0,0|1,0,1]=4 233 B12R1.1 CCCNCc1ccc(=O)[nH]c1 7538f417ad561b957ce036f792a167ba [1,1,0,0,0,0|1,0,0]=3 234 B12R1.1 CCCNCc1ccc(cn1)Br ce6bf34b40a640b4111b2e5163e26705 [1,1,0,0,0,0|2,0,0]=4 235 B12R1.1 CCCNCc1ccc(cn1)C 0859440e6ab41c7baa50b4dbb7bfaf38 [1,1,0,0,0,0|2,0,0]=4 236 B12R1.1 CCCNCc1ccc(cn1)Cl 518b2eeb37bf5f7f7618b8da0a2f2225 [1,1,0,0,0,0|2,0,0]=4 237 B12R1.1 CCCNCc1ccc(cn1)F 1bb258a69067a228981a13b7c8ffa600 [1,1,0,0,0,0|2,0,0]=4 238 B12R1.1 CCCNCc1ccc(nn1)C 32380c905b1ba0c05ca532f775e77c52 [1,1,0,0,0,0|1,0,1]=4 239 B12R1.1 CCCNCc1ccc(nn1)Cl b167ab00ee248e92eb6781b484eb4783 [1,1,0,0,0,0|1,0,1]=4 240 B12R1.1 CCCOCc1ccc(cn1)Br 49b2165de8bf470f908d401448c5b410 [1,1,0,0,0,0|2,0,0]=4 241 B12R1.1 CCCOCc1ccc(cn1)C ff405956dedef2634c60e1436e98f714 [1,1,0,0,0,0|2,0,0]=4 242 B12R1.1 CCCOCc1ccc(cn1)Cl 73222df82ad400a79f3ed27e070a7524 [1,1,0,0,0,0|2,0,0]=4 243 B12R1.1 CCCOCc1ccc(cn1)F 47efbedbe7a90cd69d4a967f412f2768 [1,1,0,0,0,0|2,0,0]=4 244 B12R1.1 CCCOCc1ccc(cn1)I 4983eead99cd391642e4ce62b61f7868 [1,1,0,0,0,0|2,0,0]=4 245 B12R1.1 CCCOCc1ccc(nn1)C ed25fade6d9775b87727b3b66a9b1147 [1,1,0,0,0,0|1,0,1]=4 246 B12R1.1 CCCOCc1ccc(nn1)Cl 07459d9f96943120393825313b4b491d [1,1,0,0,0,0|1,0,1]=4 247 B12R1.1 CCNCCc1ccc(cn1)Br 071a48b22deb6b821a1caa4a94f022f3 [1,1,0,0,0,0|2,0,0]=4 248 B12R1.1 CCOCCc1ccc(cn1)Br 4da8f1abec1823983ba9123c240ed526 [1,1,0,0,0,0|2,0,0]=4 249 B12R1.1 CCOCCc1ccc(cn1)C f8bfa9a6b9c5cf25e679ebe20d4c34d1 [1,1,0,0,0,0|2,0,0]=4 250 B12R1.1 CCOCCc1ccc(cn1)F 3104047a4d03b030dadc14553fe02c80 [1,1,0,0,0,0|2,0,0]=4 251 B12R1.1 CCOCNc1ccc(=O)[nH]c1 ab09dfacfd46837650b475c3da1497ba [1,1,0,0,0,0|2,0,0]=4 252 B12R1.1 COCCNc1ccc(=O)[nH]c1 2658be545f60feb81fc0fe240399c7b2 [1,1,0,0,0,0|2,0,0]=4 253 B12R1.1 COCNCc1ccc(=O)[nH]c1 966504355f5007bd365d9a0bdf28b307 [1,1,0,0,0,0|2,0,0]=4 254 B12R1.1 CSCCNc1ccc(=O)[nH]c1 9af7033f4814fd940ab7ea17dd876142 [1,1,0,0,0,0|2,0,0]=4 255 B12R1.1 CSCNCc1ccc(=O)[nH]c1 