0 B11R1.12 CCN(C#N)c1ccccc1 0a33bcc251eace95a09e2548bafab86c [0,0,0,0,0,0|2,0,2]=4 1 B11R1.12 CCN(C=O)c1ccccc1 da6bb0dc53f1d66135131d66e3bbe341 [0,0,0,0,0,0|1,0,1]=2 2 B11R1.12 CCN(C=O)c1ccccn1 37ec100e83e1f6ae17d6e3d5e7e2efcf [0,0,0,0,0,0|2,0,1]=3 3 B11R1.12 CCN(C=O)c1cccnc1 480f2644a238345f8cb34be867d4aca8 [0,0,0,0,0,0|2,0,1]=3 4 B11R1.12 CCN(C=O)c1cccnn1 bc5719b16cc7ecd03429b0711c320eb4 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.12 CCN(C=O)c1ccncc1 509a741e45cf3609202d1982e0d164de [0,0,0,0,0,0|2,0,1]=3 6 B11R1.12 CCN(C=O)c1ccnnc1 fe3d76655349ae24f92703f860ee65b0 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.12 CCN(C=O)c1cnccn1 2106275e2d269f3c272150672947c57e [0,0,0,0,0,0|3,0,1]=4 8 B11R1.12 CCN(C=O)c1cncnc1 cd46d9bff73ae0e41def8003b3301e1e [0,0,0,0,0,0|3,0,1]=4 9 B11R1.12 CCN(CF)c1ccccc1 64bfdf9f1ec7c91dbb7909bf38760f4f [0,0,0,0,0,0|2,0,2]=4 10 B10R1.15 CCN(C)c1ccccc1 9cc6568b1f30abe04427bdea858da30e [1,0,0,0,0,0|1,0,2]=4 11 B10R1.15 CN(C=O)c1ccccn1 48011329103c524c4b63577b588cdb27 [1,0,0,0,0,0|2,0,0]=3 12 B10R1.15 CN(C=O)c1cccnc1 c200b85f739a703bfa35217d599e46e7 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.15 CN(C=O)c1cccnn1 bb6c9a4d3ed3a56597c0fa4d221ca30b [1,0,0,0,0,0|3,0,0]=4 14 B10R1.15 CN(C=O)c1ccncc1 9cc48dd486f2ee4c03255d677df658bd [1,0,0,0,0,0|2,0,0]=3 15 B10R1.15 CN(C=O)c1ccncn1 559e04860b4b657b48b2febe0788a499 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.15 CN(C=O)c1ccnnc1 e2ebf1a31d3d52b6cc6cfffa8c5ad13e [1,0,0,0,0,0|3,0,0]=4 17 B12R1.3 C#CCN(C=O)c1ccccc1 3fee30dff0acf9a3944a99cb8d7dc91b [0,1,0,0,0,0|1,0,2]=4 18 B12R1.3 C=CC(NC=O)c1ccccc1 39101a1d68dfb83652c8516ebaadcdea [0,1,0,0,0,0|0,0,2]=3 19 B12R1.3 C=CC(NCC)c1ccccc1 7683e9d7b82c3281238f04ed1a75e97e [0,1,0,0,0,0|1,0,2]=4 20 B12R1.3 C=CC(NCF)c1ccccc1 10ae09b5ad9c11712c1e0d307f5d7811 [0,1,0,0,0,0|2,0,1]=4 21 B12R1.3 C=CC(NCO)c1ccccc1 059bf4cd23c9defe529348afd9ac29e4 [0,1,0,0,0,0|2,0,1]=4 22 B12R1.3 C=CC(OCC)c1ccccc1 6bde42162b5d4c427a68bf4a10c8d095 [0,1,0,0,0,0|1,0,2]=4 23 B12R1.3 C=CC(OCF)c1ccccc1 5f73c1e6e0711249ad6cf93a7f337460 [0,1,0,0,0,0|2,0,1]=4 24 B12R1.3 C=CCN(C=O)c1cccnc1 5e279cda2cf12d361bcbc1892aeecc1e [0,1,0,0,0,0|2,0,1]=4 25 B12R1.3 C=CCN(CC)c1ccccc1 2bf94e98a6e871d2b0d4e7e5382e5a7a [0,1,0,0,0,0|2,0,1]=4 26 B12R1.3 C=C[C@@H](NC=O)c1ccccc1 2ecd6af102532c50616c1dfa6b247a68 [0,1,0,0,0,0|0,0,2]=3 27 B12R1.3 C=C[C@@H](NCC)c1ccccc1 ce0bccab84f78d550cd5d29e0af99881 [0,1,0,0,0,0|1,0,2]=4 28 B12R1.3 C=C[C@@H](NCF)c1ccccc1 87007f2d58a77127e300760fa39eaa08 [0,1,0,0,0,0|2,0,1]=4 29 B12R1.3 C=C[C@@H](NCO)c1ccccc1 0443a692877053ff1e1a5a26e535fa7f [0,1,0,0,0,0|2,0,1]=4 30 B12R1.3 C=C[C@H](NC=O)c1ccccc1 bb17988a70696eca8efb8f24034ca3c6 [0,1,0,0,0,0|0,0,2]=3 31 B12R1.3 C=C[C@H](NCC)c1ccccc1 378688aa1f70c0c46a994c0dd710e214 [0,1,0,0,0,0|1,0,2]=4 32 B12R1.3 C=C[C@H](NCF)c1ccccc1 4fe754d8498c752ef4b3c99157f3177d [0,1,0,0,0,0|2,0,1]=4 33 B12R1.3 C=C[C@H](NCO)c1ccccc1 971121604f82db695e04bc0173604a06 [0,1,0,0,0,0|2,0,1]=4 34 B12R1.3 CCC(NC=O)c1ccccc1 f35c5a1e32ab8921cb0fd5e08b4f1f33 [0,1,0,0,0,0|0,0,2]=3 35 B12R1.3 CCC(NC=O)c1ccccn1 6272c75f1bbad2ca3d2c655b19fffda8 [0,1,0,0,0,0|1,0,2]=4 36 B12R1.3 CCC(NC=O)c1cccnc1 87d0fe1dfb10c405e4ac398b90932d21 [0,1,0,0,0,0|1,0,2]=4 37 B12R1.3 CCC(NC=O)c1ccncc1 74d90ea3e225747ca3f33c9b625aca75 [0,1,0,0,0,0|1,0,2]=4 38 B12R1.3 CCCN(C=O)c1ccccc1 dd84a45c645f807d0c332ade8b13b5fc [0,1,0,0,0,0|1,0,1]=3 39 B12R1.3 CCN(CC=O)c1ccccc1 009c4a484e3ac4577aa247993a08c21a [0,1,0,0,0,0|1,0,1]=3 40 B12R1.3 CCN(CC=O)c1ccccn1 18b465d305577e43aa1e5dcf896670aa [0,1,0,0,0,0|2,0,1]=4 41 B12R1.3 CCN(CC=O)c1cccnc1 32efd6c0b5b0d40666e6f1dc4fc0b878 [0,1,0,0,0,0|2,0,1]=4 42 B12R1.3 CCN(CC=O)c1ccncc1 ff1640b3efef8260d87a381b97091d7a [0,1,0,0,0,0|2,0,1]=4 43 B12R1.3 CC[C@@H](NC=O)c1ccccc1 ebbf73246fa5e055d14598ff73ee74b9 [0,1,0,0,0,0|0,0,2]=3 44 B12R1.3 CC[C@@H](NC=O)c1ccccn1 d188ab4b3f12b054c0fc5e82fc46ec26 [0,1,0,0,0,0|1,0,2]=4 45 B12R1.3 CC[C@H](NC=O)c1ccccc1 5b95454d2846027c7fee198531e3fbcd [0,1,0,0,0,0|0,0,2]=3 46 B12R1.3 CC[C@H](NC=O)c1ccccn1 d55d33547e9d8ffcccd0a9a7b006993e [0,1,0,0,0,0|1,0,2]=4 47 B12R1.3 CC[C@H](NC=O)c1ccncc1 398e2a927c5757953e0464c5541e459b [0,1,0,0,0,0|1,0,2]=4 48 B12R1.3 N#CCN(C=O)c1ccccc1 506cbb3c502ce9098fc169fcf1b07da2 [0,1,0,0,0,0|1,0,2]=4 49 B12R1.3 N#CN(CC=O)c1ccccc1 4164fcc5462cfed288346440a09a127c [0,1,0,0,0,0|2,0,1]=4 50 B12R1.3 N#CNC(C=O)c1ccccc1 40cb884640f231bf51d3c969f91cc21b [0,1,0,0,0,0|1,0,2]=4 51 B12R1.3 O=CN(CCF)c1ccccc1 cecc898c90ae32628e1e22021418ffd8 [0,1,0,0,0,0|1,0,1]=3 52 B12R1.3 O=CN(CCO)c1ccccc1 2cfbca70005c73b7e0b1c55ae8b1e4cf [0,1,0,0,0,0|1,0,1]=3 53 B12R1.3 O=CN(CCO)c1ccccn1 fd4af6075fda05ac6ba4cf6dcc6f641d [0,1,0,0,0,0|2,0,1]=4 54 B12R1.3 O=CN(CCO)c1ccncc1 a46d4180101fea18f1923cd95ba425a2 [0,1,0,0,0,0|2,0,1]=4 55 B12R1.3 O=CNC(CO)c1ccccc1 eab85ec6bc58124fc0a34b21c2ead22e [0,1,0,0,0,0|1,0,2]=4 56 B12R1.3 O=CN[C@@H](CF)c1ccccc1 0ff261ab74fd1bb17f257b9fa0c61993 [0,1,0,0,0,0|1,0,2]=4 57 B12R1.3 O=CN[C@@H](CO)c1ccccc1 2914095b931483c8867faf13c06219d2 [0,1,0,0,0,0|1,0,2]=4 58 B12R1.3 O=CN[C@H](CO)c1ccccc1 5b2542d815db0af521344638e8200526 [0,1,0,0,0,0|1,0,2]=4 59 B12R1.12 CCN(C=O)c1ccc(cc1)Br a298ab7cad35aa1ec2d94ab133616023 [0,1,0,0,0,0|1,0,1]=3 60 B12R1.12 CCN(C=O)c1ccc(cc1)C eaf836ea6b842ec93e8182af29d7c16a [0,1,0,0,0,0|1,0,1]=3 61 B12R1.12 CCN(C=O)c1ccc(cc1)Cl 6d7f2c41f258ac2893043fece93c0214 [0,1,0,0,0,0|1,0,1]=3 62 B12R1.12 CCN(C=O)c1ccc(cc1)F 2859b23023e695a7ae2c4fbb44ca5434 [0,1,0,0,0,0|1,0,1]=3 63 B12R1.12 CCN(C=O)c1ccc(cc1)O d72c28d8849a639167bd91dd366b00c8 [0,1,0,0,0,0|1,0,1]=3 64 B12R1.12 CCN(C=O)c1ccc(cn1)Br 5295a889084867f50d4aef413e6dc10c [0,1,0,0,0,0|2,0,1]=4 65 B12R1.12 CCN(C=O)c1ccc(nc1)Cl 48fcda4929c59588e8145c50ca40ef85 [0,1,0,0,0,0|2,0,1]=4 66 B12R1.12 N#CN(C=O)c1ccc(cc1)Br 22435b6ea58e7e7b2c4cba0228448711 [0,1,0,0,0,0|2,0,1]=4 67 B12R1.13 CCN(C=O)c1cc(ccn1)C 199ffa12ba50927111b3e8c7cd3c38eb [0,1,0,0,0,0|2,0,1]=4 68 B12R1.13 CCN(C=O)c1cc(ccn1)Cl 69261c6160b764d455aaee67ed5690c3 [0,1,0,0,0,0|2,0,1]=4 69 B12R1.13 CCN(C=O)c1cccc(c1)Br b09102eb19d6ee0066ff9da9f16802ad [0,1,0,0,0,0|1,0,1]=3 70 B12R1.13 CCN(C=O)c1cccc(c1)C 66edc5dcca08cc518c8d4208c202e614 [0,1,0,0,0,0|1,0,1]=3 71 B12R1.13 CCN(C=O)c1cccc(c1)Cl f1280dfd687af0662c8c7fc9e5804186 [0,1,0,0,0,0|1,0,1]=3 72 B12R1.13 CCN(C=O)c1cccc(c1)F ad8cef72c1f5d6136c2febaf674d8a33 [0,1,0,0,0,0|1,0,1]=3 73 B12R1.13 CCN(C=O)c1cccc(c1)O c24e9df2171a902944c8ed7e8a9c39cb [0,1,0,0,0,0|1,0,1]=3 74 B12R1.13 CCN(C=O)c1cccc(n1)C d4685679c9a85f117a8010e0c1e9ea6f [0,1,0,0,0,0|2,0,1]=4 75 B12R1.13 N#CN(C=O)c1cccc(c1)Br 6e872f0105b6ade4a852e7007f8ecd24 [0,1,0,0,0,0|2,0,1]=4 76 B12R1.243 CCN(C=O)c1ccccc1Br 73f4c91f77b803e18289ea62f9f13e02 [0,1,0,0,0,0|1,0,1]=3 77 B12R1.243 CCN(C=O)c1ccccc1C 501349ea0d18ad0cf5fb9654d3271030 [0,1,0,0,0,0|1,0,1]=3 78 B12R1.243 CCN(C=O)c1ccccc1Cl fb9903b4c38df435792122a814bcd691 [0,1,0,0,0,0|1,0,1]=3 79 B12R1.243 CCN(C=O)c1ccccc1F c4fad30ba83c3c1c333ea47b8f9f6366 [0,1,0,0,0,0|1,0,1]=3 80 B12R1.243 CCN(C=O)c1ccccc1O 816b767689b3d33145efa1da1f0cf5f3 [0,1,0,0,0,0|1,0,1]=3 81 B12R1.243 CCN(C=O)c1ncccc1Br edbaa2f0c790e6974e7e02bde8909fd8 [0,1,0,0,0,0|2,0,1]=4 82 B12R1.478 CC(C)N(C=O)c1ccccn1 bf9e5e4b2ec097904780d85032eb08ab [0,1,0,0,0,0|2,0,1]=4 83 B12R1.478 CCN(C(=O)C)c1ccccn1 6b1b53f87ac82d1362da592fc9df66f0 [0,1,0,0,0,0|2,0,1]=4 84 B12R1.478 CCN(C(=O)C)c1cccnc1 9012d027ed000d64e84a067dc20ed86f [0,1,0,0,0,0|2,0,1]=4 85 B12R1.478 CCN(C(=O)C)c1ccncc1 ee96d08c388ee5d4c9fad0a9a5691897 [0,1,0,0,0,0|2,0,1]=4 86 B12R2.1 O=CN1CCc2c1cccc2 952fb58dcbced8913394c41c3e29378e [0,0,0,1,0,0|1,0,1]=3 87 B12R2.1 O=CN1CCc2c1cccn2 d2dcd13cafbd9713f3325443b770875f [0,0,0,1,0,0|2,0,1]=4 88 B12R2.1 O=CN1CCc2c1ccnc2 2e0b92775838ffc53aae45498b831cce [0,0,0,1,0,0|2,0,1]=4 89 B12R2.1 O=CN1CCc2c1cncc2 1b052413b23f1c3e48b9b6dcd0ea0849 [0,0,0,1,0,0|2,0,1]=4 90 B12R2.1 O=CN1CCc2c1nccc2 6d4df3c1b7ebbfc1a8390e263c834cd5 [0,0,0,1,0,0|2,0,1]=4 91 B12R2.2 c1cc(ccn1)c2cc[nH]c2 f5ebef512b12877556bee11f96bc2725 [0,0,0,1,0,0|2,0,1]=4 92 B12R2.2 c1cc(ccn1)c2ccoc2 b0f8583ab6d2ba17d7e413294cab564a [0,0,0,1,0,0|1,0,2]=4 93 B12R2.2 c1cc(ccn1)c2ccsc2 49a5d03965ca68bfedffb763fe361fcd [0,0,0,1,0,0|1,1,1]=4 94 B12R2.2 c1cc(ccn1)c2cn[nH]c2 b58212f3b0c25df7e4f5dc357f49c59e [0,0,0,1,0,0|3,0,0]=4 95 B12R2.2 c1cc(ccn1)c2cnoc2 7e4377323635cdca99cf8d7b27a54c88 [0,0,0,1,0,0|2,0,1]=4 96 B12R2.2 c1cc(ccn1)c2cnsc2 f0f42350ce9cb1a8b364155803990597 [0,0,0,1,0,0|2,1,0]=4 97 B12R2.2 c1ccc(cc1)c2c[nH]cn2 c4f52ead17ff341ae089332bd3fd6d99 [0,0,0,1,0,0|2,0,1]=4 98 B12R2.2 c1ccc(cc1)c2c[nH]nn2 a1fb77adff563490f1ed05e60137a346 [0,0,0,1,0,0|3,0,0]=4 99 B12R2.2 c1ccc(cc1)c2cc[nH]c2 8a1082d55b05930cd516c569b34285bf [0,0,0,1,0,0|1,0,1]=3 100 B12R2.2 c1ccc(cc1)c2cc[nH]n2 72e992508b1d4f2e5b527c318ff4b66c [0,0,0,1,0,0|2,0,1]=4 101 B12R2.2 c1ccc(cc1)c2ccc[nH]2 31571cc0c476cc0ec85253928e85f3d5 [0,0,0,1,0,0|2,0,1]=4 102 B12R2.2 c1ccc(cc1)c2ccco2 67d5bff31c39591a62f72fefb1796923 [0,0,0,1,0,0|2,0,1]=4 103 B12R2.2 c1ccc(cc1)c2cccs2 7e0ec9509785b0110be83131d3635968 [0,0,0,1,0,0|2,0,1]=4 104 B12R2.2 c1ccc(cc1)c2ccno2 43e56304d00da0163b84bc8aac75bf60 [0,0,0,1,0,0|2,0,1]=4 105 B12R2.2 c1ccc(cc1)c2ccns2 9fe01b29879878645a20197465a91c70 [0,0,0,1,0,0|2,0,1]=4 106 B12R2.2 c1ccc(cc1)c2ccoc2 943a3166e2c0d8deacea159f1af77584 [0,0,0,1,0,0|0,0,2]=3 107 B12R2.2 c1ccc(cc1)c2ccon2 f5a7154212377e56a115aa8bde828f0c [0,0,0,1,0,0|1,0,2]=4 108 B12R2.2 c1ccc(cc1)c2ccsc2 8abbaa963d5901294968ded92d9e7883 [0,0,0,1,0,0|0,1,1]=3 109 B12R2.2 c1ccc(cc1)c2ccsn2 7e2d66bdf520ba656a205b9b08fa770d [0,0,0,1,0,0|1,1,1]=4 110 B12R2.2 c1ccc(cc1)c2cn[nH]c2 be4a681aed3d612250a8a908fe0c61a6 [0,0,0,1,0,0|2,0,0]=3 111 B12R2.2 c1ccc(cc1)c2cnco2 2e69350309650d294610cdfd138ca5ee [0,0,0,1,0,0|2,0,1]=4 112 B12R2.2 c1ccc(cc1)c2cncs2 0159bbc9e5156efd8a149997d4a791d9 [0,0,0,1,0,0|2,0,1]=4 113 B12R2.2 c1ccc(cc1)c2cnns2 fb2b084bbd736371b3fd77a0d336210d [0,0,0,1,0,0|3,0,0]=4 114 B12R2.2 c1ccc(cc1)c2cnoc2 a10948557e486353e1e9efd1544a1b7a [0,0,0,1,0,0|1,0,1]=3 115 B12R2.2 c1ccc(cc1)c2cnsc2 23fa8ce39ce783d9d384a004da139025 [0,0,0,1,0,0|1,1,0]=3 116 B12R2.2 c1ccc(cc1)c2cnsn2 c0070606933b921c07cef0585421c520 [0,0,0,1,0,0|2,1,0]=4 117 B12R2.2 c1ccc(cc1)c2cocn2 42a4e4263f73296e3c97d861c51c0e74 [0,0,0,1,0,0|1,0,2]=4 118 B12R2.2 c1ccc(cc1)c2cscn2 60bfea8c8c18be7c457f7b8399613162 [0,0,0,1,0,0|1,1,1]=4 119 B12R2.2 c1ccc(cc1)c2csnn2 a396f2ede87df7a4dfd3c834750a19df [0,0,0,1,0,0|2,1,0]=4 120 B12R2.2 c1ccc(cc1)n2ccnc2 b5590a048e73d1452d700beebfdfe551 [0,0,0,1,0,0|2,0,1]=4 121 