0 B13R1.3972 CCNc1c(ccc(c1Br)C)CO 44f343abc6ddeda1376a65d4e5680f73 [0,1,0,0,0,0|3,0,0]=4 1 B13R1.3972 Cc1ccc(c(c1Br)NCF)CO 673826289f90c8c59eec016785989583 [0,1,0,0,0,0|3,0,0]=4 2 B13R1.3972 Cc1ccc(c(c1Br)NCO)CO 635a44a857b06f10d0b17ebd054881ba [0,1,0,0,0,0|2,0,0]=3 3 B13R1.3972 OCNc1c(ccc(c1F)F)CO 45e77d24230ae40ad048adbf70d832ef [0,1,0,0,0,0|3,0,0]=4 4 B12R1.112 CCNc1ccc(cc1CO)C 68f0ede8aec6979002e37b5db5210efe [1,1,0,0,0,0|2,0,0]=4 5 B12R1.112 CCNc1cnc(cc1CO)Br 084ea45985f9a99b94e4a60550f49723 [1,1,0,0,0,0|2,0,0]=4 6 B12R1.112 CCc1cc(ncc1NCO)Br b738d0b7d7e55b68497a5d701c771991 [1,1,0,0,0,0|2,0,0]=4 7 B12R1.112 CCc1cc(ncc1NCO)Cl a169e5f1ff3d6199935e618ddc2e67d1 [1,1,0,0,0,0|2,0,0]=4 8 B12R1.112 Cc1ccc(c(c1)CO)NCF 360486b2bd35b7099ad5853453d2ad0a [1,1,0,0,0,0|2,0,0]=4 9 B12R1.112 Cc1ccc(c(c1)CO)NCO 417d8d9affd3bd04390e3751dfdff8f3 [1,1,0,0,0,0|1,0,0]=3 10 B12R1.112 Cc1ccc(c(n1)CO)NCO e96ba350107873b59daa308a085f715a [1,1,0,0,0,0|2,0,0]=4 11 B12R1.112 OCNc1ccc(cc1CO)Br dbc1adfd944a56a6803be1ca7689a9ee [1,1,0,0,0,0|2,0,0]=4 12 B12R1.112 OCNc1ccc(cc1CO)Cl 85c371839f3932042a2711416d1638dd [1,1,0,0,0,0|2,0,0]=4 13 B12R1.112 OCNc1ccc(cc1CO)F e53a2b2eff9613ac6155bac0709e5053 [1,1,0,0,0,0|2,0,0]=4 14 B12R1.112 OCNc1ccc(cc1CO)I 757bfca6b5e8fca1fc96e0856503d095 [1,1,0,0,0,0|2,0,0]=4 15 B12R1.112 OCNc1cnc(cc1CO)Br 593c2176ce6663bae2c2d7ff546ff20b [1,1,0,0,0,0|1,0,0]=3 16 B12R1.112 OCc1cc(ncc1NCF)Br 6a3e5dbaeae7d0c22eb56d08e99589d4 [1,1,0,0,0,0|2,0,0]=4 17 B12R1.268 CCNc1cc(ccc1CO)C 9f3b58d17e62958ab70317b0f9b3499e [1,1,0,0,0,0|2,0,0]=4 18 B12R1.268 CCNc1cc(ncc1CO)C c9bbda0c89ff2f9629a9c79705b0ab15 [1,1,0,0,0,0|1,0,0]=3 19 B12R1.268 CCNc1cc(ncc1CO)Cl a7c539895ab659f99c4d787440edf615 [1,1,0,0,0,0|2,0,0]=4 20 B12R1.268 CCNc1nc(ncc1CO)C b2a3a42e34f29736cdfb7a837ea82a7b [1,1,0,0,0,0|2,0,0]=4 21 B12R1.268 Cc1cc(c(cn1)CO)NC=O 22066fa24340c15b8b14ab4edeca5f52 [1,1,0,0,0,0|0,0,2]=4 22 B12R1.268 Cc1cc(c(cn1)CO)NCF 0275f40d689c7ef8b4d94d22d44dacfb [1,1,0,0,0,0|1,0,0]=3 