92a09b479c77a6eae01f81079c0ef138 [1,1,0,0,0,0|2,0,0]=4 256 B12R1.1 O=c1ccc(c[nH]1)CNCCF 6b7f01075cc2fea94dddadb847acaf49 [1,1,0,0,0,0|2,0,0]=4 257 B12R1.1 O=c1ccc(c[nH]1)CNCCO 5a5862cd1c1c50a6b9b465493ed9e6b2 [1,1,0,0,0,0|2,0,0]=4 258 B12R1.1 O=c1ccc(c[nH]1)CNCCS 683445d43eb3b37537088b9a5c24aad8 [1,1,0,0,0,0|2,0,0]=4 259 B12R1.1 O=c1ccc(c[nH]1)NCCCF 0fe5162299d1b56fadd2158d4fbd9c07 [1,1,0,0,0,0|2,0,0]=4 260 B12R1.1 O=c1ccc(c[nH]1)NCCCO a9d30e2ce9b72f3e8ae229ea9e207ded [1,1,0,0,0,0|2,0,0]=4 261 B12R1.1 O=c1ccc(c[nH]1)NCCCS b78ab7885372e936061fb55c5427e517 [1,1,0,0,0,0|2,0,0]=4 262 B12R1.1 O=c1ccc(n[nH]1)NCCCCl 477f00b1b9904fb201b5a7014056ddce [1,1,0,0,0,0|1,0,0]=3 263 B12R1.1 O=c1ccc(n[nH]1)NCCCO d9161ec897215a964d64786935a63408 [1,1,0,0,0,0|1,0,0]=3 264 B12R1.21 CC(C)CNc1ccc(=O)[nH]c1 3970684279a6ee0105700d3d18cb6e83 [1,1,0,0,0,0|2,0,0]=4 265 B12R1.21 CC(C)NCc1ccc(=O)[nH]c1 f5fff734176dc5499671c9909abad5b3 [1,1,0,0,0,0|2,0,0]=4 266 B12R1.21 CC(O)CNc1ccc(=O)[nH]c1 fe0ef9f5074b82f8f95ef30bad6eaaec [1,1,0,0,0,0|2,0,0]=4 267 B12R1.21 C[C@H](O)CNc1ccc(=O)[nH]c1 3af6b84894ad5bd91e3770aa97cb289c [1,1,0,0,0,0|2,0,0]=4 268 B12R1.49 CCC(C)Nc1ccc(=O)[nH]c1 9c3a051318b69b42c506acf71baaab78 [1,1,0,0,0,0|2,0,0]=4 269 B12R1.69 CCCNc1ccc(=O)[nH]c1C d2a9b1b11c3872de566844db9afbaac9 [1,1,0,0,0,0|2,0,0]=4 270 B12R1.69 CCCNc1ccc(=O)[nH]c1Cl 16c5def1eb9a402424dd8229002d945c [1,1,0,0,0,0|2,0,0]=4 271 B12R1.69 CCCNc1n[nH]c(=O)[nH]c1=O c1c0f42c1d647ea5a4a8ac3c27d48004 [1,1,0,0,0,0|2,0,0]=4 272 B12R1.71 CCCNc1ccc(cn1)C=O 8ebe3d89a4a30df4106f6d3cdca4ca46 [1,1,0,0,0,0|2,0,0]=4 273 B12R1.71 CCCNc1ccc(nn1)C=O cbd6b9dd2bbbe8976b2c2c86346157de [1,1,0,0,0,0|1,0,1]=4 274 B12R1.71 CCCOc1ccc(cn1)C=O 4bd15a674df01e5246ae9320c2634007 [1,1,0,0,0,0|2,0,0]=4 275 B12R1.71 CCCOc1ccc(nn1)C=O b8e01f5b27d1348b21eac7e30bbee13d [1,1,0,0,0,0|1,0,1]=4 276 B12R1.28 CCCCNc1cc(ccn1)Br 3ce8e9f067c3a96b8cf9dbb1309fc04e [1,1,0,0,0,0|2,0,0]=4 277 B12R1.28 CCCCNc1cc(ccn1)C df22b9236c0d0914a12a55dc7c64c005 [1,1,0,0,0,0|2,0,0]=4 278 B12R1.28 CCCCNc1cc(ccn1)Cl cffab7d82e3b95857c958e6281b555d3 [1,1,0,0,0,0|2,0,0]=4 279 B12R1.28 CCCCNc1cc(ccn1)F 76d962442661bbd03d8a1a7a4e1b4df8 [1,1,0,0,0,0|2,0,0]=4 280 B12R1.28 CCCCNc1cc(ccn1)I 59ce12897e7090fd85fc4dfb96fddf31 [1,1,0,0,0,0|2,0,0]=4 281 B12R1.28 CCCCNc1cc(cnn1)Br 846a58d7c7ac21bf8aa4e579e740e721 [1,1,0,0,0,0|1,0,1]=4 282 B12R1.28 CCCCNc1cc(cnn1)C eca325fd8872164d7241954bcc558e62 [1,1,0,0,0,0|1,0,1]=4 283 B12R1.28 CCCCNc1cc(cnn1)Cl 797c0b4d06bcbed6e4170222ad28a87b [1,1,0,0,0,0|1,0,1]=4 284 B12R1.28 CCCCOc1cc(ccn1)Br 127a4e24d70a2e56fe8dba38ab0d7418 [1,1,0,0,0,0|2,0,0]=4 285 B12R1.28 CCCCOc1cc(ccn1)C a277689bb0c81dba2c426460cd5c464b [1,1,0,0,0,0|2,0,0]=4 286 B12R1.28 CCCCOc1cc(ccn1)Cl 56a40f70abea0a64471fae4dba24fb5e [1,1,0,0,0,0|2,0,0]=4 287 B12R1.28 CCCCOc1cc(ccn1)F 7b3ecf9ab860ac39a00f40bc9043bf42 [1,1,0,0,0,0|2,0,0]=4 288 B12R1.28 CCCNCc1cc(ccn1)Br 62b70cd570592b04505bcfacfa76c0a8 [1,1,0,0,0,0|2,0,0]=4 289 B12R1.28 CCCNCc1cc(ccn1)C 8f64567856c5a6b9541eee6863b3acf3 [1,1,0,0,0,0|2,0,0]=4 290 B12R1.28 CCCNCc1cc(ccn1)Cl 33d38006b2776043cf75acff3a96c3bc [1,1,0,0,0,0|2,0,0]=4 291 B12R1.28 CCCOCc1cc(ccn1)Br 55b245978a87266e978cf80fd37b8760 [1,1,0,0,0,0|2,0,0]=4 292 B12R1.28 CCCOCc1cc(ccn1)C 437e02001d74ccffa20b468cf3b27583 [1,1,0,0,0,0|2,0,0]=4 293 B12R1.28 CCCOCc1cc(ccn1)Cl 57147ac72f315e193a33357e27e37a83 [1,1,0,0,0,0|2,0,0]=4 294 B12R1.28 CCCOCc1cc(ccn1)F 8858345998cbadf17293c5f4134b7123 [1,1,0,0,0,0|2,0,0]=4 295 B12R1.28 CCCOCc1cc(ccn1)I 52a63e2452a5d464627ee845ec55bee8 [1,1,0,0,0,0|2,0,0]=4 296 B12R1.28 CCCOCc1cc(cnn1)C 2cd9786e699b5106054a0ec7469015db [1,1,0,0,0,0|1,0,1]=4 297 B12R1.28 CCOCCc1cc(ccn1)Br 9443eaadded1848b1ec48a92121d84d2 [1,1,0,0,0,0|2,0,0]=4 298 B12R1.28 COCCNc1cc(ccn1)O 7e7b9aa81faf890f17c56e59f494936e [1,1,0,0,0,0|2,0,0]=4 299 B12R1.382 CCCNc1cc(ccn1)CO 