B12R2.2 c1ccc(nc1)c2cc[nH]c2 f74cf98293d9a4c3bbe1bf6c263d689e [0,0,0,1,0,0|2,0,1]=4 122 B12R2.2 c1ccc(nc1)c2ccoc2 78eb81bf60a9fc34410a89a0c45bf08b [0,0,0,1,0,0|1,0,2]=4 123 B12R2.2 c1ccc(nc1)c2ccsc2 1611da139dcb69724e7516cf2d0451ab [0,0,0,1,0,0|1,1,1]=4 124 B12R2.2 c1ccc(nc1)c2cn[nH]c2 d25882f503bb18af84cc2bafb03a071b [0,0,0,1,0,0|3,0,0]=4 125 B12R2.2 c1ccc(nc1)c2cnoc2 c044388a3c71783d837faa43c10f2487 [0,0,0,1,0,0|2,0,1]=4 126 B12R2.2 c1ccc(nc1)c2cnsc2 64a44f74af81a4fd495b22de94cc5e45 [0,0,0,1,0,0|2,1,0]=4 127 B12R2.2 c1cncc(c1)c2cc[nH]c2 6a3c9391f16de8c4db6df809d8f1a780 [0,0,0,1,0,0|2,0,1]=4 128 B12R2.2 c1cncc(c1)c2ccoc2 ae3eb0c1c882ca0197b071ebab2a48dd [0,0,0,1,0,0|1,0,2]=4 129 B12R2.2 c1cncc(c1)c2ccsc2 5eb395c1df507ef044a693b566d4df62 [0,0,0,1,0,0|1,1,1]=4 130 B12R2.2 c1cncc(c1)c2cn[nH]c2 8d6ee2d581326378ecfedeee39315dae [0,0,0,1,0,0|3,0,0]=4 131 B12R2.2 c1cncc(c1)c2cnoc2 1161625b51938de25e0ac404dd2981c4 [0,0,0,1,0,0|2,0,1]=4 132 B12R2.2 c1cncc(c1)c2cnsc2 7fe5d3ea3e287705c1eb331cff0f7eae [0,0,0,1,0,0|2,1,0]=4 133 B12R1.118 CCC(C=O)Nc1ccccc1 8973b461ada5e90cb6534721bdd5a0a6 [0,0,0,0,0,1|0,0,2]=3 134 B12R1.118 CCC(C=O)Nc1ccccn1 2aca9ef2fc34cfed6c8d70ea766b8b1c [0,0,0,0,0,1|1,0,2]=4 135 B12R1.118 CCC(C=O)Nc1cccnc1 f2a28a3fdb0a09f8d451d38ec59b2c1d [0,0,0,0,0,1|1,0,2]=4 136 B12R1.118 CCC(C=O)Nc1ccncc1 d2ebcd5e369abce24181da19b91725a5 [0,0,0,0,0,1|1,0,2]=4 137 B12R1.118 CCC(C=O)Oc1ccccn1 c237ce22bb3dec565cc31430edd943de [0,0,0,0,0,1|1,0,2]=4 138 B12R1.118 CCC(C=O)Oc1cccnc1 c02ea9913f6b45411de0698448d19ec4 [0,0,0,0,0,1|1,0,2]=4 139 B12R1.118 CCC(C=O)Oc1ccncc1 000035e8d103b4bb731e93fa27796c45 [0,0,0,0,0,1|1,0,2]=4 140 B12R1.118 CCN(C=O)Cc1ccccc1 05bd4b36907bafd365c275012bc499e0 [0,0,0,0,0,1|1,0,1]=3 141 B12R1.118 CCN(C=O)Cc1ccccn1 b215252a15e4b5709b8ee0b7a35e4b18 [0,0,0,0,0,1|2,0,1]=4 142 B12R1.118 CCN(C=O)Cc1cccnc1 30cfe04dc8c3ff4b94dfef66857a2c80 [0,0,0,0,0,1|2,0,1]=4 143 B12R1.118 CCN(C=O)Cc1ccncc1 4059e58ff4f4431f111167a395386acb [0,0,0,0,0,1|2,0,1]=4 144 B12R1.118 O=CC(C=O)Nc1ccccc1 523bb489c9b7b5e8bfe051ff9eafd67e [0,0,0,0,0,1|1,0,1]=3 145 B12R1.118 O=CC(C=O)Nc1ccccn1 14c6262cdfec7b4e12e104e19924565e [0,0,0,0,0,1|2,0,1]=4 146 B12R1.118 O=CC(C=O)Nc1cccnc1 7e2c912e0d253f2b99a55cb3fa392450 [0,0,0,0,0,1|2,0,1]=4 147 B12R1.118 O=CC(C=O)Nc1ccncc1 0458cc633f68b30a672fa3d601b182c9 [0,0,0,0,0,1|2,0,1]=4 148 B12R1.118 O=CC(C=O)Oc1ccccn1 f67698a50a38066d9d458cccf60ff1ef [0,0,0,0,0,1|2,0,1]=4 149 B12R1.118 O=CC(C=O)Oc1cccnc1 1e0a90c08c18289efa90309f550a299a [0,0,0,0,0,1|2,0,1]=4 150 B12R1.118 O=CC(C=O)Oc1ccncc1 5d02369b46340c94279da5770c1be124 [0,0,0,0,0,1|2,0,1]=4 151 B9R1.8 CCNc1ccccc1 33257e4a9e1d882742dfd4cfddb78cda [2,0,0,0,0,0|1,0,1]=4 152 B9R1.8 O=CNc1ccccn1 881aba1a1d89f4a286d5001a309ad574 [2,0,0,0,0,0|2,0,0]=4 153 B9R1.8 O=CNc1cccnc1 355201612949cfa8d6342c6af1c523a5 [2,0,0,0,0,0|2,0,0]=4 154 B9R1.8 O=CNc1ccncc1 e7930a19a74453c18ec50a777f694607 [2,0,0,0,0,0|2,0,0]=4 155 B11R1.16 C=CCN(C)c1ccccc1 cb57bdb31a063701918aa00f058638bf [1,1,0,0,0,0|2,0,0]=4 156 B11R1.16 CC(NC=O)c1ccccc1 912f825ae8ec09ad8cb929f90e443d73 [1,1,0,0,0,0|0,0,1]=3 157 B11R1.16 CC(NC=O)c1ccccn1 2d9ff4713c5fb2a2245e54b6347c7c9e [1,1,0,0,0,0|1,0,1]=4 158 B11R1.16 CC(NC=O)c1cccnc1 8993d9f42ad801a00b7dbd874864f118 [1,1,0,0,0,0|1,0,1]=4 159 B11R1.16 CC(NC=O)c1ccncc1 5faf024cdfd5434d1564838bc71dc42c [1,1,0,0,0,0|1,0,1]=4 160 B11R1.16 CN(CC=O)c1ccccc1 669b7315010cb1229c9893a5bac75e38 [1,1,0,0,0,0|1,0,0]=3 161 B11R1.16 CN(CC=O)c1ccccn1 8eeacaea1098a53010acec6d489e7e31 [1,1,0,0,0,0|2,0,0]=4 162 B11R1.16 CN(CC=O)c1cccnc1 4e735c7da6851d8cd391939506ab7153 [1,1,0,0,0,0|2,0,0]=4 163 B11R1.16 CN(CC=O)c1ccncc1 4f1a5e470d242783af0cc78d9b673eed [1,1,0,0,0,0|2,0,0]=4 164 B11R1.16 C[C@@H](NC=O)c1ccccc1 ed3cbc790dab943801487e30e3a37c11 [1,1,0,0,0,0|0,0,1]=3 165 B11R1.16 C[C@@H](NC=O)c1ccccn1 cab0a06ffe0df70443a13b7bf3f0f929 [1,1,0,0,0,0|1,0,1]=4 166 B11R1.16 C[C@@H](NC=O)c1cccnc1 ac95236c8efa48d11de85080c1ed1da7 [1,1,0,0,0,0|1,0,1]=4 167 B11R1.16 C[C@@H](NC=O)c1ccncc1 8f84254a89086749004a481ae3d5fd96 [1,1,0,0,0,0|1,0,1]=4 168 B11R1.16 C[C@H](NC=O)c1ccccc1 0ca5dec48ba28ecff3cefea41bc874f0 [1,1,0,0,0,0|0,0,1]=3 169 B11R1.16 C[C@H](NC=O)c1ccccn1 353a0771be422f9d7abafb8a3ade0569 [1,1,0,0,0,0|1,0,1]=4 170 B11R1.16 C[C@H](NC=O)c1cccnc1 03b40f19b3a9bf3d85026c98e0fcf432 [1,1,0,0,0,0|1,0,1]=4 171 B11R1.16 C[C@H](NC=O)c1ccncc1 a397d98d692b7c5c0acb296625e84080 [1,1,0,0,0,0|1,0,1]=4 172 B11R1.16 N#CNC(=O)c1ccccc1 f968919af35f591f70d462dc16d787fc [1,1,0,0,0,0|1,0,1]=4 173 B11R1.22 CN(C=O)c1ccc(cc1)Br 9862ed13c945c79fb65fa51787bd2093 [1,1,0,0,0,0|1,0,0]=3 174 B11R1.22 CN(C=O)c1ccc(cc1)Cl d432c23837319192897a660c45f339ba [1,1,0,0,0,0|1,0,0]=3 175 B11R1.22 CN(C=O)c1ccc(cc1)F f939c668a8e6f39bb7cc93a9ebd979dd [1,1,0,0,0,0|1,0,0]=3 176 B11R1.22 CN(C=O)c1ccc(cc1)I 86b31576c767147a57657625de6a4cf6 [1,1,0,0,0,0|1,0,0]=3 177 B11R1.22 CN(C=O)c1ccc(cc1)O 71050cca6cc6c2a34d54c8525596398a [1,1,0,0,0,0|1,0,0]=3 178 B11R1.22 CN(C=O)c1ccc(cc1)S f07b31b3eaa976c4ece94ae29131a1b8 [1,1,0,0,0,0|1,0,0]=3 179 B11R1.22 CN(C=O)c1ccc(cn1)Br 7f8da10581ce5ca8a37f373d42765e26 [1,1,0,0,0,0|2,0,0]=4 180 B11R1.22 CN(C=O)c1ccc(cn1)Cl eb3549718b5ca2b8a891721b0fccec81 [1,1,0,0,0,0|2,0,0]=4 181 B11R1.22 CN(C=O)c1ccc(cn1)F ccd5b3b4d2abee8b59e402f73866a88d [1,1,0,0,0,0|2,0,0]=4 182 B11R1.22 CN(C=O)c1ccc(cn1)I f3706e1edae5d726765a21baeac8b53e [1,1,0,0,0,0|2,0,0]=4 183 B11R1.22 CN(C=O)c1ccc(nc1)Br 02e6c8c88fc8f9a945078432f838505c [1,1,0,0,0,0|2,0,0]=4 184 B11R1.22 CN(C=O)c1ccc(nc1)Cl bd70684891af49b44bb911ed20ab21a5 [1,1,0,0,0,0|2,0,0]=4 185 B11R1.22 CN(C=O)c1ccc(nc1)F 6e5f29d7bc3545ed6e42f58e9071f45e [1,1,0,0,0,0|2,0,0]=4 186 B11R1.22 Cc1ccc(cc1)N(C)C=O c253ca59971334503e7e1b5bdad7856f [1,1,0,0,0,0|1,0,0]=3 187 B11R1.22 Cc1ccc(cn1)N(C)C=O 17ad1ce648b4690112700dad4971e9cf [1,1,0,0,0,0|2,0,0]=4 188 B11R1.22 Cc1ccc(nc1)N(C)C=O e97e84386efd05e00da987d65e1de257 [1,1,0,0,0,0|2,0,0]=4 189 B11R1.23 CN(C=O)c1cc(ccn1)Br 5d3454b18877e79ab3d306b7bdc52c75 [1,1,0,0,0,0|2,0,0]=4 190 B11R1.23 CN(C=O)c1cc(ccn1)Cl 9f74106f894b34649db45534debd8ed1 [1,1,0,0,0,0|2,0,0]=4 191 B11R1.23 CN(C=O)c1cc(ccn1)I 34fbeab8aca98dabc7c6b19604a4eba9 [1,1,0,0,0,0|2,0,0]=4 192 B11R1.23 CN(C=O)c1cccc(c1)Br 04e2b42b796ef8d05d5e843c6bfac7b3 [1,1,0,0,0,0|1,0,0]=3 193 B11R1.23 CN(C=O)c1cccc(c1)Cl 6a133c007011cf0443d8614b42cd9db1 [1,1,0,0,0,0|1,0,0]=3 194 B11R1.23 CN(C=O)c1cccc(c1)F d6a1f4912d17ef5b2ef6dd6e9a7cc16c [1,1,0,0,0,0|1,0,0]=3 195 B11R1.23 CN(C=O)c1cccc(c1)I 0412fe6299fa843b927c099de9b2eca3 [1,1,0,0,0,0|1,0,0]=3 196 B11R1.23 CN(C=O)c1cccc(c1)O 61c55a3ac80552d55fb98f08b327401d [1,1,0,0,0,0|1,0,0]=3 197 B11R1.23 CN(C=O)c1cccc(n1)Br 8612b91e415e9cc649fb04c5ea29ab42 [1,1,0,0,0,0|2,0,0]=4 198 B11R1.23 CN(C=O)c1cccc(n1)Cl ca2b664edc0079e08a87049fdad8282a [1,1,0,0,0,0|2,0,0]=4 199 B11R1.23 CN(C=O)c1cccc(n1)F 4cee610795a72fd3ca41904bfd37bd40 [1,1,0,0,0,0|2,0,0]=4 200 B11R1.23 CN(C=O)c1ccnc(c1)Br 91a80df2840651b48e3e6a49028296ef [1,1,0,0,0,0|2,0,0]=4 201 B11R1.23 CN(C=O)c1ccnc(c1)Cl 66533818364b3b9a357710653b7fa487 [1,1,0,0,0,0|2,0,0]=4 202 B11R1.23 CN(C=O)c1ccnc(c1)F 6b488499e9af4e4c49e6e6e6b68ab3e3 [1,1,0,0,0,0|2,0,0]=4 203 B11R1.23 Cc1cccc(c1)N(C)C=O 8d3d604d6ddb9f04039aac9ce5e10e5e [1,1,0,0,0,0|1,0,0]=3 204 B11R1.23 Cc1cccc(n1)N(C)C=O 6cb388448dc4b9e667ac2839ef3d869c [1,1,0,0,0,0|2,0,0]=4 205 B11R1.23 Cc1ccnc(c1)N(C)C=O 9a844feefad7cbd79d0790089efe483f [1,1,0,0,0,0|2,0,0]=4 206 B11R1.23 Cc1cncc(c1)N(C)C=O 7fd556f41e83e9cebad64414d3df3e54 [1,1,0,0,0,0|2,0,0]=4 207 B11R1.36 CC(=O)N(C)c1ccccn1 3b204f817d8bae885450195e4bca3293 [1,1,0,0,0,0|2,0,0]=4 208 B11R1.36 CC(=O)N(C)c1cccnc1 99d370e4887dccbc66fa5e316a815456 [1,1,0,0,0,0|2,0,0]=4 209 B11R1.36 CC(=O)N(C)c1ccncc1 92a60507d9bf675ae196cc0294354361 [1,1,0,0,0,0|2,0,0]=4 210 B11R1.222 CN(C=O)c1ccccc1Br 3426899914cb277130ea1a231941052f [1,1,0,0,0,0|1,0,0]=3 211 B11R1.222 CN(C=O)c1ccccc1Cl 135f44500c6825a6172cd53bd209f325 [1,1,0,0,0,0|1,0,0]=3 212 B11R1.222 CN(C=O)c1ccccc1F b02bb0760d6e84d207ae27e31e461504 [1,1,0,0,0,0|1,0,0]=3 213 B11R1.222 CN(C=O)c1ccccc1O 4c3e44ceba918ddfd6ff42ad51415b5c [1,1,0,0,0,0|1,0,0]=3 214 B11R1.222 CN(C=O)c1cccnc1Cl b027a9b01c7da1291b970a20c75c2e99 [1,1,0,0,0,0|2,0,0]=4 215 B11R1.222 CN(C=O)c1cccnc1F 8e9cfc1b0e6a6be08d31776d822be16f [1,1,0,0,0,0|2,0,0]=4 216 B11R1.222 CN(C=O)c1ccncc1Br 8cc913ec23aad9d896b4d08982d9caac [1,1,0,0,0,0|2,0,0]=4 217 B11R1.222 CN(C=O)c1ccncc1Cl 9b82e4e8acbda3d0a3daf2c69d5db345 [1,1,0,0,0,0|2,0,0]=4 218 B11R1.222 CN(C=O)c1ccncc1I 840d7cb0d6d3990e32570cdbf1681a0c [1,1,0,0,0,0|2,0,0]=4 219 B11R1.222 CN(C=O)c1cnccc1F 9a049333e1849191907641c6cea15d3a [1,1,0,0,0,0|2,0,0]=4 220 B11R1.222 CN(C=O)c1ncccc1Br db76b93ef1e268b910ac631c67ca1632 [1,1,0,0,0,0|2,0,0]=4 221 B11R1.222 CN(C=O)c1ncccc1Cl 449a83a0cec7f02bd2abd91cedd0a796 [1,1,0,0,0,0|2,0,0]=4 222 B11R1.222 CN(C=O)c1ncccc1F b641ddbedbd63da000d5c508aca4e04b [1,1,0,0,0,0|2,0,0]=4 223 B11R1.222 CN(C=O)c1ncccc1I 71913ea62e33de145ae57bd78731fdb8 [1,1,0,0,0,0|2,0,0]=4 224 B11R1.222 Cc1ccccc1N(C)C=O 0cbd91f766c6614fd036ecf6c5c52ea2 [1,1,0,0,0,0|1,0,0]=3 225 B11R1.222 Cc1cccnc1N(C)C=O 438b938c4b12b8c4e4c902048dbadb00 [1,1,0,0,0,0|2,0,0]=4 226 B11R1.222 Cc1ccncc1N(C)C=O 5e2154d6d670430a5469b9d55e39c87e [1,1,0,0,0,0|2,0,0]=4 227 B11R1.222 Cc1ncccc1N(C)C=O dc35c78fbaab6693ce2763b76bacc250 [1,1,0,0,0,0|2,0,0]=4 228 B13R1.79 C=CCN(C=O)Cc1ccccc1 f8490af59c01fb1f94a7b7ce86a6ff02 [0,1,0,0,0,1|1,0,1]=4 229 B13R1.79 CCC(Cc1ccccc1)NC=O 1f34d3c55786ec32c0ec34664690437c [0,1,0,0,0,1|0,0,2]=4 230 B13R1.79 CCCN(C=O)Cc1ccccc1 04c3429c9ded9bdd8050a0febdf2a8ae [0,1,0,0,0,1|1,0,1]=4 231 B13R1.79 CCN(CC=O)Cc1ccccc1 823f8740bc2b6904fcfe6a2f2a7bf19d [0,1,0,0,0,1|1,0,1]=4 232 B13R1.79 O=CN(CCBr)Cc1ccccc1 ffba392c077fd0a663edb00344c66542 [0,1,0,0,0,1|1,0,1]=4 233 B13R1.79 O=CN(CCCl)Cc1ccccc1 d2c3752c51d4a46d9db7f4050cd5383a [0,1,0,0,0,1|1,0,1]=4 234 B13R1.79 O=CN(CCO)Cc1ccccc1 6dffa71cffcf9da6bb67534cd7aa487f [0,1,0,0,0,1|1,0,1]=4 235 B13R1.86 CCC(C=O)N(C)c1ccccc1 e793d7781c3561ff31419c9a00bb1d93 [0,1,0,0,0,1|0,0,2]=4 236 B13R1.145 CCC(C=O)Nc1ccc(cc1)Br 9acdcfb102cca380076584567cff1466 [0,1,0,0,0,1|0,0,2]=4 237 B13R1.145 CCC(C=O)Nc1ccc(cc1)C 2672c86a611854ec369e1a161ac52940 [0,1,0,0,0,1|0,0,2]=4 238 B13R1.145 CCC(C=O)Nc1ccc(cc1)Cl 1d596c206c99b3e07eca1c1575efc263 [0,1,0,0,0,1|0,0,2]=4 239 B13R1.145 CCC(C=O)Nc1ccc(cc1)F 41ec5a0e3170771534c8a6df7901d61c [0,1,0,0,0,1|0,0,2]=4 240 B13R1.145 CCC(C=O)Nc1ccc(cc1)I 4d511841ae5e9007cfeda48810807ce7 [0,1,0,0,0,1|0,0,2]=4 241 B13R1.145 CCC(C=O)Nc1ccc(cc1)S 