0 B10R1.4 CCNc1cncnc1Br 0995cba514c5c52cf1ff4087b5bf444f [0,0,1,0,0,0|2,0,1]=4 1 B10R1.4 CCNc1cncnc1C c780de3350d8a4ea3afb5887d12adc9b [0,0,1,0,0,0|2,0,1]=4 2 B10R1.4 CCNc1cncnc1Cl b13fe482777c2ee0f7c3bc51abe459e4 [0,0,1,0,0,0|2,0,1]=4 3 B10R1.4 Cc1ccncc1NC=O 480a397461cc81757979891789a47566 [0,0,1,0,0,0|3,0,0]=4 4 B10R1.4 Cc1ncccc1NC=O 7a06f216539d990da9cb44ab6e9b0c87 [0,0,1,0,0,0|3,0,0]=4 5 B10R1.4 Cc1ncncc1NC=O e208c53ff6ae6786cc4686d2d6167722 [0,0,1,0,0,0|2,0,0]=3 6 B10R1.4 Cc1ncncc1NCO 93665cbde74a24c33608f61db671f6c5 [0,0,1,0,0,0|2,0,1]=4 7 B10R1.4 FCNc1cncnc1Br f17bc57810b4ceb9e461a4e40e6ff1a7 [0,0,1,0,0,0|2,0,1]=4 8 B10R1.4 FCNc1cncnc1Cl b5ef0442d90c4fa105fb35f084bbf954 [0,0,1,0,0,0|2,0,1]=4 9 B10R1.4 O=CNc1cccnc1Br 067ed8cd00ae2be37ffcd23d4b813102 [0,0,1,0,0,0|3,0,0]=4 10 B10R1.4 O=CNc1cccnc1Cl 65ed286318dffde1ac22a69c8035c069 [0,0,1,0,0,0|3,0,0]=4 11 B10R1.4 O=CNc1cccnc1F 3f6098c3ee28b0b9240bc4385fc649ef [0,0,1,0,0,0|3,0,0]=4 12 B10R1.4 O=CNc1cccnc1I 554eb10301b8ea5a0631a3d0de1821bb [0,0,1,0,0,0|3,0,0]=4 13 B10R1.4 O=CNc1cccnc1O 2b8662d82921d406bd957c952a352054 [0,0,1,0,0,0|3,0,0]=4 14 B10R1.4 O=CNc1cnccc1Br 175a2e259bf91212e04dc2028b743367 [0,0,1,0,0,0|3,0,0]=4 15 B10R1.4 O=CNc1cnccc1F 93504e3990a6d40804e0070c51f15814 [0,0,1,0,0,0|3,0,0]=4 16 B10R1.4 O=CNc1cnccc1I 69e2f5597c7a113298b91de3b2400640 [0,0,1,0,0,0|3,0,0]=4 17 B10R1.4 O=CNc1cnccc1S e87b0427f473ebba57abc19e02e63ca1 [0,0,1,0,0,0|3,0,0]=4 18 B10R1.4 O=CNc1cncnc1I 8004f1f11d2122a3a5d869defdfebb5c [0,0,1,0,0,0|2,0,0]=3 19 B10R1.4 OCNc1cncnc1Br f532c779795ecc66cdae0fa23b949df3 [0,0,1,0,0,0|2,0,1]=4 20 B10R1.4 OCNc1cncnc1Cl 069a181016f0bb277062a2272d7e52f1 [0,0,1,0,0,0|2,0,1]=4 21 B9R1.8 CCNc1cncnc1 d22064ed1cc1956224a6568ef26d5099 [1,0,1,0,0,0|1,0,1]=4 22 B9R1.8 FCNc1cncnc1 49689598886657fafe98ac3f8f7ecc0b [1,0,1,0,0,0|1,0,1]=4 23 B9R1.8 O=CNc1cccnc1 355201612949cfa8d6342c6af1c523a5 [1,0,1,0,0,0|2,0,0]=4 24 B9R1.8 O=CNc1ccncn1 2441242a2ef010826c6f20d4fd1c9498 [1,0,1,0,0,0|1,0,1]=4 25 B9R1.8 OCNc1cncnc1 f94e24e43a9b982a2515c894be0cdeee [1,0,1,0,0,0|1,0,1]=4 26 B11R1.17 C=CCNc1cncnc1Br 62ff49a64e54c94d835e5f8f9159623a [0,1,1,0,0,0|2,0,0]=4 27 B11R1.17 C=CCNc1cncnc1C 581c31375dd4f43361449a624b767e8e [0,1,1,0,0,0|2,0,0]=4 28 B11R1.17 C=CCNc1cncnc1Cl ad3e3044904a342fac732c35c94c44c6 [0,1,1,0,0,0|2,0,0]=4 29 B11R1.17 C=CCNc1cncnc1I 426651edf4f068221e473957fcee14dd [0,1,1,0,0,0|2,0,0]=4 30 B11R1.17 Cc1ncncc1NCC=O 7235165745183968925aac6f4d0bc4d1 [0,1,1,0,0,0|2,0,0]=4 31 B11R1.17 O=CCNc1cncnc1Br 2b5bc4b21a38baa4affc1580e3827e7a [0,1,1,0,0,0|2,0,0]=4 32 B11R1.17 O=CCNc1cncnc1Cl f8932e2485b1b0ea79b3fd288f9f0388 [0,1,1,0,0,0|2,0,0]=4 33 B11R1.17 O=CCNc1cncnc1I e9319e26386112857fc93f28c8318f78 [0,1,1,0,0,0|2,0,0]=4 34 B11R1.41 CCc1ncncc1NC=O 4d820321008b8dfc86be5742f124441d [0,1,1,0,0,0|2,0,0]=4 35 B11R1.41 O=CNc1cncnc1C=O 321d8862a3f7814147f405d0a2ad9979 [0,1,1,0,0,0|2,0,0]=4 36 B11R1.81 Cc1nc(ncc1NC=O)Br 90df95697a1ae98aa85697db1b009f03 [0,1,1,0,0,0|2,0,0]=4 37 B11R1.81 Cc1nc(ncc1NC=O)Cl ebded247cb4bed50f1b3538fad98f9c3 [0,1,1,0,0,0|2,0,0]=4 38 B11R1.81 Cc1ncc(c(n1)C)NC=O f8904cc10cb86a076a28d0d0e5e30870 [0,1,1,0,0,0|2,0,0]=4 39 B11R1.81 Cc1ncc(c(n1)Cl)NC=O fe81b681e519f91532267b5cfbca9c2a [0,1,1,0,0,0|2,0,0]=4 40 B11R1.81 O=CNc1cnc(nc1Cl)Cl f9fb2694170abbdf5a831e921055f53f [0,1,1,0,0,0|2,0,0]=4 41 B11R1.81 O=CNc1cnc(nc1I)Cl 86db0e2725a66a02bfa93acd6e58e327 [0,1,1,0,0,0|2,0,0]=4 42 B13R2.292 CCNc1ccnc2c1[nH]cc2 1acec24d35b630488384113beb727020 [0,2,0,0,0,0|2,0,0]=4 43 B13R2.292 CCNc1nccc2c1[nH]cc2 4c2ab498131c5bad793aabf8d626b621 [0,2,0,0,0,0|2,0,0]=4 44 B13R2.292 CCNc1nccc2c1[nH]cn2 ee9d4e220927085610ace8844a8f32f1 [0,2,0,0,0,0|1,0,0]=3 45 B13R2.292 CCNc1ncnc2c1[nH]cc2 b184e3e936b6eefd229bff9511aa1c46 [0,2,0,0,0,0|1,0,0]=3 46 B13R2.292 CCNc1ncnc2c1[nH]nc2 