345686f8f7fc4193c3d54f5473476781 [1,1,0,0,0,0|2,0,0]=4 300 B12R1.382 CCCNc1cc(ccn1)OC 109be477e841414d52336a19ae0bae83 [1,1,0,0,0,0|2,0,0]=4 301 B12R1.382 CCCNc1cc(cnn1)OC 9c43568ede7ab9ede8a80a6d1a768419 [1,1,0,0,0,0|1,0,1]=4 302 B12R1.382 CCCOc1cc(ccn1)OC 6235bfb7a2a1b7b35b44ea0467bed6c5 [1,1,0,0,0,0|2,0,0]=4 303 B12R1.382 CCNCc1cc(ccn1)OC d66630da3eaf0a7b104d68f4dcd9a532 [1,1,0,0,0,0|2,0,0]=4 304 B12R1.382 CCOCc1cc(ccn1)OC e5477ac001cefe59a71bbf2e8cf87f9b [1,1,0,0,0,0|2,0,0]=4 305 B12R1.382 CCOCc1cc(cnn1)OC 280cbe2cdee4346d413db9f0a921b190 [1,1,0,0,0,0|1,0,1]=4 306 B12R1.527 CCCCNc1n[nH]c(c1Br)C 69cec26108e92107ac6c74f19bf17ee9 [0,1,0,0,1,0|2,0,0]=4 307 B12R1.527 CCCCNc1n[nH]c(c1C)Br a3a874348d403c930e27424be31765ba [0,1,0,0,1,0|2,0,0]=4 308 B12R1.527 CCCCNc1n[nH]c(c1Cl)C 3e3a2e80986523b90393ede4e19deeb8 [0,1,0,0,1,0|2,0,0]=4 309 B12R1.527 CCCCOc1n[nH]c(c1Cl)C b0899ca1af26d52f5c3e7ebfcc7ca8c0 [0,1,0,0,1,0|2,0,0]=4 310 B12R1.527 CCCOCc1n[nH]c(=O)n1C 14374443b5d4223d1ae674e6d6c7488c [0,1,0,0,1,0|2,0,0]=4 311 B12R1.527 CCCOCc1n[nH]c(c1F)C 7987db9ba319696097a83b459b127847 [0,1,0,0,1,0|2,0,0]=4 312 B14R1.61 CCCCNc1cc(c(=O)n(c1)C)Br e561b1d65088c402be522892cf944dfd [0,2,0,0,0,0|2,0,0]=4 313 B14R1.61 CCCCNc1cc(c(=O)n(c1)C)C 51a4fc549d88eb51b1008b111c7173d9 [0,2,0,0,0,0|2,0,0]=4 314 B14R1.61 CCCCNc1cc(c(=O)n(c1)C)Cl a098e050797466b500db9132a2a7a22a [0,2,0,0,0,0|2,0,0]=4 315 B14R1.61 CCCCNc1cc(c(=O)n(c1)C)F 057c238dc441838c7ee44a8ab81a6778 [0,2,0,0,0,0|2,0,0]=4 316 B14R1.61 CCCCNc1cc(c(=O)n(n1)C)C 6c103b5f5041e61d9ef772c68afb1b5f [0,2,0,0,0,0|1,0,0]=3 317 B14R1.61 COCCNc1cc(c(=O)n(n1)C)C 7b990347925e3e995725d5bbb5101ebd [0,2,0,0,0,0|2,0,0]=4 318 B14R1.61 CSCCNc1cc(c(=O)n(n1)C)C 8e885307dd160da4c246b2a6cd33179f [0,2,0,0,0,0|2,0,0]=4 319 B14R1.61 Cc1cc(nn(c1=O)C)NCCCCl 9008c743127e935208ebbf285c3e06e3 [0,2,0,0,0,0|2,0,0]=4 320 B14R1.61 Cc1cc(nn(c1=O)C)NCCCO d67ca990046a041b0fa53efd2ce98b11 [0,2,0,0,0,0|2,0,0]=4 321 B14R1.708 CCC(C)Nc1cc(c(=O)n(n1)C)C 4c956775b454db3649af28eda3c4c512 [0,2,0,0,0,0|2,0,0]=4 322 B14R1.708 CC[C@@H](C)Nc1cc(c(=O)n(n1)C)C c9e1bd744e998f2cde9b705dbf32e68a [0,2,0,0,0,0|2,0,0]=4 323 B14R1.708 CC[C@H](C)Nc1cc(c(=O)n(n1)C)C e106483a11410d263d30bf9583f809a7 [0,2,0,0,0,0|2,0,0]=4 324 B14R1.6821 CCCN(C)c1cc(c(=O)n(n1)C)C 344c00e1ce70aef051ac7e5e367f110f [0,2,0,0,0,0|2,0,0]=4 325 B14R1.15552 Cc1cc(nn(c1=O)C)NCC(C)C b55bd22fba0314145215b43d5830fc6e [0,2,0,0,0,0|2,0,0]=4 326 B14R1.15552 Cc1cc(nn(c1=O)C)NCC(C)O 4d6b105ac04ab47d506a9f0225c702e4 [0,2,0,0,0,0|2,0,0]=4 327 B14R1.15552 Cc1cc(nn(c1=O)C)NC[C@@H](C)O 5880ae61e507133ada24be5ca4e06de5 [0,2,0,0,0,0|2,0,0]=4 328 B14R1.15552 Cc1cc(nn(c1=O)C)NC[C@H](C)O d6596bdc67528031b2f9dd8a8027e7f9 [0,2,0,0,0,0|2,0,0]=4 329 B14R1.907 CCCCNc1cc(c(cn1)Br)CO 06802c99415d7ad3b75c9b961f118fd7 [0,2,0,0,0,0|2,0,0]=4 330 B14R1.907 CCCCNc1cc(c(cn1)Br)OC 18855a25c7990fea02bd835dab48ad90 [0,2,0,0,0,0|2,0,0]=4 331 B14R1.907 CCCCNc1cc(c(cn1)C)OC 80b4fd135fec0bf15cbee568b7ddbcab [0,2,0,0,0,0|2,0,0]=4 332 B14R1.907 CCCCNc1cc(c(cn1)Cl)OC 5c4e3297748dc01dfc58b38e4fbca30c [0,2,0,0,0,0|2,0,0]=4 333 B14R1.907 CCCCNc1cc(c(cn1)I)OC c7f6d700cad1c4eddd7870a998339bd4 [0,2,0,0,0,0|2,0,0]=4 334 B14R1.907 CCCCOc1cc(c(cn1)Cl)OC eac065866d6e134adeb58e1523eb601e [0,2,0,0,0,0|2,0,0]=4 335 B14R1.907 CCCOCc1cc(c(cn1)Br)OC 0909f990ad92db5abc0bcd6c1a9a793c [0,2,0,0,0,0|2,0,0]=4 336 B14R1.909 CCCCNc1ccc(c(c1)O)C=O 9f25673736016a97da861b89be802939 [0,2,0,0,0,0|2,0,0]=4 337 B14R1.909 CCCCNc1cnc(c(c1)O)C=O f9c7d420ae81ab368f6113ae2d8ff1fa [0,2,0,0,0,0|1,0,1]=4 338 B14R1.232 CCCCCNc1cc(c(=O)[nH]n1)C e069fe341e98bde367f97f3db78289ae [0,2,0,0,0,0|1,0,0]=3 339 B14R1.232 CCOCCNc1c[nH]c(=O)c(c1)F d23c1c0f1e56a82318f989a7269b7d7b [0,2,0,0,0,0|2,0,0]=4 340 B14R1.232 COCCCNc1c[nH]c(=O)c(c1)F 5eb3da290e8a4b0b7f7f2c30ea1e3612 [0,2,0,0,0,0|2,0,0]=4 341 B14R1.232 