52bf6a42096d3cab39ca09c9a6b00545 [0,1,0,0,0,1|0,0,2]=4 242 B13R1.145 CCC(C=O)Oc1ccc(cc1)Br 34e651efc700ac21f7490f9cfc704be0 [0,1,0,0,0,1|0,0,2]=4 243 B13R1.145 CCC(C=O)Oc1ccc(cc1)C 02d871860f6824bc43198b12b4b566ad [0,1,0,0,0,1|0,0,2]=4 244 B13R1.145 CCC(C=O)Oc1ccc(cc1)Cl 80ce899daa7e27bc529e4721a3a53bed [0,1,0,0,0,1|0,0,2]=4 245 B13R1.145 CCC(C=O)Oc1ccc(cc1)F 12ed161e5f960ee35458b1f9c50e9cfb [0,1,0,0,0,1|0,0,2]=4 246 B13R1.145 CCC(C=O)Oc1ccc(cc1)I e7af03cf82640aa95f1edb9e4372744e [0,1,0,0,0,1|0,0,2]=4 247 B13R1.145 CCC(C=O)Oc1ccc(cc1)S e6cb5e04ad889644c67f01f51c8c25ea [0,1,0,0,0,1|0,0,2]=4 248 B13R1.145 CCN(C=O)Cc1ccc(cc1)Br f6704f82d1da017794eb218694a67134 [0,1,0,0,0,1|1,0,1]=4 249 B13R1.145 CCN(C=O)Cc1ccc(cc1)C bc0c396fd21603b73c76b9f58d40219d [0,1,0,0,0,1|1,0,1]=4 250 B13R1.145 CCN(C=O)Cc1ccc(cc1)Cl 97b3f5ddef0a4336c210903d137616b3 [0,1,0,0,0,1|1,0,1]=4 251 B13R1.145 CCN(C=O)Cc1ccc(cc1)F d781d0c869d17b898baef472699d1011 [0,1,0,0,0,1|1,0,1]=4 252 B13R1.145 CCN(C=O)Cc1ccc(cc1)O 00f3114f0de490a3bd07fcd7bb1c0fd7 [0,1,0,0,0,1|1,0,1]=4 253 B13R1.145 Cc1ccc(cc1)NC(C=O)C=O 89cc333c4c9f9c3148b0122dbcdb823f [0,1,0,0,0,1|1,0,1]=4 254 B13R1.145 Cc1ccc(cc1)OC(C=O)C=O cc416cb2500e08bec61f44264f45f086 [0,1,0,0,0,1|1,0,1]=4 255 B13R1.145 O=CC(C=O)Nc1ccc(cc1)Br 5ffa71bfd8a86fbfef7006a0d3df3f96 [0,1,0,0,0,1|1,0,1]=4 256 B13R1.145 O=CC(C=O)Nc1ccc(cc1)Cl 039510c4a432bc3c1947cd2ad37998c7 [0,1,0,0,0,1|1,0,1]=4 257 B13R1.145 O=CC(C=O)Nc1ccc(cc1)F c7455693c9829c3fd9f81ed9470658ed [0,1,0,0,0,1|1,0,1]=4 258 B13R1.145 O=CC(C=O)Nc1ccc(cc1)I cb8599e89692ca0f44ac53a6d1b163af [0,1,0,0,0,1|1,0,1]=4 259 B13R1.145 O=CC(C=O)Nc1ccc(cc1)S 92da35f28f0e4d54a2204238776d60a8 [0,1,0,0,0,1|1,0,1]=4 260 B13R1.145 O=CC(C=O)Oc1ccc(cc1)Br 6fba0cf772d9f551cd7b93bf1782a024 [0,1,0,0,0,1|1,0,1]=4 261 B13R1.145 O=CC(C=O)Oc1ccc(cc1)Cl 66b152c2f8716092b9532967a6fa2acf [0,1,0,0,0,1|1,0,1]=4 262 B13R1.145 O=CC(C=O)Oc1ccc(cc1)F fcbed32072ec7614741bccb3dccab220 [0,1,0,0,0,1|1,0,1]=4 263 B13R1.145 O=CC(C=O)Oc1ccc(cc1)I 51e690104a49a3c21beb210786294393 [0,1,0,0,0,1|1,0,1]=4 264 B13R1.145 O=CC(C=O)Oc1ccc(cc1)S 6024dee1a5a75621dd37b80222db469f [0,1,0,0,0,1|1,0,1]=4 265 B13R1.146 CCC(C=O)Nc1cccc(c1)Br 5053bd22533b5f7d2de83ef4963dc26a [0,1,0,0,0,1|0,0,2]=4 266 B13R1.146 CCC(C=O)Nc1cccc(c1)C 9f9ddd8dcbca85a63aa3e468151fabe6 [0,1,0,0,0,1|0,0,2]=4 267 B13R1.146 CCC(C=O)Nc1cccc(c1)Cl 11e0162f4828bf6acdaaab0481c6ba12 [0,1,0,0,0,1|0,0,2]=4 268 B13R1.146 CCC(C=O)Nc1cccc(c1)F 13068905d9b3393eb33f9689b768a4c5 [0,1,0,0,0,1|0,0,2]=4 269 B13R1.146 CCC(C=O)Nc1cccc(c1)I 5df774252921ac254d11d31925a6e834 [0,1,0,0,0,1|0,0,2]=4 270 B13R1.146 CCC(C=O)Nc1cccc(c1)S eadc92a29304740d45bf9972670e0b92 [0,1,0,0,0,1|0,0,2]=4 271 B13R1.146 CCC(C=O)Oc1cccc(c1)Br a2280bb281d9e25618c762ee39ead546 [0,1,0,0,0,1|0,0,2]=4 272 B13R1.146 CCC(C=O)Oc1cccc(c1)C cfe9b461a405f5af987602b9f602a742 [0,1,0,0,0,1|0,0,2]=4 273 B13R1.146 CCC(C=O)Oc1cccc(c1)Cl 3ca6b05594cca12a2303b3901657f9a7 [0,1,0,0,0,1|0,0,2]=4 274 B13R1.146 CCC(C=O)Oc1cccc(c1)F e963872495a916e7e3dc7a4873354fbf [0,1,0,0,0,1|0,0,2]=4 275 B13R1.146 CCC(C=O)Oc1cccc(c1)I 46897a4e95ddfda1babf383bdb8257a9 [0,1,0,0,0,1|0,0,2]=4 276 B13R1.146 CCC(C=O)Oc1cccc(c1)S 707d680a87ab2dcd57ebf40801a59b51 [0,1,0,0,0,1|0,0,2]=4 277 B13R1.146 CCN(C=O)Cc1cccc(c1)Br 459c54bc259c034778c5f9f916dea89e [0,1,0,0,0,1|1,0,1]=4 278 B13R1.146 CCN(C=O)Cc1cccc(c1)C d802a0ccc9cafa58bd8232423c7690f3 [0,1,0,0,0,1|1,0,1]=4 279 B13R1.146 CCN(C=O)Cc1cccc(c1)Cl 6883f6fa7a4431bd342478deb461e949 [0,1,0,0,0,1|1,0,1]=4 280 B13R1.146 CCN(C=O)Cc1cccc(c1)F 1ba9a4cf848d4aa4f2af03580f179f52 [0,1,0,0,0,1|1,0,1]=4 281 B13R1.146 CCN(C=O)Cc1cccc(c1)I cd708eda96146232be0ed55b366f0eb0 [0,1,0,0,0,1|1,0,1]=4 282 B13R1.146 CCN(C=O)Cc1cccc(c1)O 39c0a2e0637d8ea663bdcb9ac2db0fb3 [0,1,0,0,0,1|1,0,1]=4 283 B13R1.146 Cc1cccc(c1)NC(C=O)C=O 9065724d29193f65fb6162a3b5a9ba79 [0,1,0,0,0,1|1,0,1]=4 284 B13R1.146 Cc1cccc(c1)OC(C=O)C=O 60674fd7e1a8a65323f4b72520be988e [0,1,0,0,0,1|1,0,1]=4 285 B13R1.146 O=CC(C=O)Nc1cccc(c1)Br cb0cb7b233f647b37b7da021b61055ea [0,1,0,0,0,1|1,0,1]=4 286 B13R1.146 O=CC(C=O)Nc1cccc(c1)Cl 4188bc3ddb93bd18f20c3d04fcb341f2 [0,1,0,0,0,1|1,0,1]=4 287 B13R1.146 O=CC(C=O)Nc1cccc(c1)F 48335dc076e39603c31579f6109dec2d [0,1,0,0,0,1|1,0,1]=4 288 B13R1.146 O=CC(C=O)Nc1cccc(c1)I 39aa31f4ffde246d4edc5eadd47a20fd [0,1,0,0,0,1|1,0,1]=4 289 B13R1.146 O=CC(C=O)Nc1cccc(c1)S 39ba218542fcdcbf7543d72b256c0f7b [0,1,0,0,0,1|1,0,1]=4 290 B13R1.146 O=CC(C=O)Oc1cccc(c1)Br 1dbdfe5d0e7488f038d5300c87b4bc98 [0,1,0,0,0,1|1,0,1]=4 291 B13R1.146 O=CC(C=O)Oc1cccc(c1)Cl 2079b6d010918973ac5f93b44078b13b [0,1,0,0,0,1|1,0,1]=4 292 B13R1.146 O=CC(C=O)Oc1cccc(c1)F 93b8ea4857f8612c9fd1f55455ffa581 [0,1,0,0,0,1|1,0,1]=4 293 B13R1.146 O=CC(C=O)Oc1cccc(c1)I 9e02f3dbc698c11ce0e527f348fc8370 [0,1,0,0,0,1|1,0,1]=4 294 B13R1.146 O=CC(C=O)Oc1cccc(c1)S 8090f83104d18f78f046d84f6e0158e2 [0,1,0,0,0,1|1,0,1]=4 295 B13R1.335 CCC(C=O)Nc1ccccc1Br f0d6fbf531ed9e179b757b1c4cb947c3 [0,1,0,0,0,1|0,0,2]=4 296 B13R1.335 CCC(C=O)Nc1ccccc1C 2c136a5078a8cd337dcd9f1054ae1c91 [0,1,0,0,0,1|0,0,2]=4 297 B13R1.335 CCC(C=O)Nc1ccccc1Cl 2af026b514ccaa3152eb9b64a389b588 [0,1,0,0,0,1|0,0,2]=4 298 B13R1.335 CCC(C=O)Nc1ccccc1F d72ead8aa344781d18ddc32015a32616 [0,1,0,0,0,1|0,0,2]=4 299 B13R1.335 CCC(C=O)Nc1ccccc1I c74a407585749a1edb2e37e5a60875e3 [0,1,0,0,0,1|0,0,2]=4 300 B13R1.335 CCC(C=O)Nc1ccccc1S 87e933f1b8b2630ba726f2fb91b96c28 [0,1,0,0,0,1|0,0,2]=4 301 B13R1.335 CCC(C=O)Oc1ccccc1Br c9f34e34eaffb0d44cee0e679d16d35f [0,1,0,0,0,1|0,0,2]=4 302 B13R1.335 CCC(C=O)Oc1ccccc1C b033d2ad3856a53e330ddd0eaab4e26a [0,1,0,0,0,1|0,0,2]=4 303 B13R1.335 CCC(C=O)Oc1ccccc1Cl 593e4aad8505eeae0e8abc8aec7e3430 [0,1,0,0,0,1|0,0,2]=4 304 B13R1.335 CCC(C=O)Oc1ccccc1F 938f64002d0af68b680a7b05e8490a90 [0,1,0,0,0,1|0,0,2]=4 305 B13R1.335 CCC(C=O)Oc1ccccc1I f24e79db404846a5f83e030c78a0ae3b [0,1,0,0,0,1|0,0,2]=4 306 B13R1.335 CCC(C=O)Oc1ccccc1S 7bc6571f99b72a105826fa33f691a4a7 [0,1,0,0,0,1|0,0,2]=4 307 B13R1.335 CCN(C=O)Cc1ccccc1C 8daf20450dd5ddc21be135067bf5f138 [0,1,0,0,0,1|1,0,1]=4 308 B13R1.335 CCN(C=O)Cc1ccccc1F bd54e0e7b7c3c1a547e41ead45c55c7d [0,1,0,0,0,1|1,0,1]=4 309 B13R1.335 CCN(C=O)Cc1ccccc1O 47e0ff81db9bff530f7514a2a7557243 [0,1,0,0,0,1|1,0,1]=4 310 B13R1.335 Cc1ccccc1NC(C=O)C=O 65e6e41314e78fa82068f1750d702eb3 [0,1,0,0,0,1|1,0,1]=4 311 B13R1.335 Cc1ccccc1OC(C=O)C=O 367846b1af7ee78797b7c9a5a375170e [0,1,0,0,0,1|1,0,1]=4 312 B13R1.335 O=CC(C=O)Nc1ccccc1Cl d99f19d0c0a0dd2e297b0fa8056eb7e9 [0,1,0,0,0,1|1,0,1]=4 313 B13R1.335 O=CC(C=O)Nc1ccccc1F 3373ffa0c7e4a21debd5167356896f37 [0,1,0,0,0,1|1,0,1]=4 314 B13R1.335 O=CC(C=O)Nc1ccccc1I 9d5fbf2c0a95cae7260e718077cace9e [0,1,0,0,0,1|1,0,1]=4 315 B13R1.335 O=CC(C=O)Nc1ccccc1S 7c22d65998d71b72246d32c6f09868ed [0,1,0,0,0,1|1,0,1]=4 316 B13R1.335 O=CC(C=O)Oc1ccccc1Cl 7d5e34694556329d29acd388baab7953 [0,1,0,0,0,1|1,0,1]=4 317 B13R1.335 O=CC(C=O)Oc1ccccc1F 9a842b840c71064a76129273f251d306 [0,1,0,0,0,1|1,0,1]=4 318 B13R1.335 O=CC(C=O)Oc1ccccc1I 5c65809afb6dcaf59c093d3e7e62bd20 [0,1,0,0,0,1|1,0,1]=4 319 B13R1.418 CC(C)C(C=O)Nc1ccccc1 d774c4f620449b5df4c6d95d952d43bc [0,1,0,0,0,1|0,0,2]=4 320 B13R1.418 CC(C)N(C=O)Cc1ccccc1 59fdda873ca35d91d20a94a609f32c50 [0,1,0,0,0,1|1,0,1]=4 321 B13R1.418 CCC(Nc1ccccc1)C(=O)N 6379bfebc9482df3fc6cc9e65a970107 [0,1,0,0,0,1|0,0,2]=4 322 B13R1.418 CCC(Nc1ccccc1)C(=O)O b399a6317777c28b38bcfac5c0f65672 [0,1,0,0,0,1|0,0,2]=4 323 B13R1.418 CCN(Cc1ccccc1)C(=O)C 2a8906fd87fa5b9da2764b32c6215886 [0,1,0,0,0,1|1,0,1]=4 324 B13R1.418 CC[C@@H](Nc1ccccc1)C(=O)O 1914b3cd3ee7431d26c7ff3e251e07f1 [0,1,0,0,0,1|0,0,2]=4 325 B13R1.418 CC[C@H](Nc1ccccc1)C(=O)N 4889b687b0c145fd97cbc9f2ba50001b [0,1,0,0,0,1|0,0,2]=4 326 B13R1.418 CC[C@H](Nc1ccccc1)C(=O)O 9be901a21eaf26c69752bdc769cc5768 [0,1,0,0,0,1|0,0,2]=4 327 B13R1.1 C=CC(NC=O)c1ccc(cc1)Br ef42bfa0b7848e5472f2827f468eae21 [0,2,0,0,0,0|0,0,2]=4 328 B13R1.1 C=CC(NC=O)c1ccc(cc1)F bb97dae50d97f8936d7f432b4e78e3e4 [0,2,0,0,0,0|0,0,2]=4 329 B13R1.1 C=CC(NC=O)c1ccc(cc1)I d56659d2657c1eabd8b38a89b708c978 [0,2,0,0,0,0|0,0,2]=4 330 B13R1.1 CCC(NC=O)c1ccc(cc1)Br 2ee469ba18e9da23386ef4ad9a5b4788 [0,2,0,0,0,0|0,0,2]=4 331 B13R1.1 CCC(NC=O)c1ccc(cc1)C f92b70cc645e587117f074c488a719bd [0,2,0,0,0,0|0,0,2]=4 332 B13R1.1 CCC(NC=O)c1ccc(cc1)Cl 2e0207891639bc9d744aa837a9ad5d59 [0,2,0,0,0,0|0,0,2]=4 333 B13R1.1 CCC(NC=O)c1ccc(cc1)F fd5c2da913dd8751f5213b6b8056b55a [0,2,0,0,0,0|0,0,2]=4 334 B13R1.1 CCN(CC=O)c1ccc(cc1)Br 68b28968c5eb97ad0acbb56b100b1294 [0,2,0,0,0,0|1,0,1]=4 335 B13R1.1 CCN(CC=O)c1ccc(cc1)C d051d8a81902dcc824d1c350868be035 [0,2,0,0,0,0|1,0,1]=4 336 B13R1.1 CCN(CC=O)c1ccc(cc1)Cl e928c7c69d96d26d2c0c686d79904e62 [0,2,0,0,0,0|1,0,1]=4 337 B13R1.1 CCN(CC=O)c1ccc(cc1)F 57b480dc17680a91f03b8225b3575f30 [0,2,0,0,0,0|1,0,1]=4 338 B13R1.1 CC[C@@H](NC=O)c1ccc(cc1)Br ef38046ca7ee8a5691db97324795e8d1 [0,2,0,0,0,0|0,0,2]=4 339 B13R1.1 CC[C@@H](NC=O)c1ccc(cc1)Cl 73cbf6fc0aabb518c408ac8f122ea14d [0,2,0,0,0,0|0,0,2]=4 340 B13R1.1 CC[C@@H](NC=O)c1ccc(cc1)F 455669df2937e06fb13c7002856f4fab [0,2,0,0,0,0|0,0,2]=4 341 B13R1.1 CC[C@H](NC=O)c1ccc(cc1)Br af176dbf78147301b2e75dd0f8a15745 [0,2,0,0,0,0|0,0,2]=4 342 B13R1.1 CC[C@H](NC=O)c1ccc(cc1)Cl 0420b8ac649773ba7bedef1192fb0d9d [0,2,0,0,0,0|0,0,2]=4 343 B13R1.1 CC[C@H](NC=O)c1ccc(cc1)F 9a15c2227cce9aeb7f7276fa69419a98 [0,2,0,0,0,0|0,0,2]=4 344 B13R1.1 Cc1ccc(cc1)N(C=O)CCO e5ef432524b68a29126fb45f91296d59 [0,2,0,0,0,0|1,0,1]=4 345 B13R1.1 O=CN(CCO)c1ccc(cc1)Br 7a6a7f96cd7aa3fa8f95640d8e8d60db [0,2,0,0,0,0|1,0,1]=4 346 B13R1.1 O=CN(CCO)c1ccc(cc1)F 2ecb68d8ebc63acceae05539eb4b1aed [0,2,0,0,0,0|1,0,1]=4 347 B13R1.2 CCC(NC=O)c1cccc(c1)Br 2783e38905b6b88e184bba0ead90fbad [0,2,0,0,0,0|0,0,2]=4 348 B13R1.2 CCC(NC=O)c1cccc(c1)C f3661b7e6cf9c86fcd674975c962740c [0,2,0,0,0,0|0,0,2]=4 349 B13R1.2 CCC(NC=O)c1cccc(c1)Cl 49907341dc895acda852eb9c29ed5d1c [0,2,0,0,0,0|0,0,2]=4 350 B13R1.2 CCC(NC=O)c1cccc(c1)F d845df2900ed3b741a9d765e9b3a2314 [0,2,0,0,0,0|0,0,2]=4 351 B13R1.2 CCCN(C=O)c1cccc(c1)C 27539193e5a3678407cf84cdee475b3f [0,2,0,0,0,0|1,0,1]=4 352 B13R1.2 CCCN(C=O)c1cccc(c1)Cl eb33cba5e97262423ca5d3922b734649 [0,2,0,0,0,0|1,0,1]=4 353 B13R1.2 CCCN(C=O)c1cccc(c1)O 8fb0b802e7e695196fe728d079f84097 [0,2,0,0,0,0|1,0,1]=4 354 B13R1.2 CCN(CC=O)c1cccc(c1)Br 8d9c3e08aeb7d25db016f92fe71fda43 [0,2,0,0,0,0|1,0,1]=4 355 B13R1.2 CCN(CC=O)c1cccc(c1)C e7f12e1a1cda47a5da1c98df92871a5c [0,2,0,0,0,0|1,0,1]=4 356 B13R1.2 CCN(CC=O)c1cccc(c1)Cl 60243f3bc7c2a9d857ab0d3f6e57e13e [0,2,0,0,0,0|1,0,1]=4 357 B13R1.2 CCN(CC=O)c1cccc(c1)F faea1021b8eaed643b4a03b6b60df0b8 [0,2,0,0,0,0|1,0,1]=4 358 B13R1.2 CC[C@@H](NC=O)c1cccc(c1)Br f49ae7f037e578e425056a3ae9a51bc0 [0,2,0,0,0,0|0,0,2]=4 359 B13R1.2 CC[C@@H](NC=O)c1cccc(c1)C cd78a4c9c6482d3be4a746fa09cbe6a3 [0,2,0,0,0,0|0,0,2]=4 360 B13R1.2 CC[C@@H](NC=O)c1cccc(c1)Cl b00ed43b226bc9024432cbff8f87fe53 [0,2,0,0,0,0|0,0,2]=4 361 B13R1.2 CC[C@@H](NC=O)c1cccc(c1)F c421792136fe9595461a435e604de5df [0,2,0,0,0,0|0,0,2]=4 362 B13R1.2 CC[C@H](NC=O)c1cccc(c1)Br 4a396707040849515be5e4e7685e8abe [0,2,0,0,0,0|0,0,2]=4 363 B13R1.2 CC[C@H](NC=O)c1cccc(c1)Cl 830a2c29b008285fd9dd7900ec319cd0 [0,2,0,0,0,0|0,0,2]=4 364 B13R1.2 Cc1cccc(c1)N(C=O)CCO b68d42b61f39de5736f511e80141938d [0,2,0,0,0,0|1,0,1]=4 365 B13R1.26 C#CCNC(C=O)c1ccccc1 29be01926ee157e820c31275b04438d3 [0,2,0,0,0,0|1,0,1]=4 366 B13R1.26 C=CC(NCC=O)c1ccccc1 554a68b281071a72858b965a9f4dee92 [0,2,0,0,0,0|0,0,2]=4 367 B13R1.26 C=CC(OCC=O)c1ccccc1 3364173dab13594f9815ed2014953bd0 [0,2,0,0,0,0|0,0,2]=4 368 B13R1.26 C=CCCN(C=O)c1ccccc1 44f1f123433c073869008d52ceb71f76 [0,2,0,0,0,0|1,0,1]=4 369 B13R1.26 C=C[C@@H](NCC=O)c1ccccc1 3310b6a3f6df9c394732cd9fa9d5265c [0,2,0,0,0,0|0,0,2]=4 370 B13R1.26 C=C[C@H](NCC=O)c1ccccc1 16df17267ad2ab142471f7e45fa352fc [0,2,0,0,0,0|0,0,2]=4 371 B13R1.26 CCC(NCC=O)c1ccccc1 95f0712696bae22d12c6f2f89a4ab0af [0,2,0,0,0,0|0,0,2]=4 372 B13R1.26 CCC(OCC=O)c1ccccc1 22d631f4381eac13072af35245e75c82 [0,2,0,0,0,0|0,0,2]=4 373 B13R1.26 CCCCN(C=O)c1ccccc1 3f4748206aeba81d0167a4b2cec011f1 [0,2,0,0,0,0|1,0,1]=4 374 B13R1.26 CCCNC(C=O)c1ccccc1 a9d865eede21a251ca86aba62b2c978e [0,2,0,0,0,0|0,0,2]=4 375 B13R1.26 CCN(CCC=O)c1ccccc1 8f9511603a7735db08268c3ac5a7782c [0,2,0,0,0,0|1,0,1]=4 376 B13R1.26 CCO/C=C(\C=O)/c1ccccc1 25f4250e235f80b5c88931384da54a3b [0,2,0,0,0,0|0,0,0]=2 377 B13R1.26 CCO/C=C(\C=O)/c1ccccn1 6d516e74e898fa87af344730d1cbc5d3 [0,2,0,0,0,0|1,0,0]=3 378 B13R1.26 CCO/C=C(\C=O)/c1ccncc1 dc869c5232cbc58bd60bb9adea15eceb [0,2,0,0,0,0|1,0,0]=3 379 B13R1.26 CCO/C=C(\C=O)/c1ccncn1 675204aa48f1f4eedf74cd55e9f55594 [0,2,0,0,0,0|2,0,0]=4 380 B13R1.26 CCO/C=C(\C=O)/c1cnccn1 88eaca9da737e77c47552ffc841e634f [0,2,0,0,0,0|2,0,0]=4 381 B13R1.26 CCOC=C(C#N)c1ccccc1 63d5f0c73e0b48ce02dbca621b7398ce [0,2,0,0,0,0|1,0,1]=4 382 B13R1.26 CC[C@@H](NCC=O)c1ccccc1 3d1ae1dfcea40d314ce7e328dc316861 [0,2,0,0,0,0|0,0,2]=4 383 B13R1.26 CC[C@@H](OCC=O)c1ccccc1 ff4d6fdd39d62cd4dd5fbc1780fcd463 [0,2,0,0,0,0|0,0,2]=4 384 B13R1.26 CC[C@H](NCC=O)c1ccccc1 33e6c884e365733829f389a52f4be184 [0,2,0,0,0,0|0,0,2]=4 385 B13R1.26 CC[C@H](OCC=O)c1ccccc1 151015fabcf1f0f05e31ab274278f1ef [0,2,0,0,0,0|0,0,2]=4 386 B13R1.26 COCCN(C=O)c1ccccc1 a2c0cc9770a17f9d61a7c772186f21d3 [0,2,0,0,0,0|1,0,1]=4 387 B13R1.26 N#CC(=COCF)c1ccccc1 46c5b8c9335e5a6ddd2b8ddbf2f1cc1c [0,2,0,0,0,0|1,0,1]=4 388 B13R1.26 N#CCCN(C=O)c1ccccc1 93fca7b45d453d05e5be021b6511aaa4 [0,2,0,0,0,0|1,0,1]=4 389 B13R1.26 N#CCNC(C=O)c1ccccc1 b9b4c35a5730c0624180c70407d693c1 [0,2,0,0,0,0|1,0,1]=4 390 B13R1.26 O=C/C(=C\OCF)/c1ccccc1 c95aab4ef0ec92a39993b301751d3d7f [0,2,0,0,0,0|0,0,0]=2 391 B13R1.26 O=C/C(=C\OCF)/c1ccccn1 68e5b18d0248a0492062d5a000f713fd [0,2,0,0,0,0|1,0,0]=3 392 B13R1.26 O=C/C(=C\OCF)/c1ccncc1 58deaee1e5d1fda6ab634584552204e9 [0,2,0,0,0,0|1,0,0]=3 393 B13R1.26 O=C/C(=C\OCF)/c1ccncn1 d8c82626d8c21cbd9669d776c51e1dc8 [0,2,0,0,0,0|2,0,0]=4 394 B13R1.26 O=C/C(=C\OCF)/c1cnccn1 7bdc44d6e22d96d80f73852dba74bdaf [0,2,0,0,0,0|2,0,0]=4 395 B13R1.26 O=CC(NCCBr)c1ccccc1 4d607c35dd84aa7985340a2c60d4b6cb [0,2,0,0,0,0|0,0,2]=4 396 B13R1.26 O=CC(NCCF)c1ccccc1 ad6d333ce28a591c6cf045b53cb35ab3 [0,2,0,0,0,0|0,0,2]=4 397 B13R1.26 O=CC(NCCI)c1ccccc1 2894ee4b322c4a2ae54c87071a51c7de [0,2,0,0,0,0|0,0,2]=4 398 B13R1.26 O=CC(NCCO)c1ccccc1 a329887f1e1bc65085d7a4d4d820b798 [0,2,0,0,0,0|0,0,2]=4 399 B13R1.26 O=CC(NCCS)c1ccccc1 1dc6c50ba26b2e40756a4dc367102bc6 [0,2,0,0,0,0|0,0,2]=4 400 B13R1.26 O=CN(CCCO)c1ccccc1 239ae522582c17715a6d6637479d71ee [0,2,0,0,0,0|1,0,1]=4 401 B13R1.173 CCC(NC=O)c1ccccc1Br 4de6d1f5904d8f6c6f69865b3620839c [0,2,0,0,0,0|0,0,2]=4 402 B13R1.173 CCC(NC=O)c1ccccc1C 198b2eb38625e860e54ed958f3b2226c [0,2,0,0,0,0|0,0,2]=4 403 B13R1.173 CCC(NC=O)c1ccccc1Cl 3eeba56af5fbb43dc1aaca941662d505 [0,2,0,0,0,0|0,0,2]=4 404 B13R1.173 CCC(NC=O)c1ccccc1F 76c8fda3bdefc4bdc52900b3eb8b8392 [0,2,0,0,0,0|0,0,2]=4 405 B13R1.173 CCCN(C=O)c1ccccc1F d9939c3740122ad73335e018f73db703 [0,2,0,0,0,0|1,0,1]=4 406 B13R1.173 CCN(CC=O)c1ccccc1Br 28416a73251dcee3255fdc1b3f1d5f40 [0,2,0,0,0,0|1,0,1]=4 407 B13R1.173 CCN(CC=O)c1ccccc1C 7b2f0c1c8902e2f62024eb8de1a54d91 [0,2,0,0,0,0|1,0,1]=4 408 B13R1.173 CCN(CC=O)c1ccccc1Cl df649d10f932591a2e278364d3eb9fba [0,2,0,0,0,0|1,0,1]=4 409 B13R1.173 CCN(CC=O)c1ccccc1F 774aaa7d6d5dfb6e0f6a1ca12ce1349d [0,2,0,0,0,0|1,0,1]=4 410 B13R1.173 CC[C@H](NC=O)c1ccccc1F bc83fdff6d637a1fd5aaea2d929f725c [0,2,0,0,0,0|0,0,2]=4 411 B13R1.173 Cc1ccccc1N(C=O)CCO a79a0604b0f007f46b383ebf1924f2e5 [0,2,0,0,0,0|1,0,1]=4 412 B13R1.398 C=CCN(CC=O)c1ccccc1 bebaa175f3499ad50c3a92b6f84668d0 [0,2,0,0,0,0|1,0,1]=4 413 B13R1.398 C=CC[C@@H](NC=O)c1ccccc1 75cf5b6405a5332158b689cd73018e3f [0,2,0,0,0,0|0,0,2]=4 414 B13R1.398 CCCC(NC=O)c1ccccc1 96bad0e766597a2cabffc3b0b14b65c3 [0,2,0,0,0,0|0,0,2]=4 415 B13R1.398 CCCN(CC=O)c1ccccc1 39a7a58e99af9b71e22cb7938ca8dbb9 [0,2,0,0,0,0|1,0,1]=4 416 B13R1.398 CCC[C@@H](NC=O)c1ccccc1 c100f0eb9e21127e7debfa92a2f93695 [0,2,0,0,0,0|0,0,2]=4 417 B13R1.398 CCC[C@H](NC=O)c1ccccc1 ba59810a5832a204f837ae12221fa56d [0,2,0,0,0,0|0,0,2]=4 418 B13R1.398 COCC(NC=O)c1ccccc1 a63a2b8fc8294f3146c0134b647a19a8 [0,2,0,0,0,0|0,0,2]=4 419 B13R1.398 COC[C@@H](NC=O)c1ccccc1 067546f851be66827736fa1cacee56a9 [0,2,0,0,0,0|0,0,2]=4 420 B13R1.398 COC[C@H](NC=O)c1ccccc1 a4f1c8db94e3be1a8f7c9063e4eec989 [0,2,0,0,0,0|0,0,2]=4 421 B13R1.398 O=CCN(CCF)c1ccccc1 ff51c9c025ddc7712cce2a2ab5cd890a [0,2,0,0,0,0|1,0,1]=4 422 B13R1.398 O=CCN(CCO)c1ccccc1 27c9c1e737c4feb080d3bc8e908f8acf [0,2,0,0,0,0|1,0,1]=4 423 B13R1.398 O=CNC(CCO)c1ccccc1 0aee80c1dd948e98b51353afabd745c1 [0,2,0,0,0,0|0,0,2]=4 424 B13R1.398 O=CN[C@@H](CCO)c1ccccc1 5810140a2169a80e490ab06c23268531 [0,2,0,0,0,0|0,0,2]=4 425 B13R1.398 O=CN[C@H](CCO)c1ccccc1 5580ecf7a7358d448a8fa039f51e93ad [0,2,0,0,0,0|0,0,2]=4 426 B13R1.402 CC(C=O)(OCF)c1ccccc1 abfa187ae8de8100bdc6c8007653d746 [0,2,0,0,0,0|1,0,1]=4 427 B13R1.402 CCOC(C)(C=O)c1ccccc1 98bf4a06a3acb9fdae1b015022e8ee05 [0,2,0,0,0,0|0,0,2]=4 428 B13R1.405 C=CCN(C(=O)C)c1ccccc1 78938c4cbd2af0abea92c09a30ad0417 [0,2,0,0,0,0|1,0,1]=4 429 B13R1.405 CC(=O)C(OCF)c1ccccc1 c3d3e521c28656480f76530200b274cc [0,2,0,0,0,0|1,0,1]=4 430 B13R1.405 CC(=O)N(CCO)c1ccccc1 8371393b648c70f71d6c0e74bfe97ccc [0,2,0,0,0,0|1,0,1]=4 431 B13R1.405 CC(C)N(CC=O)c1ccccc1 7aa4ef54bf649848dc75238416a7b06d [0,2,0,0,0,0|1,0,1]=4 432 B13R1.405 CC(O)C(NC=O)c1ccccc1 253b7ff965779656e043ad99eab5bfa2 [0,2,0,0,0,0|0,0,2]=4 433 B13R1.405 CCNC(C(=O)N)c1ccccc1 3a9e509bb7a36804140905d5d5255dd9 [0,2,0,0,0,0|0,0,2]=4 434 B13R1.405 CCNC(C(=O)O)c1ccccc1 2da17e1ce9e7f565721e624ebeefc560 [0,2,0,0,0,0|0,0,2]=4 435 B13R1.405 CCN[C@@H](C(=O)N)c1ccccc1 8297ff417df1cc6ca16c12f46d118770 [0,2,0,0,0,0|0,0,2]=4 436 B13R1.405 CCN[C@@H](C(=O)O)c1ccccc1 bbb5413322df4340130ea9a37ea31842 [0,2,0,0,0,0|0,0,2]=4 437 B13R1.405 CCN[C@H](C(=O)N)c1ccccc1 d3cf846f3a8b811ad72aff28ee83c3c0 [0,2,0,0,0,0|0,0,2]=4 438 B13R1.405 CCN[C@H](C(=O)O)c1ccccc1 3357d9db2dcc627327e25ebf1f9eafed [0,2,0,0,0,0|0,0,2]=4 439 B13R1.405 CCOC(C(=O)C)c1ccccc1 978b8a065cefe3dd4c48c28bab1ef6f1 [0,2,0,0,0,0|0,0,2]=4 440 B13R1.405 CCOC(C(=O)N)c1ccccc1 4cadd269f5009a12d685dab928c6328d [0,2,0,0,0,0|0,0,2]=4 441 B13R1.405 CCOC(C(=O)O)c1ccccc1 bf2a391e548c65a683a0a45a2b3fdcac [0,2,0,0,0,0|0,0,2]=4 442 B13R1.405 CCO[C@@H](C(=O)N)c1ccccc1 93f6fc7d6947450b6bb9e9e3f4e8d071 [0,2,0,0,0,0|0,0,2]=4 443 B13R1.405 CCO[C@@H](C(=O)O)c1ccccc1 26ff87578b2634a5a13bd7cc5cbb3ff5 [0,2,0,0,0,0|0,0,2]=4 444 B13R1.405 CCO[C@H](C(=O)N)c1ccccc1 a51bdf38f41c41f4f543792d8b6211e5 [0,2,0,0,0,0|0,0,2]=4 445 B13R1.405 CCO[C@H](C(=O)O)c1ccccc1 a9cfff70734151ac3e9919424a3b721c [0,2,0,0,0,0|0,0,2]=4 446 B13R1.405 C[C@@H](O)[C@@H](NC=O)c1ccccc1 70f0bb18fd3f35d5c1ed806674580a85 [0,2,0,0,0,0|0,0,2]=4 447 B13R1.405 C[C@H](O)[C@H](NC=O)c1ccccc1 401dac024de396cc7b1702fe7ea45488 [0,2,0,0,0,0|0,0,2]=4 448 B13R1.405 NC(=O)C(NC=O)c1ccccc1 1419cf8bc61a4c9b2c0985ddfc0d7969 [0,2,0,0,0,0|1,0,1]=4 449 B13R1.405 NC(=O)C(NCF)c1ccccc1 94caeda65eeed342640007ed64a73f05 [0,2,0,0,0,0|1,0,1]=4 450 B13R1.405 NC(=O)C(NCO)c1ccccc1 f9605ac1c305b368b46ec3b1b3110e4f [0,2,0,0,0,0|1,0,1]=4 451 B13R1.405 NC(=O)C(OCF)c1ccccc1 813096555c1d692b6040dd3bf22dbde1 [0,2,0,0,0,0|1,0,1]=4 452 B13R1.405 NC(=O)[C@@H](NC=O)c1ccccc1 8eddd458075b7f3911b7198f3739de70 [0,2,0,0,0,0|1,0,1]=4 453 B13R1.405 NC(=O)[C@@H](NCF)c1ccccc1 cb010097f35f94b5dfc49acd8fdebc46 [0,2,0,0,0,0|1,0,1]=4 454 B13R1.405 NC(=O)[C@@H](NCO)c1ccccc1 51ad7bae4199bea1ce245323e7eeae6c [0,2,0,0,0,0|1,0,1]=4 455 B13R1.405 NC(=O)[C@@H](OCF)c1ccccc1 3f84489714d9310293f6c0293883ca25 [0,2,0,0,0,0|1,0,1]=4 456 B13R1.405 NC(=O)[C@H](NC=O)c1ccccc1 c2e6682bd89c44856ce5ad4e8c283a08 [0,2,0,0,0,0|1,0,1]=4 457 B13R1.405 NC(=O)[C@H](NCF)c1ccccc1 3db3bf3958198731e3764656c73ea3b3 [0,2,0,0,0,0|1,0,1]=4 458 B13R1.405 NC(=O)[C@H](NCO)c1ccccc1 c444554e2337359095f30dad39050792 [0,2,0,0,0,0|1,0,1]=4 459 B13R1.405 NC(=O)[C@H](OCF)c1ccccc1 5648bc8df0a24083a38304060e0b33b8 [0,2,0,0,0,0|1,0,1]=4 460 B13R1.405 O=C(O)C(NCF)c1ccccc1 f87294065061ac670b7b98475c0c3305 [0,2,0,0,0,0|1,0,1]=4 461 B13R1.405 O=C(O)C(NCO)c1ccccc1 4ae7101686a7f2b414f8cb3c5615274c [0,2,0,0,0,0|1,0,1]=4 462 B13R1.405 O=C(O)C(OCF)c1ccccc1 9b4de0fe878b86051b4e49a3c1325a7a [0,2,0,0,0,0|1,0,1]=4 463 B13R1.405 O=C(O)[C@@H](NCF)c1ccccc1 48d09161f902cbdc22e5f35f493fdde7 [0,2,0,0,0,0|1,0,1]=4 464 B13R1.405 O=C(O)[C@@H](NCO)c1ccccc1 ba8eabe17018ad22490c7c850008370b [0,2,0,0,0,0|1,0,1]=4 465 B13R1.405 O=C(O)[C@@H](OCF)c1ccccc1 61775100312073eda0e34d8b62fb2254 [0,2,0,0,0,0|1,0,1]=4 466 B13R1.405 O=C(O)[C@H](NCF)c1ccccc1 12170a0dd494513e71bb9cf266a09a69 [0,2,0,0,0,0|1,0,1]=4 467 B13R1.405 O=C(O)[C@H](NCO)c1ccccc1 f7474bd1c72a2d1b5e0ad9a2a2e446d9 [0,2,0,0,0,0|1,0,1]=4 468 B13R1.405 O=C(O)[C@H](OCF)c1ccccc1 e24f0f0979ad51ee6162490ba466ae90 [0,2,0,0,0,0|1,0,1]=4 469 B13R1.532 C=CC(=O)N(CC)c1ccccc1 667b07f2c5c88d47e8105ee3c9dd404a [0,2,0,0,0,0|1,0,1]=4 470 B13R1.532 CC(C=O)N(C=O)c1ccccc1 3fac2487132ca501aeed6fa1a2da7751 [0,2,0,0,0,0|1,0,1]=4 471 B13R1.532 CCC(c1ccccc1)N(C)C=O 0baedd380245cbde3752614e065679d3 [0,2,0,0,0,0|0,0,2]=4 472 B13R1.532 CCN(C(=O)C=O)c1ccccc1 9559fcaa03138ac2ec1f8c16cf2ce2f1 [0,2,0,0,0,0|1,0,1]=4 473 B13R1.532 CCN(C)C(C=O)c1ccccc1 f990741681601dfdd34b91c11a5b4755 [0,2,0,0,0,0|0,0,2]=4 474 B13R1.532 CCN(c1ccccc1)C(C)C=O e60164abf42dbc83dcf380f3b4cc5b7b [0,2,0,0,0,0|1,0,1]=4 475 B13R1.532 CCN(c1ccccc1)[C@H](C)C=O 22a7a8af9f964f7979830eae70ee4056 [0,2,0,0,0,0|1,0,1]=4 476 B13R1.713 C=CC(NC(=O)C)c1ccccc1 5bb063b42c840d7013ecb1423ee42561 [0,2,0,0,0,0|0,0,2]=4 477 B13R1.713 C=C[C@@H](NC(=O)C)c1ccccc1 06a330712eecb774846e09b51cf8bcf6 [0,2,0,0,0,0|0,0,2]=4 478 B13R1.713 C=C[C@H](NC(=O)C)c1ccccc1 d1024d4aee3b5a479a166e0e048d5f03 [0,2,0,0,0,0|0,0,2]=4 479 B13R1.713 CC(C)OC(C=O)c1ccccc1 355a7c4982edcf5a0ba8a1ae1b147522 [0,2,0,0,0,0|0,0,2]=4 480 B13R1.713 CCC(NC(=O)C)c1ccccc1 4b108746296086381277dbefdf93545f [0,2,0,0,0,0|0,0,2]=4 481 B13R1.713 CCN(CC(=O)N)c1ccccc1 30fab9fca94f2264463c62b9e3db24e9 [0,2,0,0,0,0|1,0,1]=4 482 B13R1.713 CCN(CC(=O)O)c1ccccc1 f96341975e42fad0db4dd3b5f9c74de6 [0,2,0,0,0,0|1,0,1]=4 483 B13R1.713 CC[C@@H](NC(=O)C)c1ccccc1 dad02339beaab90891ee585072e399a5 [0,2,0,0,0,0|0,0,2]=4 484 B13R1.713 CC[C@H](NC(=O)C)c1ccccc1 1d4236e7dfe81bf263a1136947ca95b3 [0,2,0,0,0,0|0,0,2]=4 485 B13R1.713 C[C@@H](O)CN(C=O)c1ccccc1 94b821f978f07f83231d214ed7a9ca05 [0,2,0,0,0,0|1,0,1]=4 486 B13R1.713 NC(=O)CN(C=O)c1ccccc1 0ce7cef2746c0460ed6098b983d04635 [0,2,0,0,0,0|2,0,0]=4 487 B13R1.39 CCN(C=O)c1ccc(cc1)C#N 2b49856b3e07cd647b8a42aa4ee41222 [0,2,0,0,0,0|1,0,1]=4 488 B13R1.39 CCN(C=O)c1ccc(cc1)C=O b6365f4a31c0c825d8d8133ed4c134fd [0,2,0,0,0,0|1,0,1]=4 489 B13R1.39 CCN(C=O)c1ccc(cc1)OC 9f82661be903fe49951d168600e2be9a [0,2,0,0,0,0|1,0,1]=4 490 B13R1.39 CCc1ccc(cc1)N(C=O)CC 5410996f4e53943545505efe1ec1752a [0,2,0,0,0,0|1,0,1]=4 491 B13R1.331 CCN(C=O)c1ccc(c(c1)Br)F c09057f1c9d5d8eb77318cf443f73d6f [0,2,0,0,0,0|1,0,1]=4 492 B13R1.331 CCN(C=O)c1ccc(c(c1)C)C 47ef57e9bde262bb149c3b0b88b6704e [0,2,0,0,0,0|1,0,1]=4 493 B13R1.331 CCN(C=O)c1ccc(c(c1)Cl)Cl 33ae1655dfda84d1d96ad03bf69f4d5c [0,2,0,0,0,0|1,0,1]=4 494 B13R1.331 CCN(C=O)c1ccc(c(c1)Cl)F 9e81bdfe29c75f98b8ad267f0821ed36 [0,2,0,0,0,0|1,0,1]=4 495 B13R1.331 CCN(C=O)c1ccc(c(c1)F)F d7158311dbac00e492f38ece486a256f [0,2,0,0,0,0|1,0,1]=4 496 B13R1.706 CC(C)N(C=O)c1ccc(cc1)Br cabf1dcc49c3472cbc8fccc51de1ce53 [0,2,0,0,0,0|1,0,1]=4 497 B13R1.706 CC(C)N(C=O)c1ccc(cc1)Cl 2f05344ed6d77798a8268260333d8dbd [0,2,0,0,0,0|1,0,1]=4 498 B13R1.706 CC(C)N(C=O)c1ccc(cc1)F 287920e47d7e0eb3e17ed87149a63571 [0,2,0,0,0,0|1,0,1]=4 499 B13R1.706 CC(C)N(C=O)c1ccc(cc1)O 95352495f54c429596f8afedad81bd28 [0,2,0,0,0,0|1,0,1]=4 500 B13R1.706 CCN(C(=O)C)c1ccc(cc1)C 3eeb1b73d86deac2e7c9db5a77095999 [0,2,0,0,0,0|1,0,1]=4 501 B13R1.706 CCN(C(=O)C)c1ccc(cc1)F 81ae7f726c70d922360aedc53dae0a21 [0,2,0,0,0,0|1,0,1]=4 502 B13R1.706 CCN(C(=O)C)c1ccc(cc1)O 657074e2f55da469be87babbf7cc6943 [0,2,0,0,0,0|1,0,1]=4 503 B13R1.706 Cc1ccc(cc1)N(C=O)C(C)C 26a1073caa4cc770c003903e807909d6 [0,2,0,0,0,0|1,0,1]=4 504 B13R1.961 CCN(C=O)c1ccc(cc1C)F bcaa956cb4b87ed7148ec4ddf2bff625 [0,2,0,0,0,0|1,0,1]=4 505 B13R1.961 CCN(C=O)c1ccc(cc1Cl)Cl f1ad4c9a2cef5852e2ab141725c405fe [0,2,0,0,0,0|1,0,1]=4 506 B13R1.961 CCN(C=O)c1ccc(cc1F)C d2dc92a80232288a9e152d961a5a7174 [0,2,0,0,0,0|1,0,1]=4 507 B13R1.8 CCN(C=O)c1cccc(c1C)C b8f4196795d708202c2cd5b6593a227c [0,2,0,0,0,0|1,0,1]=4 508 B13R1.8 CCN(C=O)c1cccc(c1Cl)Cl 5f0f110e40bdd0f23ffa470ca50eefc5 [0,2,0,0,0,0|1,0,1]=4 509 B13R1.8 CCN(C=O)c1cccc(c1F)Br d392a72bf7d9465b9b4a8dbc396f06ea [0,2,0,0,0,0|1,0,1]=4 510 B13R1.317 CCN(C=O)c1cc(ccc1C)O ca0be5eec2434cc9bb29b29167eca733 [0,2,0,0,0,0|1,0,1]=4 511 B13R1.317 CCN(C=O)c1cc(ccc1Cl)Cl 1f26e7ae43e46167cb1485a530154c91 [0,2,0,0,0,0|1,0,1]=4 512 B13R1.317 CCN(C=O)c1cc(ccc1O)C 6f6a891fb2ab21f77e9269a511b96bde [0,2,0,0,0,0|1,0,1]=4 513 B13R1.321 CCN(C=O)c1cc(cc(c1)Br)C e960e04224c007681856840d1384f53d [0,2,0,0,0,0|1,0,1]=4 514 B13R1.321 CCN(C=O)c1cc(cc(c1)C)C b41e2317d6465bdb75d15d39ed119c2d [0,2,0,0,0,0|1,0,1]=4 515 B13R1.321 CCN(C=O)c1cc(cc(c1)Cl)Cl b8a02954451a3db10911740712141fa2 [0,2,0,0,0,0|1,0,1]=4 516 B13R1.646 C#Cc1cccc(c1)N(C=O)CC 1eafad47206b4ef4371a375138fa51ea [0,2,0,0,0,0|1,0,1]=4 517 B13R1.646 CCN(C=O)c1cccc(c1)C#N b8ea772f211c606c723b6bfbf57712b8 [0,2,0,0,0,0|1,0,1]=4 518 B13R1.646 CCN(C=O)c1cccc(c1)OC 503b22083f556bb002f04f1f4c2b918d [0,2,0,0,0,0|1,0,1]=4 519 B13R1.646 CCc1cccc(c1)N(C=O)CC 3e17f905c53a9c0def5ff70890f9aa63 [0,2,0,0,0,0|1,0,1]=4 520 B13R1.716 CC(C)N(C=O)c1cccc(c1)Br 038a4ced7ef0c0d597c1e869c1a4bb0c [0,2,0,0,0,0|1,0,1]=4 521 B13R1.716 CC(C)N(C=O)c1cccc(c1)Cl 687e6aed41296e49433e01f9c875fafd [0,2,0,0,0,0|1,0,1]=4 522 B13R1.716 CC(C)N(C=O)c1cccc(c1)F d3d6dbc80813d3079d78bdff63e95962 [0,2,0,0,0,0|1,0,1]=4 523 B13R1.716 CCN(C(=O)C)c1cccc(c1)C 742017ec6a3683b0d6b6f454f74b211f [0,2,0,0,0,0|1,0,1]=4 524 B13R1.716 CCN(C(=O)C)c1cccc(c1)Cl e9a9cd9ee00ccd14af6d68cda4005428 [0,2,0,0,0,0|1,0,1]=4 525 B13R1.716 CCN(C(=O)C)c1cccc(c1)F 054fd87560b820132be6205250552e4a [0,2,0,0,0,0|1,0,1]=4 526 B13R1.716 CCN(C(=O)C)c1cccc(c1)O fdc230537d6903215b70c1d170f2cb32 [0,2,0,0,0,0|1,0,1]=4 527 B13R1.716 Cc1cccc(c1)N(C=O)C(C)C 54e552d3b539301982ba49d5574c32c1 [0,2,0,0,0,0|1,0,1]=4 528 B13R1.92 CCN(C=O)c1ccccc1C#N ad8235adb726648081e1a58b561db900 [0,2,0,0,0,0|1,0,1]=4 529 B13R1.92 CCN(C=O)c1ccccc1OC ebd49bb267c12f9ea450239b6be35700 [0,2,0,0,0,0|1,0,1]=4 530 B13R1.720 CC(C)N(C=O)c1ccccc1Br 60a484452b580ceab0f4d1d22ce72ef7 [0,2,0,0,0,0|1,0,1]=4 531 B13R1.720 CC(C)N(C=O)c1ccccc1F 079f04c5fb9349fc8d61462c587552fa [0,2,0,0,0,0|1,0,1]=4 532 B13R1.720 CC(C)N(C=O)c1ccccc1S c57439dc7556967d529b0305f7187cbc [0,2,0,0,0,0|1,0,1]=4 533 B13R1.720 CCN(C(=O)C)c1ccccc1C d8bb972729fdc5adb0527460e9ac65a0 [0,2,0,0,0,0|1,0,1]=4 534 B13R1.720 CCN(C(=O)C)c1ccccc1Cl a6716135a6bf3e7c0d556056da72ab3e [0,2,0,0,0,0|1,0,1]=4 535 B13R1.720 CCN(C(=O)C)c1ccccc1F b3bddc2540e649f9e9a5a0e30a3fed34 [0,2,0,0,0,0|1,0,1]=4 536 B13R1.720 CCN(C(=O)C)c1ccccc1O 33b1782bee2750e2e7512a99fe783f8e [0,2,0,0,0,0|1,0,1]=4 537 B13R1.720 Cc1ccccc1N(C=O)C(C)C 601d6e8bfa2df10855d01210e1df0692 [0,2,0,0,0,0|1,0,1]=4 538 B13R1.8528 CCN(C=O)c1c(cccc1C)C 56032f37eb500b636dfee9e5f863869f [0,2,0,0,0,0|1,0,1]=4 539 B13R1.8528 CCN(C=O)c1c(cccc1Cl)Cl 8cad4fbc7e5bee84ce8cbca2a47d4162 [0,2,0,0,0,0|1,0,1]=4 540 B13R2.27 O=C1CCC1Nc2ccccc2 19af677ce18a39a689c42bbc9ddc96eb [0,0,0,1,0,1|0,0,2]=4 541 B13R2.45 C[C@@H]1c2ccccc2CN1C=O 429897fb571653c308d7f9fef4ff95f7 [0,0,0,1,0,1|1,0,1]=4 542 B13R2.57 O=CN1CCc2ccccc2C1 ca6a2fd7719eafb50844fee2e23df55a [0,0,0,1,0,1|1,0,1]=4 543 B13R2.64 c1ccc(cc1)Nc2ccoc2 b6ffc45b3cd7de1d8ee1b38b2e6c6d07 [0,0,0,1,0,1|0,0,2]=4 544 B13R2.64 c1ccc(cc1)Nc2ccsc2 323d37588015eb6112eeaa5c551608d9 [0,0,0,1,0,1|0,1,1]=4 545 B13R2.64 c1ccc(cc1)Nc2cnoc2 ae0b2140a9014f56929ddfc62b3b3da6 [0,0,0,1,0,1|1,0,1]=4 546 B13R2.64 c1ccc(cc1)Nc2cnsc2 f9552c32abb664d868b4a2d1994cf24d [0,0,0,1,0,1|1,1,0]=4 547 B13R2.138 CC1C(N1C=O)c2ccccc2 6bb296f9ab876c2e3544e957c36bf4f6 [0,0,0,1,0,1|1,0,1]=4 548 B13R2.138 C[C@@H]1[C@@H](N1C=O)c2ccccc2 891cf643b1f320871fa8e665073b90ac [0,0,0,1,0,1|1,0,1]=4 549 B13R2.1 CCNc1c[nH]c2c1cccc2 4920bd96e85cfd1292a4b6790abfcbf3 [0,1,0,1,0,0|1,0,1]=4 550 B13R2.1 CCNc1csc2c1cccc2 6dd41b9f0a78472cc182ab65508da2ad [0,1,0,1,0,0|0,1,1]=4 551 B13R2.1 CCOc1c[nH]c2c1cccc2 0854f2bc586a3a00282d60e462292aa5 [0,1,0,1,0,0|1,0,1]=4 552 B13R2.1 CCOc1coc2c1cccc2 60e06b3be66452591e08d10f7c2531c3 [0,1,0,1,0,0|0,0,2]=4 553 B13R2.1 CCOc1csc2c1cccc2 0531aa4e79aafb0c2ad76af3c74634cc [0,1,0,1,0,0|0,1,1]=4 554 B13R2.1 FCNc1c[nH]c2c1cccc2 59ba68714c6b2533ed2b55defcd1ee5a [0,1,0,1,0,0|2,0,0]=4 555 B13R2.1 FCNc1csc2c1cccc2 212bbe2c97437f4fa61695197661b592 [0,1,0,1,0,0|1,1,0]=4 556 B13R2.1 FCOc1c[nH]c2c1cccc2 da15a515e28ff15939c74134cf2a81ae [0,1,0,1,0,0|2,0,0]=4 557 B13R2.1 FCOc1coc2c1cccc2 ddaeb88a44ef99c9a53dfb2f60f58ed7 [0,1,0,1,0,0|1,0,1]=4 558 B13R2.1 FCOc1csc2c1cccc2 7b0f63fc5d7cbb8fc096f225954dda60 [0,1,0,1,0,0|1,1,0]=4 559 B13R2.1 O=CCN1CCc2c1cccc2 42a5659aae6fcaaea8dfeeb692f2d2a9 [0,1,0,1,0,0|1,0,1]=4 560 B13R2.1 O=CNC1CCc2c1cccc2 a8252a75d7e4723b941feb36cd0e250e [0,1,0,1,0,0|0,0,2]=4 561 B13R2.1 O=CN[C@@H]1CCc2c1cccc2 1821c8c3e70e0e57618f78559a876272 [0,1,0,1,0,0|0,0,2]=4 562 B13R2.1 O=CN[C@H]1CCc2c1cccc2 ca095098699942f1370ae31f78085fe2 [0,1,0,1,0,0|0,0,2]=4 563 B13R2.1 O=CNc1cnc2n1cccc2 77adfad380951ccb6a2c83f4b50e13c0 [0,1,0,1,0,0|2,0,0]=4 564 B13R2.1 O=CNc1cnn2c1cccc2 75949dda9a142c47c9b2d59ff3b8d45a [0,1,0,1,0,0|2,0,0]=4 565 B13R2.1 O=CNc1csc2c1cccc2 3b86149a01be6b0ff4138172f4897a75 [0,1,0,1,0,0|1,0,0]=3 566 B13R2.1 O=CNc1csc2c1cccn2 bf1bc04ca4a1a1dfbb7a9dd1d19a291f [0,1,0,1,0,0|2,0,0]=4 567 B13R2.1 O=CNc1csc2c1cncc2 27c3db24ab0d9b227543dbe56a50abca [0,1,0,1,0,0|2,0,0]=4 568 B13R2.1 O=CNc1csc2c1nccc2 6f0c88d8fe4d2456dcd4b1558f373a31 [0,1,0,1,0,0|2,0,0]=4 569 B13R2.1 O=CNc1noc2c1cccc2 011515c155eaf6a6eb19c97b5cc579bc [0,1,0,1,0,0|2,0,0]=4 570 B13R2.1 O=CNc1nsc2c1cccc2 045a448649021c5c23c33262071db6e7 [0,1,0,1,0,0|2,0,0]=4 571 B13R2.1 O=CNc1onc2c1cccc2 d6a996f88e5debe6667364d8020bbae5 [0,1,0,1,0,0|2,0,0]=4 572 B13R2.1 O=CNc1snc2c1cccc2 661241492611075ac7a275c40ddc5285 [0,1,0,1,0,0|2,0,0]=4 573 B13R2.1 OCNc1c[nH]c2c1cccc2 e44d4aa993e29879a79d02f560bb5b04 [0,1,0,1,0,0|2,0,0]=4 574 B13R2.1 OCNc1csc2c1cccc2 140c460ff7852dfd589d95a08181a842 [0,1,0,1,0,0|1,1,0]=4 575 B13R2.3 c1ccc(cc1)c2ccccc2 0c130c5194829f75e6212547c9058852 [0,1,0,1,0,0|1,0,1]=4 576 B13R2.3 c1ccc(cc1)c2ccccn2 659ed5063976b22f39e255c3a00e90ff [0,1,0,1,0,0|1,0,1]=4 577 B13R2.3 c1ccc(cc1)c2cccnc2 aede9e2c1a2e5e3f69dd9bab53763184 [0,1,0,1,0,0|1,0,1]=4 578 B13R2.3 c1ccc(cc1)c2ccncc2 ab32915c52ae423a893ab43d3a4fa249 [0,1,0,1,0,0|1,0,1]=4 579 B13R2.3 c1ccc(cc1)c2ccncn2 3f3aa2337d3cb760d7710b5369619b71 [0,1,0,1,0,0|1,0,1]=4 580 B13R2.3 c1ccc(cc1)c2ccnnc2 21cc29227ea0a2a69235d12b57806490 [0,1,0,1,0,0|1,0,1]=4 581 B13R2.3 c1ccc(cc1)c2cnccn2 06bb879b80cb780eb3d40706097ed70b [0,1,0,1,0,0|1,0,1]=4 582 B13R2.3 c1ccc(cc1)c2cncnc2 800bc60e83c77d88b6140f729ae2256d [0,1,0,1,0,0|1,0,1]=4 583 B13R2.3 c1ccc(cc1)c2cnnnc2 d04695c25598b200d386ae5a0de0e298 [0,1,0,1,0,0|2,0,0]=4 584 B13R2.10 Brc1ccc(o1)c2ccccc2 a128649fb04583a8b78e4e76f43445c5 [0,1,0,1,0,0|1,0,1]=4 585 B13R2.10 Brc1ccc(s1)c2ccccc2 55b2d08b83323a18d6f71f71ffda41b3 [0,1,0,1,0,0|1,0,1]=4 586 B13R2.10 Brc1ncc(s1)c2ccccc2 3b87915993e0b1a12c260b8dc72f8730 [0,1,0,1,0,0|2,0,0]=4 587 B13R2.10 Cc1c[nH]c(n1)c2ccccc2 059516ef67247868640aa09654bdba8b [0,1,0,1,0,0|2,0,0]=4 588 B13R2.10 Cc1cc(c[nH]1)c2ccccc2 3f3e7bdaff1ee9796c664f15107c31bb [0,1,0,1,0,0|1,0,0]=3 589 B13R2.10 Cc1cc(c[nH]1)c2ccccn2 48ab5649c8fcf1f68d8fd764e134fd5b [0,1,0,1,0,0|2,0,0]=4 590 B13R2.10 Cc1cc(c[nH]1)c2cccnc2 9ac56f0f11526e0e39b066a09e4bff9c [0,1,0,1,0,0|2,0,0]=4 591 B13R2.10 Cc1cc(c[nH]1)c2ccncc2 7b5c1ac8aa3c06bf9d5b06f55ad2f622 [0,1,0,1,0,0|2,0,0]=4 592 B13R2.10 Cc1cc(cs1)c2ccccc2 cb644a43544e7da075abe876c7fb3b0f [0,1,0,1,0,0|0,1,0]=3 593 B13R2.10 Cc1cc(cs1)c2ccccn2 a54954315c3bf76656ddca21a514f23c [0,1,0,1,0,0|1,1,0]=4 594 B13R2.10 Cc1cc(cs1)c2cccnc2 ba4020379e5c9537e7865c1429ef3170 [0,1,0,1,0,0|1,1,0]=4 595 B13R2.10 Cc1cc(cs1)c2ccncc2 9eba7335c9d9a6fd3f3402420576078c [0,1,0,1,0,0|1,1,0]=4 596 B13R2.10 Cc1cc(n[nH]1)c2ccccc2 771e997f19829b3ff242367ebf486de5 [0,1,0,1,0,0|2,0,0]=4 597 B13R2.10 Cc1cc(no1)c2ccccc2 f377d78335fce3bf0c94dfeb8bc1b6a5 [0,1,0,1,0,0|1,0,1]=4 598 B13R2.10 Cc1cc(ns1)c2ccccc2 c5d7c46dd637a9e664886d96725fa74b [0,1,0,1,0,0|1,1,0]=4 599 B13R2.10 Cc1cc(on1)c2ccccc2 8aa0d052c9e30fcd44c374e36bf93612 [0,1,0,1,0,0|2,0,0]=4 600 B13R2.10 Cc1cc(sn1)c2ccccc2 e0a0a0d6e009cc92a199f109fe342a12 [0,1,0,1,0,0|2,0,0]=4 601 B13R2.10 Cc1ccc([nH]1)c2ccccc2 90f6f36bf62aa313fa0225b68caaef78 [0,1,0,1,0,0|1,0,0]=3 602 B13R2.10 Cc1ccc([nH]1)c2ccccn2 5930d438204f534d6811e1afdddc2269 [0,1,0,1,0,0|2,0,0]=4 603 B13R2.10 Cc1ccc([nH]1)c2cccnc2 15b323e5189925426efeab9c6e2feb48 [0,1,0,1,0,0|2,0,0]=4 604 B13R2.10 Cc1ccc([nH]1)c2ccncc2 d446108101c965626559421573c2a682 [0,1,0,1,0,0|2,0,0]=4 605 B13R2.10 Cc1ccc(o1)c2ccccc2 4fcff6ba21693662fadcf2b756a10be4 [0,1,0,1,0,0|1,0,0]=3 606 B13R2.10 Cc1ccc(o1)c2ccccn2 0e4b8566254a16039242d5f160c8848d [0,1,0,1,0,0|2,0,0]=4 607 B13R2.10 Cc1ccc(o1)c2cccnc2 0d1d5771607adc0b7fd797407bad5c41 [0,1,0,1,0,0|2,0,0]=4 608 B13R2.10 Cc1ccc(o1)c2ccncc2 86194b54d0a1152f37beddc5dfe976b1 [0,1,0,1,0,0|2,0,0]=4 609 B13R2.10 Cc1ccc(s1)c2ccccc2 32546833c9c253a429939eb351a15996 [0,1,0,1,0,0|1,0,0]=3 610 B13R2.10 Cc1ccc(s1)c2ccccn2 a0db4652b0f446a4b89de5a0cadb08b0 [0,1,0,1,0,0|2,0,0]=4 611 B13R2.10 Cc1ccc(s1)c2cccnc2 dec11150c8c1d81cbf9856fb34f1523e [0,1,0,1,0,0|2,0,0]=4 612 B13R2.10 Cc1ccc(s1)c2ccncc2 641685a7b066f91af658eaab8a45ad70 [0,1,0,1,0,0|2,0,0]=4 613 B13R2.10 Cc1ccn(n1)c2ccccc2 0332f1659baa7fac23f0b09b1d708d4a [0,1,0,1,0,0|2,0,0]=4 614 B13R2.10 Cc1cnc(o1)c2ccccc2 8be3dfddb880dcb9f44d2ed553f1e2bf [0,1,0,1,0,0|2,0,0]=4 615 B13R2.10 Cc1cnc(s1)c2ccccc2 789c9d6e47722c2c848a08828eb60134 [0,1,0,1,0,0|2,0,0]=4 616 B13R2.10 Cc1coc(c1)c2ccccc2 54c39e2e17614b64e0e91f8d08357a5f [0,1,0,1,0,0|2,0,0]=4 617 B13R2.10 Cc1coc(n1)c2ccccc2 ae62d0a7a03ddcad3951e8f063376e25 [0,1,0,1,0,0|2,0,0]=4 618 B13R2.10 Cc1csc(c1)c2ccccc2 a86185f4b4a8295a0a99b110dd5bf5ce [0,1,0,1,0,0|2,0,0]=4 619 B13R2.10 Cc1csc(n1)c2ccccc2 8bdb5009b4774f97acaf333c19e14f52 [0,1,0,1,0,0|2,0,0]=4 620 B13R2.10 Cc1nc(c[nH]1)c2ccccc2 b64d8ffb67dae24db2d4f626d9f225e7 [0,1,0,1,0,0|1,0,0]=3 621 B13R2.10 Cc1nc(c[nH]1)c2ccccn2 d2c11c53e26389ec604dc62153a509ae [0,1,0,1,0,0|2,0,0]=4 622 B13R2.10 Cc1nc(c[nH]1)c2cccnc2 70193ecaaf99a9165f38d44a783d6f9a [0,1,0,1,0,0|2,0,0]=4 623 B13R2.10 Cc1nc(c[nH]1)c2ccncc2 bfa0da47864d8fa381969182bc38f1c0 [0,1,0,1,0,0|2,0,0]=4 624 B13R2.10 Cc1nc(co1)c2ccccc2 154b2a2d0cf0112f1be8c5c50e015e11 [0,1,0,1,0,0|0,0,1]=3 625 B13R2.10 Cc1nc(co1)c2ccccn2 452feb9d42a3628e21b96741453d23f8 [0,1,0,1,0,0|1,0,1]=4 626 B13R2.10 Cc1nc(co1)c2cccnc2 bbf70818fd64a3de8fb70173a9c30f96 [0,1,0,1,0,0|1,0,1]=4 627 B13R2.10 Cc1nc(co1)c2ccncc2 ebe6cedacd5ad82968e83e5d1d85ff55 [0,1,0,1,0,0|1,0,1]=4 628 B13R2.10 Cc1nc(cs1)c2ccccc2 cb3c9bb03d92ef8c14a7795b6c8ad6e9 [0,1,0,1,0,0|0,1,0]=3 629 B13R2.10 Cc1nc(cs1)c2ccccn2 a3678b4edba06371e58fe6b9fad0b5a6 [0,1,0,1,0,0|1,1,0]=4 630 B13R2.10 Cc1nc(cs1)c2cccnc2 1212bc08d296c361ca436b9ef4314e71 [0,1,0,1,0,0|1,1,0]=4 631 B13R2.10 Cc1nc(cs1)c2ccncc2 88128614733f6c0d0ae97c18b3efdb19 [0,1,0,1,0,0|1,1,0]=4 632 B13R2.10 Cc1nc(n[nH]1)c2ccccc2 9840e3acf9976f21a23626e31f2080ca [0,1,0,1,0,0|2,0,0]=4 633 B13R2.10 Cc1nc(no1)c2ccccc2 4ef251e391fe7a6a2de0087a17fbc546 [0,1,0,1,0,0|1,0,1]=4 634 B13R2.10 Cc1nc(ns1)c2ccccc2 ecf44b12ce7e5d0ccec4a5499621ac2f [0,1,0,1,0,0|1,1,0]=4 635 B13R2.10 Cc1ncc(o1)c2ccccc2 985733a4b804c9a5227f4d50087af44a [0,1,0,1,0,0|1,0,0]=3 636 B13R2.10 Cc1ncc(o1)c2ccccn2 15a23530cbbb24148a7f705bed3bd2d4 [0,1,0,1,0,0|2,0,0]=4 637 B13R2.10 Cc1ncc(o1)c2cccnc2 b7b3c0a5d297fb10d8229fa666325778 [0,1,0,1,0,0|2,0,0]=4 638 B13R2.10 Cc1ncc(o1)c2ccncc2 e22c1b266cf146527d82b1806d63cc5e [0,1,0,1,0,0|2,0,0]=4 639 B13R2.10 Cc1ncc(s1)c2ccccc2 69140b3e1485059f8c91c522b83c9257 [0,1,0,1,0,0|1,0,0]=3 640 B13R2.10 Cc1ncc(s1)c2ccccn2 d5f8b64a286212dc661492db5c6b89e8 [0,1,0,1,0,0|2,0,0]=4 641 B13R2.10 Cc1ncc(s1)c2cccnc2 8419f7708e55d5d4d46364b0aa1a0a6a [0,1,0,1,0,0|2,0,0]=4 642 B13R2.10 Cc1ncc(s1)c2ccncc2 ad6ef8d60216289c1555ea10f194edc7 [0,1,0,1,0,0|2,0,0]=4 643 B13R2.10 Cc1nnc(o1)c2ccccc2 92a516d60d6164c27ce0f67a28d224d9 [0,1,0,1,0,0|2,0,0]=4 644 B13R2.10 Cc1nnc(s1)c2ccccc2 5eb53e80dd6a19f63093482a5020f4dc [0,1,0,1,0,0|2,0,0]=4 645 B13R2.10 Cc1noc(n1)c2ccccc2 02b7093a9dc3219517391e3c24642e52 [0,1,0,1,0,0|2,0,0]=4 646 B13R2.10 Cc1nsc(n1)c2ccccc2 3f38b7c577240eadb7b7d4cac24b8828 [0,1,0,1,0,0|2,0,0]=4 647 B13R2.10 Clc1cc(cs1)c2ccccc2 a2a939b3b7024e409a79f4a3debe2b20 [0,1,0,1,0,0|0,1,1]=4 648 B13R2.10 Clc1ccc(s1)c2ccccc2 f90c7362950a90441e33d660dd38b52c [0,1,0,1,0,0|1,0,1]=4 649 B13R2.10 Clc1ncc(s1)c2ccccc2 1bbcc620beb4db2b58701f1ef67d0c25 [0,1,0,1,0,0|2,0,0]=4 650 B13R2.10 Cn1cc(cn1)c2ccccc2 620d2f627362b9033388f9cd66687004 [0,1,0,1,0,0|1,0,0]=3 651 B13R2.10 Cn1cc(cn1)c2ccccn2 7f370f0b6d15c507724402f2fc5f2e1d [0,1,0,1,0,0|2,0,0]=4 652 B13R2.10 Cn1cc(cn1)c2cccnc2 36e03defca1d2b0e649ba40b04fad9bf [0,1,0,1,0,0|2,0,0]=4 653 B13R2.10 Cn1cc(cn1)c2ccncc2 27d1ffb3b197c31a844615ddfe7a0a40 [0,1,0,1,0,0|2,0,0]=4 654 B13R2.10 Cn1cc(nn1)c2ccccc2 219c21ef8df00287393ab2814c37d44f [0,1,0,1,0,0|2,0,0]=4 655 B13R2.10 Cn1ccc(c1)c2ccccc2 6a1e203c932d2ee75ebaf29b63159997 [0,1,0,1,0,0|1,0,0]=3 656 B13R2.10 Cn1ccc(c1)c2ccccn2 94b18469c9ad631b4753cbad0489a376 [0,1,0,1,0,0|2,0,0]=4 657 B13R2.10 Cn1ccc(c1)c2cccnc2 dad0e8f4fdd163c9fc7f0c145533c329 [0,1,0,1,0,0|2,0,0]=4 658 B13R2.10 Cn1ccc(c1)c2ccncc2 da0362da345f5ffaa1c800a6172afc6e [0,1,0,1,0,0|2,0,0]=4 659 B13R2.10 Cn1ccc(n1)c2ccccc2 f74614d34c76a68fe54c829611626fb8 [0,1,0,1,0,0|2,0,0]=4 660 B13R2.10 Cn1cnc(c1)c2ccccc2 e71b949ce62746dac4d81eef9fb386ad [0,1,0,1,0,0|2,0,0]=4 661 B13R2.10 Cn1ncc(n1)c2ccccc2 2a29ad98940bbe0fb40eebb082952af7 [0,1,0,1,0,0|2,0,0]=4 662 B13R2.10 Fc1ccc(s1)c2ccccc2 82fbdd9d7428d70c1834b3ef40f55e6c [0,1,0,1,0,0|1,0,1]=4 663 B13R2.10 Ic1ccc(s1)c2ccccc2 932f5962d4faf448fa3659cb70560529 [0,1,0,1,0,0|1,0,1]=4 664 B13R2.10 Nc1ccc(s1)c2ccccc2 ca1bd6de272e22cdb4783ddb923c1ced [0,1,0,1,0,0|1,0,1]=4 665 B13R2.10 Nc1nc(c[nH]1)c2ccccc2 704c494e7ed0964cbdb202a28ca2d47b [0,1,0,1,0,0|2,0,0]=4 666 B13R2.10 Nc1nc(co1)c2ccccc2 c6a1a80f21c3f9f974cf52a67ba78947 [0,1,0,1,0,0|1,0,1]=4 667 B13R2.10 Nc1nc(cs1)c2ccccc2 7e0f852930d6c0fcbd191a3870954a29 [0,1,0,1,0,0|1,1,0]=4 668 B13R2.10 Nc1ncc(s1)c2ccccc2 46f7b1ccc007b1ec5c5a7f968c26b349 [0,1,0,1,0,0|2,0,0]=4 669 B13R2.10 Oc1ccc(s1)c2ccccc2 e85fb471368bfbab264bb537d277c747 [0,1,0,1,0,0|0,0,2]=4 670 B13R2.10 Oc1nc(cs1)c2ccccc2 07a1e2d0514cc115ae4a41c7659d4307 [0,1,0,1,0,0|1,0,1]=4 671 B13R2.10 On1cc(cn1)c2ccccc2 5a341cd0711914f662b7edc2dd0c142b [0,1,0,1,0,0|1,0,1]=4 672 B13R2.15 Brc1ccsc1c2ccccc2 cdc2f371d79c4e01c1a0e63d6486d540 [0,1,0,1,0,0|1,0,1]=4 673 B13R2.15 Brc1cscc1c2ccccc2 b99d399c34f1c857651815dd1331a73c [0,1,0,1,0,0|0,1,1]=4 674 B13R2.15 Cc1[nH]cnc1c2ccccc2 badddfccb2322d5bb47e1ed70ba7d06a [0,1,0,1,0,0|1,0,0]=3 675 B13R2.15 Cc1[nH]cnc1c2ccccn2 ae546c0e3ab994e7cdc4d6873b5c049e [0,1,0,1,0,0|2,0,0]=4 676 B13R2.15 Cc1[nH]cnc1c2cccnc2 5a502c2208046950cd5359d0ec871112 [0,1,0,1,0,0|2,0,0]=4 677 B13R2.15 Cc1[nH]cnc1c2ccncc2 72f568190f299eab8bd723e2c4882b78 [0,1,0,1,0,0|2,0,0]=4 678 B13R2.15 Cc1c[nH]nc1c2ccccc2 1f0c53f6fa80b22b48cdfd2fcb5b175d [0,1,0,1,0,0|2,0,0]=4 679 B13R2.15 Cc1ccsc1c2ccccc2 bcc5a512146bdbef2e0a143f4e1609d6 [0,1,0,1,0,0|1,0,0]=3 680 B13R2.15 Cc1ccsc1c2ccccn2 c4651c389f399a5ad392354cbaad6a04 [0,1,0,1,0,0|2,0,0]=4 681 B13R2.15 Cc1ccsc1c2cccnc2 263d32afa0ae4485b31d36af40c398dd [0,1,0,1,0,0|2,0,0]=4 682 B13R2.15 Cc1ccsc1c2ccncc2 ca8859486ab251cfb0f9271361a70f74 [0,1,0,1,0,0|2,0,0]=4 683 B13R2.15 Cc1cnsc1c2ccccc2 4a48ae73e91c675b4594dbc432a800f7 [0,1,0,1,0,0|2,0,0]=4 684 B13R2.15 Cc1conc1c2ccccc2 5181cdb09d64324a18a253827b4590a2 [0,1,0,1,0,0|1,0,1]=4 685 B13R2.15 Cc1cscc1c2ccccc2 9a5b49604e9cfa78e7251764322e9988 [0,1,0,1,0,0|0,1,0]=3 686 B13R2.15 Cc1cscc1c2ccccn2 60f0d9592a845e54463d02275fe979c6 [0,1,0,1,0,0|1,1,0]=4 687 B13R2.15 Cc1cscc1c2cccnc2 e7d76961fed63223a0b7ee1974424477 [0,1,0,1,0,0|1,1,0]=4 688 B13R2.15 Cc1cscc1c2ccncc2 77993ffdd5d76c1ece91b89d9fcfd344 [0,1,0,1,0,0|1,1,0]=4 689 B13R2.15 Cc1csnc1c2ccccc2 759b2383a773e141eced303d71749cba [0,1,0,1,0,0|1,1,0]=4 690 B13R2.15 Cc1n[nH]cc1c2ccccc2 82a91775b11b3d85873b77475c0dcafb [0,1,0,1,0,0|1,0,0]=3 691 B13R2.15 Cc1n[nH]cc1c2ccccn2 7ab821a56cb4e9012656c213c2bc358c [0,1,0,1,0,0|2,0,0]=4 692 B13R2.15 Cc1n[nH]cc1c2cccnc2 d1edc9220adede9858487fe78878a20f [0,1,0,1,0,0|2,0,0]=4 693 B13R2.15 Cc1n[nH]cc1c2ccncc2 ee7f9e2c65a798d31f415acda51d946a [0,1,0,1,0,0|2,0,0]=4 694 B13R2.15 Cc1nccn1c2ccccc2 0759cd8bc2c94e9720cf035e488c1c9c [0,1,0,1,0,0|2,0,0]=4 695 B13R2.15 Cc1ncoc1c2ccccc2 f443e217372b6825172b1af82fafcd6e [0,1,0,1,0,0|1,0,0]=3 696 B13R2.15 Cc1ncoc1c2ccccn2 f7e59b3a7ebf012f1e0cfe32210deaf7 [0,1,0,1,0,0|2,0,0]=4 697 B13R2.15 Cc1ncoc1c2cccnc2 6c4a181d1bfb2ed454db7048e93aaeab [0,1,0,1,0,0|2,0,0]=4 698 B13R2.15 Cc1ncoc1c2ccncc2 5a893138557a35427ab2eed8ab823d36 [0,1,0,1,0,0|2,0,0]=4 699 B13R2.15 Cc1ncsc1c2ccccc2 04d7ca7d87f3768d7976243f63f6e145 [0,1,0,1,0,0|1,0,0]=3 700 B13R2.15 Cc1ncsc1c2ccccn2 b38d01e36fafdb08620d917eedf23bc0 [0,1,0,1,0,0|2,0,0]=4 701 B13R2.15 Cc1ncsc1c2cccnc2 bdfc09c52134cd6ec30a704dda28a7f8 [0,1,0,1,0,0|2,0,0]=4 702 B13R2.15 Cc1ncsc1c2ccncc2 3f36234496b96fca610794b2a69c7959 [0,1,0,1,0,0|2,0,0]=4 703 B13R2.15 Cc1nn[nH]c1c2ccccc2 2114573b889a10c17c341433047e4e23 [0,1,0,1,0,0|2,0,0]=4 704 B13R2.15 Cc1nnsc1c2ccccc2 28a85b731ddea1882f0e8eb41eba288e [0,1,0,1,0,0|2,0,0]=4 705 B13R2.15 Cc1nocc1c2ccccc2 9acda67da1088ca2d0a05f9af7f23054 [0,1,0,1,0,0|0,0,1]=3 706 B13R2.15 Cc1nocc1c2ccccn2 05880205e7f83e90940492a826604ac0 [0,1,0,1,0,0|1,0,1]=4 707 B13R2.15 Cc1nocc1c2cccnc2 5de058a1ee5ce2cb13e830ced8e63eed [0,1,0,1,0,0|1,0,1]=4 708 B13R2.15 Cc1nocc1c2ccncc2 185944ee68d5bc3d188b378deaaa0fd4 [0,1,0,1,0,0|1,0,1]=4 709 B13R2.15 Cc1nscc1c2ccccc2 c03eed9a6726a489175369455960ddab [0,1,0,1,0,0|0,1,0]=3 