0 B23R3.17233761 Cc1cccnc1CNc2cccc3c2c(nc(n3)N)N d869aac7291c5da6c1b23f88bee6c114 [0,0,0,0,0,0|4,0,0]=4 1 B23R3.17233761 Cc1ncccc1CNc2cccc3c2c(nc(n3)N)N 189cc0bec1a36dc53bcd60b8d60fa1fc [0,0,0,0,0,0|2,0,0]=2 2 B23R3.17233761 Nc1nc(c2c(cccc2n1)NCc3ccccc3F)N 3a792c3bcef4448075fc11c1b374b008 [0,0,0,0,0,0|4,0,0]=4 3 B23R3.17233761 Nc1nc(c2c(cccc2n1)NCc3cccnc3F)N 9d85d07334d5ab7313c5ec3e7237dad1 [0,0,0,0,0,0|3,0,0]=3 4 B22R3.380577 Nc1nc(c2c(cccc2n1)NCc3ccccc3)N 692915d42cb75e4b583a00ced83a3974 [1,0,0,0,0,0|3,0,0]=4 5 B22R3.380577 Nc1nc(c2c(cccc2n1)NCc3cccnc3)N dd1eae40393b3b1c30ea8e6712fc8a07 [1,0,0,0,0,0|2,0,0]=3 6 B22R3.380577 Nc1nc(c2c(cccc2n1)NCc3cccnn3)N da645cf22ae62ce167f9cca587f37fe5 [1,0,0,0,0,0|3,0,0]=4 7 B22R3.380577 Nc1nc(c2c(cccc2n1)NCc3ccnnc3)N efeaef69d0e5683b19cacc9a065ee2c9 [1,0,0,0,0,0|3,0,0]=4 8 B22R3.380577 Nc1nc(c2c(cccc2n1)NCc3cnccn3)N 50c4852d7f3c4d5bbc564bf9d67afc37 [1,0,0,0,0,0|3,0,0]=4 9 B22R3.380577 Nc1nc(c2c(cccc2n1)NCc3cncnc3)N 940c0c79afe76b8a78e0d5c3c8fdee69 [1,0,0,0,0,0|3,0,0]=4 10 B22R3.670680 Cc1ncccc1OCc2cccc3c2c(ccc3)Br 68971940f42a3965df4e48826d2e2f81 [1,0,0,0,0,0|3,0,0]=4 11 B24R3.45670073 CCc1ccccc1CNc2cccc3c2c(nc(n3)N)N 2037d07b08c9bf866c64b9b8e6a368ed [0,1,0,0,0,0|3,0,0]=4 12 B24R3.45670073 COc1ccccc1CNc2cccc3c2c(nc(n3)N)N f82c82b392ee96a9a63aa89b0e28c0f1 [0,1,0,0,0,0|3,0,0]=4 13 B24R3.45670073 COc1ncccc1CNc2cccc3c2c(nc(n3)N)N 716367f9811166e82eabc194d28a16c4 [0,1,0,0,0,0|2,0,0]=3 14 B24R3.45670073 COc1nccnc1CNc2cccc3c2c(nc(n3)N)N 3a86f973c3863874c6731018899d6bf9 [0,1,0,0,0,0|3,0,0]=4 15 B24R3.45670073 CSc1ccccc1CNc2cccc3c2c(nc(n3)N)N 1aa49e951e3987f4e6915e8264622865 [0,1,0,0,0,0|3,0,0]=4 16 B24R3.45670073 Nc1nc(c2c(cccc2n1)NCc3ccccc3CO)N 82d1f3eb0a7ed55b114a8636ade5889c [0,1,0,0,0,0|3,0,0]=4 17 B24R3.118319707 Cc1c(cccc1CNc2cccc3c2c(nc(n3)N)N)F b522b2bf120e19e175823b47ec2d6b93 [0,1,0,0,0,0|3,0,0]=4 18 B24R3.118319707 Cc1cccc(c1C)CNc2cccc3c2c(nc(n3)N)N fd8e664dff4e042b58e5bc7f8d2ab1a5 [0,1,0,0,0,0|3,0,0]=4 19 B24R3.232798505 Cc1cccc(c1CNc2cccc3c2c(nc(n3)N)N)C 346b3b658594c1d5f8c7d7d2825030e8 [0,1,0,0,0,0|3,0,0]=4 20 B24R3.234597626 