COCCCNc1cc(c(=O)[nH]n1)C ed8db5733cdcb24cdf754c2a592c9710 [0,2,0,0,0,0|1,0,0]=3 342 B14R1.232 O=c1[nH]cc(cc1F)NCCCCCl 21153561704d1b3534c684f55cfb74e9 [0,2,0,0,0,0|2,0,0]=4 343 B14R1.687 Cc1cc(n[nH]c1=O)NCCS(=O)C 643187ecc2b03417621886b4411f07e4 [0,2,0,0,0,0|2,0,0]=4 344 B12R1.27 C=CC(=O)NCC1=CCCCC1 28082ed0903988688ca05bfababfa9c8 [0,0,1,1,0,0|2,0,0]=4 345 B12R1.27 O=C(CO)NCC1=CCCCC1 9144f9f47549d8c75190e17781377f8e [0,0,1,1,0,0|1,0,1]=4 346 B12R1.27 O=CC(=O)NCC1=CCCCC1 2017a43ec1c567233adb21d171f93366 [0,0,1,1,0,0|1,0,1]=4 347 B12R2.294 O=c1ccc(c[nH]1)NC2CC2 33be8a87d3f12fed44c542b3313058ad [1,0,0,1,0,0|2,0,0]=4 348 B14R2.23185 Cc1cc(nn(c1=O)C)NC2CC2 f81bcee60ff4175aab12a6753031369a [0,1,0,1,0,0|2,0,0]=4 349 B10R1.16 CCCNc1cc(=O)[nH]o1 5fa93b769c1ecc30b2f5ef33a751badd [1,0,0,0,1,0|2,0,0]=4 350 B10R1.16 CCCNc1cc([nH]n1)Br 9cd4c7665ed0b0e9c93662115e2ba177 [1,0,0,0,1,0|2,0,0]=4 351 B10R1.16 CCCNc1cc([nH]n1)C 281e10b2a5dc5893b2acee5ef3a90588 [1,0,0,0,1,0|2,0,0]=4 352 B10R1.16 CCCNc1cc([nH]n1)F e74d872c4ce14591f6c3df1e2b9313e5 [1,0,0,0,1,0|2,0,0]=4 353 B10R1.16 CCCNc1n[nH]c(=O)[nH]1 e90e93ddb106f9c84dd4b96fe23a98be [1,0,0,0,1,0|2,0,0]=4 354 B10R1.16 CCCOC1=CC(=O)NC1 569531b643bfafeec4dbbf8109f7ba8e [1,0,0,0,1,0|2,0,0]=4 355 B10R1.16 CCNCc1cc(=O)[nH]o1 9b4aa905fe627bee9bd7f4092be7060a [1,0,0,0,1,0|2,0,0]=4 356 B10R1.29 CCCNc1n[nH]cc1Br aa1542756946ac5e4e902f628a811ee1 [1,0,0,0,1,0|2,0,0]=4 357 B10R1.29 CCCNc1n[nH]cc1C dade50dda9de4696e07b83ae74c7f8c3 [1,0,0,0,1,0|2,0,0]=4 358 B10R1.29 CCCNc1n[nH]cc1Cl c92b982fb49468ee0bdb7960ffa019e0 [1,0,0,0,1,0|2,0,0]=4 359 B10R1.29 CCCNc1n[nH]cc1I e338b6f408be9908fdecfd450ae77b60 [1,0,0,0,1,0|2,0,0]=4 360 B10R1.29 CCCNc1n[nH]cc1N b394efa40976e99c36fe275a7133aa4f [1,0,0,0,1,0|2,0,0]=4 361 B10R1.29 CCCOc1n[nH]cc1C 968e4442fe891e655847abf1422385b2 [1,0,0,0,1,0|2,0,0]=4 362 B10R1.29 CCOCc1n[nH]cc1C e9aefe8636d2a4db6f2c2fc59a41815d [1,0,0,0,1,0|2,0,0]=4