ce87c3aa4cdaf6b5f0b577907af30fc5 [0,2,0,0,0,0|2,0,0]=4 47 B13R2.292 CCNc1ncnc2c1cc[nH]2 ec5d21eed802de102b868ae1f471ea29 [0,2,0,0,0,0|1,0,1]=4 48 B13R2.292 CCNc1ncnc2c1cco2 640e1c8e6b96bfd1d6583334ea0d0f43 [0,2,0,0,0,0|2,0,0]=4 49 B13R2.292 CCNc1ncnc2c1ccs2 0480b9ee59f4437ce354d83f676fbe56 [0,2,0,0,0,0|2,0,0]=4 50 B13R2.292 CCNc1ncnc2c1nc[nH]2 a69b6743d2fd54b54547f2603e783e07 [0,2,0,0,0,0|0,0,2]=4 51 B13R2.292 CCNc1ncnc2c1ncs2 ab3bcce909ce8f2ab52edfa5e611a0c5 [0,2,0,0,0,0|1,0,1]=4 52 B13R2.292 CCNc1ncnc2c1scc2 61dcf68c71e656aa103eecd654044c71 [0,2,0,0,0,0|2,0,0]=4 53 B13R2.292 CCNc1ncnc2n1ncn2 09a92ebd07aee721cf8fc128e56ef700 [0,2,0,0,0,0|1,0,1]=4 54 B13R2.292 CCNc1nncc2c1[nH]cn2 ff14b9473d48d628c6d74e6aa19c50c7 [0,2,0,0,0,0|2,0,0]=4 55 B13R2.292 FCNc1ccnc2c1[nH]cc2 a269e79bafac2a704596186e3574f7f9 [0,2,0,0,0,0|2,0,0]=4 56 B13R2.292 FCNc1nccc2c1[nH]cc2 ebf9f82fd0658ae529edf0210a39fd4a [0,2,0,0,0,0|2,0,0]=4 57 B13R2.292 FCNc1nccc2c1[nH]cn2 e1e756235b0b633ce205033e27df1a7f [0,2,0,0,0,0|1,0,0]=3 58 B13R2.292 FCNc1ncnc2c1[nH]cc2 3d2934e411a753a7b8e259ad4b531537 [0,2,0,0,0,0|1,0,0]=3 59 B13R2.292 FCNc1ncnc2c1[nH]nc2 4c97f1f152429887286d55fa5a2b5d57 [0,2,0,0,0,0|2,0,0]=4 60 B13R2.292 FCNc1ncnc2c1cc[nH]2 f086e6306e6a6e2ae3deb4d4dd8bed9f [0,2,0,0,0,0|1,0,1]=4 61 B13R2.292 FCNc1ncnc2c1cco2 0eb81ddc03e2897e35633f014ace97d2 [0,2,0,0,0,0|2,0,0]=4 62 B13R2.292 FCNc1ncnc2c1ccs2 124668714cabdd542eacf07fd299965c [0,2,0,0,0,0|2,0,0]=4 63 B13R2.292 FCNc1ncnc2c1nc[nH]2 52aea0d64a8deef85f333271ba2e6f80 [0,2,0,0,0,0|0,0,2]=4 64 B13R2.292 FCNc1ncnc2c1ncs2 80f107d568e0444c43b5839810d76ede [0,2,0,0,0,0|1,0,1]=4 65 B13R2.292 FCNc1ncnc2c1scc2 8753e3602f6b154024c8baa7c4e8c5af [0,2,0,0,0,0|2,0,0]=4 66 B13R2.292 FCNc1ncnc2n1ncn2 91794bb2fe10dfd18e6e68b91f80c8b6 [0,2,0,0,0,0|1,0,1]=4 67 B13R2.292 FCNc1nncc2c1[nH]cn2 01e3fd8f43c4e002afe3dfd3817c29b5 [0,2,0,0,0,0|2,0,0]=4 68 B13R2.292 