Cc1ccc(c(n1)C)CNc2cccc3c2c(nc(n3)N)N 3007ef8c894b3f1bb78683205b117656 [0,1,0,0,0,0|2,0,0]=3 21 B24R3.234597626 Nc1nc(c2c(cccc2n1)NCc3ccc(nc3Cl)Br)N 353ce25d3d53606bd015f45c9df1fc55 [0,1,0,0,0,0|3,0,0]=4 22 B24R3.1510855827 Cc1ncccc1CN(C)c2cccc3c2c(nc(n3)N)N fc562b347a5d13922919b0c1da1e0d96 [0,1,0,0,0,0|2,0,0]=3 23 B24R4.201419852 Nc1nc(c2c(cccc2n1)c3cc4ccccc4o3)N b5f51211c603cdfb9eee17e729d1f002 [0,0,0,1,0,0|1,0,2]=4 24 B24R4.201419852 Nc1nc(c2c(cccc2n1)c3cc4cccnc4[nH]3)N cbc09897477b76f77125b6cd5443c930 [0,0,0,1,0,0|2,0,1]=4 25 B24R4.201419852 Nc1nc(c2c(cccc2n1)c3cc4cccnc4s3)N f0a2bda56de9b5b2338ec3ea99d3f972 [0,0,0,1,0,0|2,0,1]=4 26 B22R3.10619059 Cc1ccoc1CNc2cccc3c2c(nc(n3)N)N 43b79025550310385988b8069fc35d09 [0,0,0,0,1,0|3,0,0]=4 27 B22R3.10619059 Cc1ncsc1CNc2cccc3c2c(nc(n3)N)N 9d4e4ac1a575bf7f66837ecc06504c98 [0,0,0,0,1,0|3,0,0]=4 28 B22R3.10619059 Cc1nocc1CNc2cccc3c2c(nc(n3)N)N aa2aee7d8fb9953c560b68140d91f29b [0,0,0,0,1,0|3,0,0]=4 29 B22R3.10619059 Cc1occc1CNc2cccc3c2c(nc(n3)N)N 4ab32cb390cac3e9f6b04b725ca5590f [0,0,0,0,1,0|3,0,0]=4 30 B22R3.10619059 Cn1cccc1CNc2cccc3c2c(nc(n3)N)N ab6ed149b1c8f47513e6173821c621c8 [0,0,0,0,1,0|3,0,0]=4 31 B21R3.525 Brc1ncccc1OCc2cccc3c2cccn3 cab4cb43499acaf63d30186b19b51ab4 [2,0,0,0,0,0|2,0,0]=4 32 B21R3.525 Brc1ncccc1OCc2cccc3c2cncc3 a35e133f0208873f180c49c3a2d02714 [2,0,0,0,0,0|2,0,0]=4 33 B21R3.525 Cc1ccccc1OCc2cccc3c2cccn3 53b9d7227fd2563e3138de32d08fe402 [2,0,0,0,0,0|2,0,0]=4 34 B21R3.525 Cc1ccccc1OCc2cccc3c2cncc3 dc02c8a4a3fc12fa076a3050c5cb8867 [2,0,0,0,0,0|2,0,0]=4 35 B21R3.525 Cc1ncccc1CNc2cccc3c2cncn3 7a512af04762487bda6f43daa5fcce14 [2,0,0,0,0,0|2,0,0]=4 36 B21R3.525 Cc1ncccc1NCc2cccc3c2cccn3 61ee98288b529a31d904a89a89e6c29d [2,0,0,0,0,0|2,0,0]=4 37 B21R3.525 Cc1ncccc1NCc2cccc3c2cncc3 3fe5d26d793f11d769210367dc292700 [2,0,0,0,0,0|2,0,0]=4 38 B21R3.525 Cc1ncccc1OCc2cccc3c2cccc3 acadd148315692ed689504bbcad21663 [2,0,0,0,0,0|2,0,0]=4 39 B21R3.525 Cc1ncccc1OCc2cccc3c2cccn3 3ee65893d202d794d4b64589df846359 [2,0,0,0,0,0|1,0,0]=3 40 B21R3.525 Cc1ncccc1OCc2cccc3c2cncc3 3bc42adb9560188aec296cee0cbd1d5b [2,0,0,0,0,0|1,0,0]=3 