23 B12R1.268 Cc1cc(c(cn1)CO)NCO 0c7c5035bd71771ddca77320c8328119 [1,1,0,0,0,0|0,0,0]=2 24 B12R1.268 Cc1ccc(c(c1)NCF)CO 4a2fd080dd8f9fa496ab24afef58e447 [1,1,0,0,0,0|2,0,0]=4 25 B12R1.268 Cc1ccc(c(c1)NCO)CO 2bbd2ee41438e2fefc07880a90d49e83 [1,1,0,0,0,0|1,0,0]=3 26 B12R1.268 Cc1ncc(c(n1)NCF)CO 5789c1385ed980e133ef20985d5227b4 [1,1,0,0,0,0|2,0,0]=4 27 B12R1.268 Cc1ncc(c(n1)NCO)CO 4de1323c4380d7adfadebe6aaa4461a5 [1,1,0,0,0,0|1,0,0]=3 28 B12R1.268 OCNc1cc(ccc1CO)Br a13d9bb55aea43a4e01a246e99a975d9 [1,1,0,0,0,0|2,0,0]=4 29 B12R1.268 OCNc1cc(ccc1CO)Cl 99b243f38593b8c8410a2bc0bce2108d [1,1,0,0,0,0|2,0,0]=4 30 B12R1.268 OCNc1cc(ccc1CO)F 0a299db54bc6e268f28731570bf8c040 [1,1,0,0,0,0|2,0,0]=4 31 B12R1.268 OCNc1cc(ncc1CO)Cl edf812d9a1b3f02330d228c4aca35615 [1,1,0,0,0,0|1,0,0]=3 32 B12R1.268 OCNc1nc(ncc1CO)Cl bdb2d5aaf0cfcdf72b59a25f4bdd443d [1,1,0,0,0,0|2,0,0]=4 33 B12R1.268 OCc1cnc(cc1NCF)Cl 783c584a4dd539ed01b85f55fa834706 [1,1,0,0,0,0|2,0,0]=4 34 B12R1.497 Cc1ccc(c(c1Br)NCO)C 76cac3b07925445874483b547b808731 [1,1,0,0,0,0|2,0,0]=4 35 B12R1.497 Cc1ccc(c(c1C)NCO)C c5defb54e4528dca54e5352afdc478da [1,1,0,0,0,0|2,0,0]=4 36 B12R1.497 Cc1cnc(c(c1NCO)Br)Cl 70a88406cfc52b154014b9ff2298a136 [1,1,0,0,0,0|2,0,0]=4 37 B12R1.497 Cc1ncc(c(c1Br)NCO)Br aaa6a3b80d840fa196edc4fd30e8de3c [1,1,0,0,0,0|2,0,0]=4 38 B12R1.497 Cc1ncc(c(c1Cl)NCO)Cl 0fdda957276b7a549ae5cc8437c11725 [1,1,0,0,0,0|2,0,0]=4 39 B12R1.497 Cc1ncc(c(c1I)NCO)I 0caeb99a152f75925628b0bb70b9576d [1,1,0,0,0,0|2,0,0]=4 40 B12R1.542 Cc1cccc(c1CO)NCO efe80c77b2394eddba921126ff198af0 [1,1,0,0,0,0|2,0,0]=4 41 B12R1.542 OCNc1cccc(c1CO)Cl df53d6609ea4a6b3a70775864333cb1c [1,1,0,0,0,0|2,0,0]=4 42 B12R1.542 OCNc1cccc(c1CO)F aecfeedaa18aa40a415d96c2b64534c0 [1,1,0,0,0,0|2,0,0]=4 43 B12R1.1112 CCNc1c(cncc1CO)Br 2deba7d9ca27d15f4116733a84f1fbc6 [1,1,0,0,0,0|2,0,0]=4 44 B12R1.1112 CCNc1c(cncc1CO)F 473b7f1616e7446e2cf37b7cf0f886b7 [1,1,0,0,0,0|2,0,0]=4 45 B12R1.1112 Cc1cccc(c1NCO)CO 99073ea83b9e5dcdcd9d80f08b34ae72 [1,1,0,0,0,0|2,0,0]=4 46 B12R1.1112 OCNc1c(cccc1CO)Br 72c86ab8d077549083d920737e022e5f [1,1,0,0,0,0|2,0,0]=4 47 B12R1.1112 OCNc1c(cccc1CO)Cl 9ef50196c70ce0c219fbb65360faae4f [1,1,0,0,0,0|2,0,0]=4 48 B12R1.1112 OCNc1c(cccc1CO)F cf125f78b2efd7050eec553b3b05a9e6 [1,1,0,0,0,0|2,0,0]=4 49 B12R1.1112 OCNc1c(cncc1CO)Br cf0bfcd6d94aad47b9e86dff505db50c [1,1,0,0,0,0|1,0,0]=3 50 B12R1.1112 OCNc1c(cncc1CO)F eb47422c89528107a092cae810d15b30 [1,1,0,0,0,0|1,0,0]=3 51 B12R1.1112 OCc1cncc(c1NCF)Br ac8c779a5ab84159dd2cbf9ddd8b4113 [1,1,0,0,0,0|2,0,0]=4 52 B12R1.1112 OCc1cncc(c1NCF)F c10f108c9985032c11da55d39b1858d1 [1,1,0,0,0,0|2,0,0]=4 53 B12R1.544 CCNc1cnc(c(c1C)Br)C eb952edaf94c6ff75d323ff214c6278e [1,1,0,0,0,0|2,0,0]=4 54 B12R1.544 Cc1c(cnc(c1Br)Cl)NCO 586041fa75be5de0c51e8f72bf42f8db [1,1,0,0,0,0|2,0,0]=4 55 B12R1.544 Cc1c(cnc(c1Cl)Br)NCO 6fbdb11f170c68c9c56d0d67619fd6d0 [1,1,0,0,0,0|2,0,0]=4 56 B12R1.544 Cc1ccc(c(c1Br)C)NCO b80ecbf124e6b17a1b5d86d12a737239 [1,1,0,0,0,0|2,0,0]=4 57 B12R1.544 Cc1ccc(c(c1C)C)NCO 94663b56b4e531fb299a4288eedc894a [1,1,0,0,0,0|2,0,0]=4 58 B12R1.544 Cc1ccc(c(c1Cl)C)NCO 5d6fa3e35272113cbe861b687a2984f6 [1,1,0,0,0,0|2,0,0]=4 59 B12R1.544 Cc1ccc(c(c1I)C)NCO 440a8ea919d2c4cba48e1aeff205b8d3 [1,1,0,0,0,0|2,0,0]=4 60 B12R1.544 Cc1ncc(c(c1Br)C)NCF 1b24a41429ae5657e9993254d515119f [1,1,0,0,0,0|2,0,0]=4 61 B12R1.544 Cc1ncc(c(c1Br)C)NCO ff72b21c99c21717db0d964333f3affc [1,1,0,0,0,0|1,0,0]=3 62 B14R1.1360 Cc1ccc(c(c1F)CO)NCCO 896720bad71c28147f55685520485ab0 [0,2,0,0,0,0|2,0,0]=4 63 B14R1.5210 COc1ccc(c(c1F)CO)NCO a4d88ad315605ab5ef9021a315b83efe [0,2,0,0,0,0|2,0,0]=4 64 B14R1.7434 COCNc1c(ccc(c1Br)C)CO b349bfd8b679bdaeb1b3390e2e930260 [0,2,0,0,0,0|2,0,0]=4 65 B14R1.7434 Cc1ccc(c(c1Br)NCCO)CO c588c80327dda3390dd1dd42b06149db [0,2,0,0,0,0|2,0,0]=4 66 B14R1.7434 Cc1ccc(c(c1C)NCCO)CO 78db6df6e880bb38e5ac46f36d6788f2 [0,2,0,0,0,0|2,0,0]=4 67 B14R1.7434 Cc1ncc(c(c1O)CNC=O)CO 882da8fa4c58f1fb657acc8d5074c94e [0,2,0,0,0,0|0,0,1]=3