O=CNc1ncnc2c1ccs2 d1da3b91281d7e1aa10cd62cc1b3ba04 [0,2,0,0,0,0|2,0,0]=4 69 B13R2.292 O=CNc1ncnc2c1ncs2 6686a136cb1849a7e8f54611c2541fb1 [0,2,0,0,0,0|1,0,1]=4 70 B13R2.292 O=CNc1ncnc2c1scc2 279f185b08bb6b6f32cfc43900ac5494 [0,2,0,0,0,0|2,0,0]=4 71 B13R2.292 OCNc1ccnc2c1[nH]cc2 ef4a659bf72c59edc6cff6c42434b9bd [0,2,0,0,0,0|2,0,0]=4 72 B13R2.292 OCNc1nccc2c1[nH]cc2 a4fa26b75272e0f6b1145e2bbad196dc [0,2,0,0,0,0|2,0,0]=4 73 B13R2.292 OCNc1nccc2c1[nH]cn2 dce62e04d7082094e1618d2c1eac6a83 [0,2,0,0,0,0|1,0,0]=3 74 B13R2.292 OCNc1ncnc2c1[nH]cc2 59ee5b64c6c49c8676447247f05ab9ae [0,2,0,0,0,0|1,0,0]=3 75 B13R2.292 OCNc1ncnc2c1[nH]nc2 01fd23270496ebed694c770a9c8b8fa6 [0,2,0,0,0,0|2,0,0]=4 76 B13R2.292 OCNc1ncnc2c1cc[nH]2 7b1055ef8939f2c5ee6c7c4f14433189 [0,2,0,0,0,0|1,0,1]=4 77 B13R2.292 OCNc1ncnc2c1cco2 79cb93dce7d5237f1e75a1fc2830c0ae [0,2,0,0,0,0|2,0,0]=4 78 B13R2.292 OCNc1ncnc2c1ccs2 53c9aa3e7d0fa3f5cc2e6bf258e8f24d [0,2,0,0,0,0|2,0,0]=4 79 B13R2.292 OCNc1ncnc2c1nc[nH]2 d926437a9042ea5a6826c8a50ba0a5ad [0,2,0,0,0,0|0,0,2]=4 80 B13R2.292 OCNc1ncnc2c1ncs2 0159c08e8598ffbb50d1ac082dd1f262 [0,2,0,0,0,0|1,0,1]=4 81 B13R2.292 OCNc1ncnc2c1scc2 655530a0eca076070545b16a71e9cc8b [0,2,0,0,0,0|2,0,0]=4 82 B13R2.292 OCNc1ncnc2n1ncn2 c30cde364991efc9d14e5c31a52a3a38 [0,2,0,0,0,0|1,0,1]=4 83 B13R2.292 OCNc1nncc2c1[nH]cn2 9365edcff4b067ac9282a4b0b9b88af6 [0,2,0,0,0,0|2,0,0]=4 84 B11R2.2 c1c[nH]c(c1)c2ncc[nH]2 fcb9139118bec17964f2e93283d2f8b5 [0,0,1,1,0,0|2,0,0]=4 85 B11R2.2 c1c[nH]c(c1)c2ncns2 cbe10406c36c780c8ede3fe7d527a4d3 [0,0,1,1,0,0|2,0,0]=4 86 B11R2.2 c1c[nH]c(n1)c2cnco2 1b7142ac7ffaac0f6e1ce51bbcd9d1f7 [0,0,1,1,0,0|2,0,0]=4 87 B11R2.2 c1c[nH]c(n1)c2cncs2 f914656d9993347564a673ae5f267db5 [0,0,1,1,0,0|2,0,0]=4 88 B11R2.2 c1nsc(n1)c2cnco2 8cee49830994081a0af43a86b9226d3e [0,0,1,1,0,0|2,0,0]=4 89 B11R2.2 c1nsc(n1)c2cncs2 cdadc24c84b370bf0249c1b009ed3d1e [0,0,1,1,0,0|2,0,0]=4