710 B13R2.15 Cc1nscc1c2ccccn2 e5bf6ba60e5bfd5bfe59102edc3ebdef [0,1,0,1,0,0|1,1,0]=4 711 B13R2.15 Cc1nscc1c2cccnc2 33ded8972ab0941ce2955bcced784801 [0,1,0,1,0,0|1,1,0]=4 712 B13R2.15 Cc1nscc1c2ccncc2 a1b5c066ab7abb433869ce3e355a0958 [0,1,0,1,0,0|1,1,0]=4 713 B13R2.15 Cc1occc1c2ccccc2 4d4ea945bdba1c33aef670c67a4fb68f [0,1,0,1,0,0|0,0,1]=3 714 B13R2.15 Cc1occc1c2ccccn2 ff037ed7b4fb4fe0db835e5bc79206cc [0,1,0,1,0,0|1,0,1]=4 715 B13R2.15 Cc1occc1c2cccnc2 87bbc6e3d88ac1e68ad5e438d600869e [0,1,0,1,0,0|1,0,1]=4 716 B13R2.15 Cc1occc1c2ccncc2 fd02e7c9e8bf556c7363904527cda995 [0,1,0,1,0,0|1,0,1]=4 717 B13R2.15 Cc1ocnc1c2ccccc2 9b520aab2ff547a1eee827dc9f7ebdd3 [0,1,0,1,0,0|0,0,1]=3 718 B13R2.15 Cc1ocnc1c2ccccn2 6b7714e3de13e91e09ec64e583216fcb [0,1,0,1,0,0|1,0,1]=4 719 B13R2.15 Cc1ocnc1c2cccnc2 26c40351cc809f7ea232e2a8f9884ee6 [0,1,0,1,0,0|1,0,1]=4 720 B13R2.15 Cc1ocnc1c2ccncc2 ec047f3ca019ac231df3aabc6808d1dd [0,1,0,1,0,0|1,0,1]=4 721 B13R2.15 Cc1oncc1c2ccccc2 1c9bee7fded62b6a9ea47a54396f014a [0,1,0,1,0,0|0,0,1]=3 722 B13R2.15 Cc1oncc1c2ccccn2 d125fadd499e3cfeefde95399000c2ca [0,1,0,1,0,0|1,0,1]=4 723 B13R2.15 Cc1oncc1c2cccnc2 d741206ebc03bbfd1fc96f6696476b67 [0,1,0,1,0,0|1,0,1]=4 724 B13R2.15 Cc1oncc1c2ccncc2 490f46701af396362833126d135454c2 [0,1,0,1,0,0|1,0,1]=4 725 B13R2.15 Cc1sccc1c2ccccc2 5c882b457d6cb98910e0583cfebc0a4b [0,1,0,1,0,0|0,1,0]=3 726 B13R2.15 Cc1sccc1c2ccccn2 12bd79d820acaaeb5a53ff0ef7972265 [0,1,0,1,0,0|1,1,0]=4 727 B13R2.15 Cc1sccc1c2cccnc2 f9f7eb1d52430eed66bf587893046966 [0,1,0,1,0,0|1,1,0]=4 728 B13R2.15 Cc1sccc1c2ccncc2 84fa491d766215f243920695f28d38c2 [0,1,0,1,0,0|1,1,0]=4 729 B13R2.15 Cc1scnc1c2ccccc2 1323998918871ec36d561d6508cdf3a8 [0,1,0,1,0,0|0,1,0]=3 730 B13R2.15 Cc1scnc1c2ccccn2 f768da584324f4170f23270256a4129a [0,1,0,1,0,0|1,1,0]=4 731 B13R2.15 Cc1scnc1c2cccnc2 f3e835d1417597ddb113b4fe676a801b [0,1,0,1,0,0|1,1,0]=4 732 B13R2.15 Cc1scnc1c2ccncc2 76b99d0fffda50e7599fb7266ff13be7 [0,1,0,1,0,0|1,1,0]=4 733 B13R2.15 Clc1ccsc1c2ccccc2 c656c9db44122526506a4fb0e8226f6b [0,1,0,1,0,0|1,0,1]=4 734 B13R2.15 Clc1cscc1c2ccccc2 157818cec4d271419d505b91abfbddb6 [0,1,0,1,0,0|0,1,1]=4 735 B13R2.15 Clc1n[nH]cc1c2ccccc2 62e2762bc9756ba3ffc09edc200c8d36 [0,1,0,1,0,0|2,0,0]=4 736 B13R2.15 Clc1sccc1c2ccccc2 b00a242f8a1f51ef5a3e26bbd850c440 [0,1,0,1,0,0|0,1,1]=4 737 B13R2.15 Cn1cccc1c2ccccc2 7975bd39895c9a93a97760cb21b00c49 [0,1,0,1,0,0|2,0,0]=4 738 B13R2.15 Cn1ccnc1c2ccccc2 dbf105bf72f344e6ec02fb7f5b9ea3e4 [0,1,0,1,0,0|2,0,0]=4 739 B13R2.15 Cn1cncc1c2ccccc2 85873f940e1df317c4c8f2ab48ec521b [0,1,0,1,0,0|2,0,0]=4 740 B13R2.15 Cn1nccc1c2ccccc2 99b7c470650d09ebee8d1e82b94c1689 [0,1,0,1,0,0|2,0,0]=4 741 B13R2.15 Cn1ncnc1c2ccccc2 80cac1cb1e6193b5200caef441b85c05 [0,1,0,1,0,0|2,0,0]=4 742 B13R2.15 Cn1nncc1c2ccccc2 37c8ec80f208a6ccf59a8160b24f126a [0,1,0,1,0,0|2,0,0]=4 743 B13R2.15 Fc1n[nH]cc1c2ccccc2 61f58fcf889076933acc735da49b8dc0 [0,1,0,1,0,0|2,0,0]=4 744 B13R2.15 Fc1nc[nH]c1c2ccccc2 0603f7086a7b9b372c700478dcbb2f8a [0,1,0,1,0,0|2,0,0]=4 745 B13R2.15 Nc1cscc1c2ccccc2 90da637aa999b4f27613050565bfec50 [0,1,0,1,0,0|0,1,1]=4 746 B13R2.15 Nc1n[nH]cc1c2ccccc2 7638437b7f953490806b5defd8c6bc26 [0,1,0,1,0,0|2,0,0]=4 747 B13R2.15 Nc1ncsc1c2ccccc2 70de126c976e71bb3594a0d0bc99b5fb [0,1,0,1,0,0|2,0,0]=4 748 B13R2.15 Nc1nocc1c2ccccc2 47fcc2e6e0109e09a030c0cb5113cbd0 [0,1,0,1,0,0|1,0,1]=4 749 B13R2.15 Oc1nocc1c2ccccc2 75528e7c5aa4edc11953b61281ae850f [0,1,0,1,0,0|1,0,1]=4 750 B13R2.679 O=CN(c1ccccc1)C2CC2 81b6af8097ab536c3536f8b87f7c6f2c [0,1,0,1,0,0|1,0,1]=4 751 B13R2.1613 O=CN1CCCc2c1cccc2 8a6b241bb1074e16f684d48b4c866556 [0,1,0,1,0,0|1,0,1]=4 752 B13R2.1613 O=CN1CCOc2c1cccc2 7d737ec1e1649e46fd479dee4211cb41 [0,1,0,1,0,0|1,0,1]=4 753 B13R2.1613 O=CN1CCSc2c1cccc2 435991b8f2bb62d7e5b8f6bdc53638fd [0,1,0,1,0,0|1,0,1]=4 754 B13R2.2931 CC1CN(c2c1cccc2)C=O dfb8932ee8f3a1a4a9640492a7c18b8d [0,1,0,1,0,0|1,0,1]=4 755 B13R2.12 Brc1ccc(cc1)c2ccoc2 7f3c8e402280beb7d0c429b5e3ab3f97 [0,1,0,1,0,0|0,0,2]=4 756 B13R2.12 Brc1ccc(cc1)c2ccsc2 447c54ec1a6be7fb741d97ceffa0c791 [0,1,0,1,0,0|0,1,1]=4 757 B13R2.12 Brc1ccc(cc1)c2cn[nH]c2 eb801e08b163b9f8d8922ee96a5e8b63 [0,1,0,1,0,0|2,0,0]=4 758 B13R2.12 Brc1ccc(cc1)c2cnoc2 94cabb0fbcfe14184773453a75f9fc75 [0,1,0,1,0,0|1,0,1]=4 759 B13R2.12 Brc1ccc(cc1)c2cnsc2 fefcb7b05cc66ba74b2ef533c2f65ce4 [0,1,0,1,0,0|1,1,0]=4 760 B13R2.12 Cc1ccc(cc1)c2cc[nH]c2 063a1d06f0fab1416f9e6b5be67527fc [0,1,0,1,0,0|1,0,1]=4 761 B13R2.12 Cc1ccc(cc1)c2ccoc2 8720a7600cf833a0682cd30128f442ab [0,1,0,1,0,0|0,0,2]=4 762 B13R2.12 Cc1ccc(cc1)c2ccsc2 7f7cec7c117c1c83046193aa094f8aac [0,1,0,1,0,0|0,1,1]=4 763 B13R2.12 Cc1ccc(cc1)c2cn[nH]c2 f34d6b2f70006c3709df99bc2e8a3973 [0,1,0,1,0,0|2,0,0]=4 764 B13R2.12 Cc1ccc(cc1)c2cnoc2 3f63a7b83310a1aef4e946799eec3052 [0,1,0,1,0,0|1,0,1]=4 765 B13R2.12 Cc1ccc(cc1)c2cnsc2 ba182de562beaed22f13d694ba6a05ce [0,1,0,1,0,0|1,1,0]=4 766 B13R2.12 Clc1ccc(cc1)c2ccoc2 e6f5d46001bb456ed48e8e984927a1be [0,1,0,1,0,0|0,0,2]=4 767 B13R2.12 Clc1ccc(cc1)c2ccsc2 0a4bf0a3944dcef17dc5286db3eac01e [0,1,0,1,0,0|0,1,1]=4 768 B13R2.12 Clc1ccc(cc1)c2cn[nH]c2 213307afdf94cef36540850b66a10379 [0,1,0,1,0,0|2,0,0]=4 769 B13R2.12 Clc1ccc(cc1)c2cnoc2 52ba838046be4cde18cc6435a3b6b92e [0,1,0,1,0,0|1,0,1]=4 770 B13R2.12 Clc1ccc(cc1)c2cnsc2 9464598a49a54ba646bba8a55ae685cd [0,1,0,1,0,0|1,1,0]=4 771 B13R2.12 Fc1ccc(cc1)c2cc[nH]c2 7abba1fc43d3ea1f4c05b8df068106ce [0,1,0,1,0,0|1,0,1]=4 772 B13R2.12 Fc1ccc(cc1)c2ccoc2 20366bae8f3fd37801761f2a31149cdd [0,1,0,1,0,0|0,0,2]=4 773 B13R2.12 Fc1ccc(cc1)c2ccsc2 0055887fda182039b92ee56844302583 [0,1,0,1,0,0|0,1,1]=4 774 B13R2.12 Fc1ccc(cc1)c2cn[nH]c2 8c4f787bce51ff997daab39e1fea3c8c [0,1,0,1,0,0|2,0,0]=4 775 B13R2.12 Fc1ccc(cc1)c2cnoc2 58e8a4e70f401dd2d9a4e8aea8b07e9a [0,1,0,1,0,0|1,0,1]=4 776 B13R2.12 Fc1ccc(cc1)c2cnsc2 8593cb9e0b68b4e728da499d07ea8707 [0,1,0,1,0,0|1,1,0]=4 777 B13R2.12 Ic1ccc(cc1)c2ccoc2 1a75742460467eebea04276ac13d5969 [0,1,0,1,0,0|0,0,2]=4 778 B13R2.12 Ic1ccc(cc1)c2ccsc2 8467b016c2d9185726e8470bb03950ae [0,1,0,1,0,0|0,1,1]=4 779 B13R2.12 Ic1ccc(cc1)c2cn[nH]c2 c2838bca78538c7df7a23b486208db3d [0,1,0,1,0,0|2,0,0]=4 780 B13R2.12 Ic1ccc(cc1)c2cnoc2 565a3c20974c4159c6a701d2b9c99fa8 [0,1,0,1,0,0|1,0,1]=4 781 B13R2.12 Ic1ccc(cc1)c2cnsc2 d717f190f214118e566b0c8c47f4da57 [0,1,0,1,0,0|1,1,0]=4 782 B13R2.12 Nc1ccc(cc1)c2cc[nH]c2 8c116386835ea926d7c66ba2c73f5ef7 [0,1,0,1,0,0|1,0,1]=4 783 B13R2.12 Nc1ccc(cc1)c2ccoc2 b5b296eb4882f89fdf7f1d9cc4f033ce [0,1,0,1,0,0|0,0,2]=4 784 B13R2.12 Nc1ccc(cc1)c2ccsc2 6489edf2e44f7f9e99360d7566ae2e2e [0,1,0,1,0,0|0,1,1]=4 785 B13R2.12 Nc1ccc(cc1)c2cn[nH]c2 1067398d86dbbefe5a861492cf984fc1 [0,1,0,1,0,0|2,0,0]=4 786 B13R2.12 Nc1ccc(cc1)c2cnoc2 4cbdfa1f71b960898002f0aec5813507 [0,1,0,1,0,0|1,0,1]=4 787 B13R2.12 Nc1ccc(cc1)c2cnsc2 ac6509d68b6c4fef1bb645634c813070 [0,1,0,1,0,0|1,1,0]=4 788 B13R2.12 Oc1ccc(cc1)c2cc[nH]c2 d35f01b9b649e1220e52554a3873825a [0,1,0,1,0,0|1,0,1]=4 789 B13R2.12 Oc1ccc(cc1)c2ccoc2 fe84463d14b2684499c00f40f4e90d84 [0,1,0,1,0,0|0,0,2]=4 790 B13R2.12 Oc1ccc(cc1)c2ccsc2 d383b168369ac37f0b62be4bc8241512 [0,1,0,1,0,0|0,1,1]=4 791 B13R2.12 Oc1ccc(cc1)c2cn[nH]c2 f7a3765f7c2a1f4ae1e451bb1420e9f2 [0,1,0,1,0,0|2,0,0]=4 792 B13R2.12 Oc1ccc(cc1)c2cnoc2 dcc11dd5f61ea2bf74382c99c398b638 [0,1,0,1,0,0|1,0,1]=4 793 B13R2.12 Oc1ccc(cc1)c2cnsc2 0292cd19612096e8581835583af40fff [0,1,0,1,0,0|1,1,0]=4 794 B13R2.12 Sc1ccc(cc1)c2cc[nH]c2 9152bfbe3711b016df57ee5e2a604525 [0,1,0,1,0,0|1,0,1]=4 795 B13R2.12 Sc1ccc(cc1)c2ccoc2 c4e3dde66a4e45184f34ebc981c6af54 [0,1,0,1,0,0|0,0,2]=4 796 B13R2.12 Sc1ccc(cc1)c2ccsc2 733a9720d8d33bdae1b91e72c5a14eba [0,1,0,1,0,0|0,1,1]=4 797 B13R2.12 Sc1ccc(cc1)c2cn[nH]c2 2df57fe48fee0bfa6c11b2ba66157824 [0,1,0,1,0,0|2,0,0]=4 798 B13R2.12 Sc1ccc(cc1)c2cnoc2 81a68944fa48c532ea26c0d30fa45964 [0,1,0,1,0,0|1,0,1]=4 799 B13R2.12 Sc1ccc(cc1)c2cnsc2 7107854dc8b2a72f10489a0f967569b3 [0,1,0,1,0,0|1,1,0]=4 800 B13R2.662 Cc1ccc2c(c1)CCN2C=O 5184542df37368300f67183117c1d76d [0,1,0,1,0,0|1,0,1]=4 801 B13R2.662 O=CN1CCc2c1ccc(c2)Br a878a38bee8a8a8ed1a45bf065c27334 [0,1,0,1,0,0|1,0,1]=4 802 B13R2.662 O=CN1CCc2c1ccc(c2)Cl 08fd0f937f667ed3ea0e7660b9d185e3 [0,1,0,1,0,0|1,0,1]=4 803 B13R2.662 O=CN1CCc2c1ccc(c2)F 8a1950572391b14983447ff73178add1 [0,1,0,1,0,0|1,0,1]=4 804 B13R2.662 O=CN1CCc2c1ccc(c2)I 1f5ce63136146b220c104242f1daaadc [0,1,0,1,0,0|1,0,1]=4 805 B13R2.662 O=CN1CCc2c1ccc(c2)O e902fc0e18edd4afff7c7c2ef8550f17 [0,1,0,1,0,0|1,0,1]=4 806 B13R2.9 Cc1cccc2c1CCN2C=O 63176404c569bae6e4782b5cf57e44df [0,1,0,1,0,0|1,0,1]=4 807 B13R2.9 O=CN1CCc2c1cccc2Br c873ede58dfba2d0a3407ca18ed70d83 [0,1,0,1,0,0|1,0,1]=4 808 B13R2.9 O=CN1CCc2c1cccc2Cl eeece35b54680753bb82437535be07d2 [0,1,0,1,0,0|1,0,1]=4 809 B13R2.9 O=CN1CCc2c1cccc2F 6a96095acd5c93652087de7f2d9b031b [0,1,0,1,0,0|1,0,1]=4 810 B13R2.9 O=CN1CCc2c1cccc2I e6c90d51207f7a161355fad7f777366f [0,1,0,1,0,0|1,0,1]=4 811 B13R2.13 Brc1cccc(c1)c2ccoc2 5f3673ee1949188df6fc8dbf552c695b [0,1,0,1,0,0|0,0,2]=4 812 B13R2.13 Brc1cccc(c1)c2ccsc2 992ba176c308396a779bd7a96a1363ee [0,1,0,1,0,0|0,1,1]=4 813 B13R2.13 Brc1cccc(c1)c2cn[nH]c2 845c12e3c86910dc3d804c4c63c6e535 [0,1,0,1,0,0|2,0,0]=4 814 B13R2.13 Brc1cccc(c1)c2cnoc2 716dac24530bb9b51f16c6c0b2b1019a [0,1,0,1,0,0|1,0,1]=4 815 B13R2.13 Brc1cccc(c1)c2cnsc2 c2142a9cf25d9cbe67c362af81421bc2 [0,1,0,1,0,0|1,1,0]=4 816 B13R2.13 Cc1cccc(c1)c2cc[nH]c2 6f05217d5e3dd2ec797f77fcba5f97e1 [0,1,0,1,0,0|1,0,1]=4 817 B13R2.13 Cc1cccc(c1)c2ccoc2 ce0547e8f05c23dcb340bec2bababc0e [0,1,0,1,0,0|0,0,2]=4 818 B13R2.13 Cc1cccc(c1)c2ccsc2 72b62e879cc6ac032a8e287b28151041 [0,1,0,1,0,0|0,1,1]=4 819 B13R2.13 Cc1cccc(c1)c2cn[nH]c2 a17e7eaad018d94c4c166cd1a20a598d [0,1,0,1,0,0|2,0,0]=4 820 B13R2.13 Cc1cccc(c1)c2cnoc2 24799f79d72aa3c6a187f0ef247059ba [0,1,0,1,0,0|1,0,1]=4 821 B13R2.13 Cc1cccc(c1)c2cnsc2 b506aa25228f89dec42124da8b4abfba [0,1,0,1,0,0|1,1,0]=4 822 B13R2.13 Clc1cccc(c1)c2ccoc2 175eda6ba9bcce41a73151e68477b528 [0,1,0,1,0,0|0,0,2]=4 823 B13R2.13 Clc1cccc(c1)c2ccsc2 abe274871369900b5f88e2a3fd390c0c [0,1,0,1,0,0|0,1,1]=4 824 B13R2.13 Clc1cccc(c1)c2cn[nH]c2 c30fc8a420f25c4646f090f21d98bc19 [0,1,0,1,0,0|2,0,0]=4 825 B13R2.13 Clc1cccc(c1)c2cnoc2 455d58040100582fa5749cb7185d253f [0,1,0,1,0,0|1,0,1]=4 826 B13R2.13 Clc1cccc(c1)c2cnsc2 8fe0ce83d5fd170fb0867aedd725e754 [0,1,0,1,0,0|1,1,0]=4 827 B13R2.13 Fc1cccc(c1)c2cc[nH]c2 ad89fae47bcb4ef0a9a0aa882cfbb721 [0,1,0,1,0,0|1,0,1]=4 828 B13R2.13 Fc1cccc(c1)c2ccoc2 aa9475be3dafe2f2f2792604965c5a0a [0,1,0,1,0,0|0,0,2]=4 829 B13R2.13 Fc1cccc(c1)c2ccsc2 197b2256ec9ce3bde2fbeae68318d5b9 [0,1,0,1,0,0|0,1,1]=4 830 B13R2.13 Fc1cccc(c1)c2cn[nH]c2 399f6169ee8b025dee71d003fd9182b3 [0,1,0,1,0,0|2,0,0]=4 831 B13R2.13 Fc1cccc(c1)c2cnoc2 3110eb00b896b726ab2a8181a3af9b45 [0,1,0,1,0,0|1,0,1]=4 832 B13R2.13 Fc1cccc(c1)c2cnsc2 adda360dbc416b3b8f774bf1ab0cffcf [0,1,0,1,0,0|1,1,0]=4 833 B13R2.13 Ic1cccc(c1)c2ccoc2 41072888aeea1725580551ab4537fe14 [0,1,0,1,0,0|0,0,2]=4 834 B13R2.13 Ic1cccc(c1)c2ccsc2 856e5f3504e07bbce4937c0a7b3096db [0,1,0,1,0,0|0,1,1]=4 835 B13R2.13 Ic1cccc(c1)c2cn[nH]c2 39a0175f664d8214ee1c541ac90456dc [0,1,0,1,0,0|2,0,0]=4 836 B13R2.13 Ic1cccc(c1)c2cnoc2 b7ad4802dd6493bad3d8b605a3326427 [0,1,0,1,0,0|1,0,1]=4 837 B13R2.13 Ic1cccc(c1)c2cnsc2 e4640d944f27e1183c11c06feae9b8fa [0,1,0,1,0,0|1,1,0]=4 838 B13R2.13 Nc1cccc(c1)c2cc[nH]c2 f28d6c8a8d5d5af5951f242555e10f79 [0,1,0,1,0,0|1,0,1]=4 839 B13R2.13 Nc1cccc(c1)c2ccoc2 e9f9e5a4d5403d9897aeff2be63725d4 [0,1,0,1,0,0|0,0,2]=4 840 B13R2.13 Nc1cccc(c1)c2ccsc2 88d12eba088ec84923487d2c8284d774 [0,1,0,1,0,0|0,1,1]=4 841 B13R2.13 Nc1cccc(c1)c2cn[nH]c2 784afce7a883cff43ffaabff5044cf5d [0,1,0,1,0,0|2,0,0]=4 842 B13R2.13 Nc1cccc(c1)c2cnoc2 1e4f5acc5badc4dfa8654288f2865c98 [0,1,0,1,0,0|1,0,1]=4 843 B13R2.13 Nc1cccc(c1)c2cnsc2 4b5a1056839246c77c1a542ff3c08f21 [0,1,0,1,0,0|1,1,0]=4 844 B13R2.13 Oc1cccc(c1)c2cc[nH]c2 96eee2cdbc12f2a80182cca6992461b4 [0,1,0,1,0,0|1,0,1]=4 845 B13R2.13 Oc1cccc(c1)c2ccoc2 2b377443188b9513162e10228132147c [0,1,0,1,0,0|0,0,2]=4 846 B13R2.13 Oc1cccc(c1)c2ccsc2 72131e6aa5b26a53748e1e5720576911 [0,1,0,1,0,0|0,1,1]=4 847 B13R2.13 Oc1cccc(c1)c2cn[nH]c2 24579dc50f49194ccb8a00a4646561b3 [0,1,0,1,0,0|2,0,0]=4 848 B13R2.13 Oc1cccc(c1)c2cnoc2 35ae468f1b8adbb1477ee76a704842e6 [0,1,0,1,0,0|1,0,1]=4 849 B13R2.13 Oc1cccc(c1)c2cnsc2 782ca133cc62391c981790a2554650fa [0,1,0,1,0,0|1,1,0]=4 850 B13R2.13 Sc1cccc(c1)c2cc[nH]c2 6a22643f262d3c20c2c540d4362f92e4 [0,1,0,1,0,0|1,0,1]=4 851 B13R2.13 Sc1cccc(c1)c2ccoc2 b2bdef4e405e2f32e7c9ebb11ed6511e [0,1,0,1,0,0|0,0,2]=4 852 B13R2.13 Sc1cccc(c1)c2ccsc2 aaa82264488313f6a5f83371471db302 [0,1,0,1,0,0|0,1,1]=4 853 B13R2.13 Sc1cccc(c1)c2cn[nH]c2 36d6d2747fd845f8a9fdcb0341d3d36a [0,1,0,1,0,0|2,0,0]=4 854 B13R2.13 Sc1cccc(c1)c2cnoc2 c87b94ff9c640ebcf82f8f15aee5cc99 [0,1,0,1,0,0|1,0,1]=4 855 B13R2.13 Sc1cccc(c1)c2cnsc2 f5e583029be1b9c5b475b824d3aa5019 [0,1,0,1,0,0|1,1,0]=4 856 B13R2.2136 Cc1ccc2c(c1)N(CC2)C=O 29290aa8e7e6f4777491767fffe44103 [0,1,0,1,0,0|1,0,1]=4 857 B13R2.2136 O=CN1CCc2c1cc(cc2)Br a30d5fefbb22e6a6ef3d4c8b2e4099dd [0,1,0,1,0,0|1,0,1]=4 858 B13R2.2136 O=CN1CCc2c1cc(cc2)Cl a1649e047044ddb0ba955a45ce8669d9 [0,1,0,1,0,0|1,0,1]=4 859 B13R2.2136 O=CN1CCc2c1cc(cc2)F e834c03c1fc11f8369b7ca6ac5fa1fac [0,1,0,1,0,0|1,0,1]=4 860 B13R2.2136 O=CN1CCc2c1cc(cc2)I 335a770a0f3072a049c355d495b35565 [0,1,0,1,0,0|1,0,1]=4 861 B13R2.2136 O=CN1CCc2c1cc(cc2)O d8164d80b50074a1fbb2c9b0fefa9146 [0,1,0,1,0,0|1,0,1]=4 862 B13R2.18 Brc1ccccc1c2ccoc2 b09c1518e64cf2cffc9388fafe90b56b [0,1,0,1,0,0|0,0,2]=4 863 B13R2.18 Brc1ccccc1c2ccsc2 b643264481bff37f2973194520be74bf [0,1,0,1,0,0|0,1,1]=4 864 B13R2.18 Brc1ccccc1c2cn[nH]c2 f9c0840120b9236724dd4dfdaf558ee1 [0,1,0,1,0,0|2,0,0]=4 865 B13R2.18 Brc1ccccc1c2cnoc2 900908a640db8a2dc4ed862b44fcc057 [0,1,0,1,0,0|1,0,1]=4 866 B13R2.18 Brc1ccccc1c2cnsc2 b1be75058569be600fd9d97a98603086 [0,1,0,1,0,0|1,1,0]=4 867 B13R2.18 Cc1ccccc1c2cc[nH]c2 bd4ed3c340ac8e860d723dbbbd1b784e [0,1,0,1,0,0|1,0,1]=4 868 B13R2.18 Cc1ccccc1c2ccoc2 e93209ee1cce6123c2790619557f33ea [0,1,0,1,0,0|0,0,2]=4 869 B13R2.18 Cc1ccccc1c2ccsc2 02e656b9055ff33928b80595fe3447de [0,1,0,1,0,0|0,1,1]=4 870 B13R2.18 Cc1ccccc1c2cn[nH]c2 a6ef2b05fc60287146219c51cceefcea [0,1,0,1,0,0|2,0,0]=4 871 B13R2.18 Cc1ccccc1c2cnoc2 052eebfcecdbd496826cc048d2dbefc0 [0,1,0,1,0,0|1,0,1]=4 872 B13R2.18 Cc1ccccc1c2cnsc2 3e6c87a00a013113da46569d2653ac5f [0,1,0,1,0,0|1,1,0]=4 873 B13R2.18 Clc1ccccc1c2ccoc2 83c2670fd5d84f1f76d0a51e9aad2c35 [0,1,0,1,0,0|0,0,2]=4 874 B13R2.18 Clc1ccccc1c2ccsc2 0eaaca7693532b4b6bfb88e090d57e17 [0,1,0,1,0,0|0,1,1]=4 875 B13R2.18 Clc1ccccc1c2cn[nH]c2 e98cca1839794e99b16c41b9d1145e04 [0,1,0,1,0,0|2,0,0]=4 876 B13R2.18 Clc1ccccc1c2cnoc2 586b6539e209eef2001d1e277dd91c08 [0,1,0,1,0,0|1,0,1]=4 877 B13R2.18 Clc1ccccc1c2cnsc2 2be334118d467e088041e2f935fca117 [0,1,0,1,0,0|1,1,0]=4 878 B13R2.18 Fc1ccccc1c2cc[nH]c2 d8e69baa7159913e9bcde7be89d05282 [0,1,0,1,0,0|1,0,1]=4 879 B13R2.18 Fc1ccccc1c2ccoc2 b81cff344c7527662197de69e0225c10 [0,1,0,1,0,0|0,0,2]=4 880 B13R2.18 Fc1ccccc1c2ccsc2 b647e9239352ad4d26d9bf57aa93580b [0,1,0,1,0,0|0,1,1]=4 881 B13R2.18 Fc1ccccc1c2cn[nH]c2 0a34811619f7f4e54b1cda9b57ae51b0 [0,1,0,1,0,0|2,0,0]=4 882 B13R2.18 Fc1ccccc1c2cnoc2 961933f093276fffac581ef4b4fb0d30 [0,1,0,1,0,0|1,0,1]=4 883 B13R2.18 Fc1ccccc1c2cnsc2 8bc26c210244e82be537e6058f047c53 [0,1,0,1,0,0|1,1,0]=4 884 B13R2.18 Ic1ccccc1c2ccoc2 9b4251670660b5c91b21cf907b72965b [0,1,0,1,0,0|0,0,2]=4 885 B13R2.18 Ic1ccccc1c2ccsc2 f6beca87f0a8e076a22b4cdd09883b9e [0,1,0,1,0,0|0,1,1]=4 886 B13R2.18 Ic1ccccc1c2cn[nH]c2 123d9e6060e1fbb01ddfa77048402fce [0,1,0,1,0,0|2,0,0]=4 887 B13R2.18 Ic1ccccc1c2cnoc2 24a85b41b5963749bccd80257521b0fd [0,1,0,1,0,0|1,0,1]=4 888 B13R2.18 Ic1ccccc1c2cnsc2 98044be592f99d7455cc5e66e9c03262 [0,1,0,1,0,0|1,1,0]=4 889 B13R2.18 Nc1ccccc1c2cc[nH]c2 f127377b6d1e84f86a28f6b981397cfb [0,1,0,1,0,0|1,0,1]=4 890 B13R2.18 Nc1ccccc1c2ccoc2 09fad6c832e2b54c1c3cb6c999e71e61 [0,1,0,1,0,0|0,0,2]=4 891 B13R2.18 Nc1ccccc1c2ccsc2 efd0d54f62302c805c84b8b71bb24f02 [0,1,0,1,0,0|0,1,1]=4 892 B13R2.18 Nc1ccccc1c2cn[nH]c2 c7289fd8ac2b2e06b23496ceefa0cce4 [0,1,0,1,0,0|2,0,0]=4 893 B13R2.18 Nc1ccccc1c2cnoc2 6bdd7d09ea4172ceff16bb900396eef5 [0,1,0,1,0,0|1,0,1]=4 894 B13R2.18 Nc1ccccc1c2cnsc2 4b9c428359091c21edc699478bb9814e [0,1,0,1,0,0|1,1,0]=4 895 B13R2.18 Oc1ccccc1c2cc[nH]c2 b89088ddf65b0b2dd9d617859c8a63b3 [0,1,0,1,0,0|1,0,1]=4 896 B13R2.18 Oc1ccccc1c2ccoc2 c0b1ece463ed80455c1ea792f0485a96 [0,1,0,1,0,0|0,0,2]=4 897 B13R2.18 Oc1ccccc1c2ccsc2 189275d2d9c48886bb50afb94c2ac2d3 [0,1,0,1,0,0|0,1,1]=4 898 B13R2.18 Oc1ccccc1c2cn[nH]c2 1a52bf49f020fc77bb26f8e0c283397b [0,1,0,1,0,0|2,0,0]=4 899 B13R2.18 Oc1ccccc1c2cnoc2 d448d93251bc2dae1f0fe8869316b3dd [0,1,0,1,0,0|1,0,1]=4 900 B13R2.18 Oc1ccccc1c2cnsc2 f3fa2978b04ddf4d450c3da6d423f4a9 [0,1,0,1,0,0|1,1,0]=4 901 B13R2.18 Sc1ccccc1c2cc[nH]c2 304d7e949ed1004e740b0d0a763804e2 [0,1,0,1,0,0|1,0,1]=4 902 B13R2.18 Sc1ccccc1c2ccoc2 314ae42441e4a1a9f5a734fe4720b9dc [0,1,0,1,0,0|0,0,2]=4 903 B13R2.18 Sc1ccccc1c2ccsc2 68e7040a676519103d7a86423b6d4c0c [0,1,0,1,0,0|0,1,1]=4 904 B13R2.18 Sc1ccccc1c2cn[nH]c2 2fa2ce4c89a561e8c060433b2adc78df [0,1,0,1,0,0|2,0,0]=4 905 B13R2.18 Sc1ccccc1c2cnoc2 d8436b5521d138d591ec26ee5b8553c7 [0,1,0,1,0,0|1,0,1]=4 906 B13R2.18 Sc1ccccc1c2cnsc2 5040033cc11fd732044c49b589aa46fc [0,1,0,1,0,0|1,1,0]=4 907 B13R2.135 CC1Cc2ccccc2N1C=O e3f31cc4186aca572ed84f309636ae60 [0,1,0,1,0,0|1,0,1]=4 908 B13R2.135 C[C@@H]1Cc2ccccc2N1C=O 04d4df9798a33f18f6a8089a14b80514 [0,1,0,1,0,0|1,0,1]=4 909 B13R2.135 C[C@H]1Cc2ccccc2N1C=O c3e1c2b118f860f8da6923386315dea7 [0,1,0,1,0,0|1,0,1]=4 910 B13R2.2091 Cc1cccc2c1N(CC2)C=O 5a0a7f1b25a04d208a5d3fa875b8ffa4 [0,1,0,1,0,0|1,0,1]=4 911 B13R2.2091 O=CN1CCc2c1c(ccc2)Br d38fecba708d943e3bf0b39ba66adcc1 [0,1,0,1,0,0|1,0,1]=4 912 B13R2.2091 O=CN1CCc2c1c(ccc2)Cl fdb7440f54fa401046dac5b9099af1c2 [0,1,0,1,0,0|1,0,1]=4 913 B13R2.2091 O=CN1CCc2c1c(ccc2)F 51a5b60ce5b9752e1835937f12c6856b [0,1,0,1,0,0|1,0,1]=4 914 B13R2.2091 O=CN1CCc2c1c(ccc2)O 7f0fc362e6f834be0df6209c6fa1dccc [0,1,0,1,0,0|1,0,1]=4 915 B13R2.72 CC(=O)N1CCc2c1cccc2 06be9692527493672f216ca7cabc8bee [0,1,0,1,0,0|1,0,1]=4 916 B9R1.11 CN(C=O)c1ccsc1 8f15e9acca9aeb51f07a52c03adb4c19 [1,0,0,0,1,0|2,0,0]=4 917 B11R1.40 C=CC(=O)Nc1ccccc1 5f69a60f76bf8d4845a783c3048b2563 [1,0,0,0,0,1|0,0,1]=3 918 B11R1.40 C=CC(=O)Nc1ccccn1 34fef90711dfcaefc277492e72bbe936 [1,0,0,0,0,1|1,0,1]=4 919 B11R1.40 C=CC(=O)Nc1cccnc1 de5c772a8cda94a68da43551d49c0fce [1,0,0,0,0,1|1,0,1]=4 920 B11R1.40 C=CC(=O)Nc1ccncc1 415f0c78f33533c78fc6ab46a82fb4b2 [1,0,0,0,0,1|1,0,1]=4 921 B11R1.40 C=CC(C)Nc1ccccc1 11c4f91eafeb8b3d7c22c97a0ea92d57 [1,0,0,0,0,1|1,0,1]=4 922 B11R1.40 CC(C=O)Nc1ccccc1 0d04ec44ee6fe8b8d4f3d71cd15333ba [1,0,0,0,0,1|0,0,1]=3 923 B11R1.40 CC(C=O)Nc1ccccn1 f6323f482ea726d65853ab7cc1b45bb4 [1,0,0,0,0,1|1,0,1]=4 924 B11R1.40 CC(C=O)Nc1cccnc1 d9c7b2b4935781413d4a985313466b9b [1,0,0,0,0,1|1,0,1]=4 925 B11R1.40 CC(C=O)Nc1ccncc1 9d1dbf134f97c66b59956ef2739d0216 [1,0,0,0,0,1|1,0,1]=4 926 B11R1.40 CC(C=O)Oc1ccccn1 6964fdd9e0bc6b530d4dd7a3a2376b4c [1,0,0,0,0,1|1,0,1]=4 927 B11R1.40 CC(C=O)Oc1cccnc1 e37888c7c991d828e39da1a6807dceaa [1,0,0,0,0,1|1,0,1]=4 928 B11R1.40 CC(C=O)Oc1ccncc1 e75558d3547ed47505abf1a4004897c0 [1,0,0,0,0,1|1,0,1]=4 929 B11R1.40 CCC(=O)Nc1ccccn1 5f642c62afae0a49ab875733e55fde1b [1,0,0,0,0,1|1,0,1]=4 930 B11R1.40 CCC(=O)Nc1cccnc1 3f3732eaee579e7903ad30638bf6459b [1,0,0,0,0,1|1,0,1]=4 931 B11R1.40 CN(C=O)Cc1ccccc1 701ed8237afa851586621908f176512f [1,0,0,0,0,1|1,0,0]=3 932 B11R1.40 CN(C=O)Cc1ccccn1 e1588a36a59add4eaf224b7ea271ab51 [1,0,0,0,0,1|2,0,0]=4 933 B11R1.40 CN(C=O)Cc1cccnc1 ffa035f03a82f49c9d004e6e7105924f [1,0,0,0,0,1|2,0,0]=4 934 B11R1.40 CN(C=O)Cc1ccncc1 a539f04945f92d40e9c197fd41216c1b [1,0,0,0,0,1|2,0,0]=4 935 B11R1.40 C[C@H](C=O)Nc1ccccc1 10a4433daba67da13987d6e7cd5b7f0f [1,0,0,0,0,1|0,0,1]=3 936 B11R1.40 C[C@H](C=O)Nc1ccccn1 46e94b05d4e4c715a9e5400c929646b9 [1,0,0,0,0,1|1,0,1]=4 937 B11R1.40 C[C@H](C=O)Nc1cccnc1 fedeaeec69f602e704c38cd1adea1d8e [1,0,0,0,0,1|1,0,1]=4 938 B11R1.40 C[C@H](C=O)Nc1ccncc1 2f11c12f5ae2a4a34554194fcc005f15 [1,0,0,0,0,1|1,0,1]=4 939 B11R1.40 C[C@H](C=O)Oc1ccccn1 0be2b7848388ea049450b4a9fa6678e7 [1,0,0,0,0,1|1,0,1]=4 940 B11R1.40 C[C@H](C=O)Oc1cccnc1 55db0365e7488258d11fe983dbcaf255 [1,0,0,0,0,1|1,0,1]=4 941 B11R1.40 C[C@H](C=O)Oc1ccncc1 0569f754c55d1898e8e0bee53c4f5433 [1,0,0,0,0,1|1,0,1]=4 942 B11R1.40 O=CC(=O)Nc1ccccc1 d69489ae088f523aa236921a313e92a5 [1,0,0,0,0,1|1,0,0]=3 943 B11R1.40 O=CC(=O)Nc1ccccn1 9dee939f22a8949e3604743fdb4606fc [1,0,0,0,0,1|2,0,0]=4 944 B11R1.40 O=CC(=O)Nc1cccnc1 4483235651c46310384ecdfb83cf0459 [1,0,0,0,0,1|2,0,0]=4 945 B11R1.40 O=CC(=O)Nc1ccncc1 4b5bab6fe314b5f2251f228c60250dcd [1,0,0,0,0,1|2,0,0]=4 946 B13R1.417 CCC(C=O)NCc1ccccc1 f6845985d015a5d539738c58cc946136 [0,0,0,0,0,2|0,0,2]=4 947 B13R1.417 CCC(C=O)OCc1ccccc1 7e42f954680b0457c90fa3b9a0110dd2 [0,0,0,0,0,2|0,0,2]=4 948 B13R1.417 CCN(C=O)CCc1ccccc1 4ec660b185cec5e17670f6a60b5e65af [0,0,0,0,0,2|1,0,1]=4 949 B13R1.417 O=CC(C=O)NCc1ccccc1 4ccee071e923c3ac45c90ed8c3e9896c [0,0,0,0,0,2|1,0,1]=4