41 B21R3.525 Cc1ncccc1OCc2cccc3c2nccn3 db342d2d4cbf66ccb125b7e16fd562e5 [2,0,0,0,0,0|2,0,0]=4 42 B21R3.525 Cc1nccnc1OCc2cccc3c2cccn3 e762836f8a79e8145a9fcc2952e4f7ee [2,0,0,0,0,0|2,0,0]=4 43 B21R3.525 Cc1nccnc1OCc2cccc3c2cncc3 cdc4b9aa6b45ad773d33609a22e747a1 [2,0,0,0,0,0|2,0,0]=4 44 B21R3.525 Cc1ncncc1OCc2cccc3c2cccn3 1bb1ff7774e49b1dcbb9cd91a9c6453b [2,0,0,0,0,0|2,0,0]=4 45 B21R3.525 Cc1ncncc1OCc2cccc3c2cncc3 30a69971cfe80bb849afc799cafd01f5 [2,0,0,0,0,0|2,0,0]=4 46 B21R3.525 Clc1ncccc1OCc2cccc3c2cccn3 afc1ca0749faff5f00bbc0af78ca38e8 [2,0,0,0,0,0|2,0,0]=4 47 B21R3.525 Clc1ncccc1OCc2cccc3c2cncc3 159759dd83975f8fe1fd7b3d17db10f9 [2,0,0,0,0,0|2,0,0]=4 48 B21R3.525 Fc1ncccc1OCc2cccc3c2cccn3 b1d83754677f1823e4b996152c3daf8a [2,0,0,0,0,0|2,0,0]=4 49 B21R3.525 Fc1ncccc1OCc2cccc3c2cncc3 66dfcec69ca36179ea9df01eab53b232 [2,0,0,0,0,0|2,0,0]=4 50 B21R3.525 Ic1ncccc1OCc2cccc3c2cccn3 dbfd5c12a862c91322ca41d8d677f44f [2,0,0,0,0,0|2,0,0]=4 51 B21R3.525 Ic1ncccc1OCc2cccc3c2cncc3 01fd2abe0347f6c51ba650f99d5dafed [2,0,0,0,0,0|2,0,0]=4 52 B23R3.345848 CN(Cc1cccnc1)c2cccc3c2c(nc(n3)N)N eb1a1ec89424fd7959b9a49ea891dec6 [1,1,0,0,0,0|2,0,0]=4 53 B23R3.24622273 Cc1ccc(cn1)CNc2cccc3c2c(nc(n3)N)N 336d1bcebf0cc4c93abbf142e1cf28a2 [1,1,0,0,0,0|2,0,0]=4 54 B23R3.24622273 Nc1nc(c2c(cccc2n1)NCc3ccc(nc3)F)N b6af85fe4575223f0e53bb8f09e04d19 [1,1,0,0,0,0|2,0,0]=4 55 B23R3.73179940 Cc1cncc(c1)CNc2cccc3c2c(nc(n3)N)N 6dce8d07a3c917fa436beaa52733f502 [1,1,0,0,0,0|2,0,0]=4 56 B23R3.73179940 Nc1nc(c2c(cccc2n1)NCc3cncc(c3)F)N e41df24477b3e498452a1a6f9b0c3bfa [1,1,0,0,0,0|2,0,0]=4 57 B23R3.73179940 Nc1nc(c2c(cccc2n1)NCc3cncc(c3)O)N 700d04f804adbe75993e37031a4fa810 [1,1,0,0,0,0|2,0,0]=4 58 B23R3.223044023 CCc1ccccc1Nc2cccc3c2c(nc(n3)N)N 04ef6e5d365d002d1c35f14a50b66c9a [0,1,0,0,1,0|2,0,0]=4 59 B23R3.223044023 CCc1ncccc1Nc2cccc3c2c(nc(n3)N)N d40cd51b92adedbb313d2ffd7c600bc6 [0,1,0,0,1,0|1,0,0]=3 60 B23R3.223044023 CCc1nccnc1Nc2cccc3c2c(nc(n3)N)N 490a8d627dea1067fa9eb0fe355aad35 [0,1,0,0,1,0|2,0,0]=4 61 B23R3.223044023 Nc1nc(c2c(cccc2n1)Nc3ccccc3CBr)N 8dcf0cab8c4f395d1dced2c2c805337c [0,1,0,0,1,0|2,0,0]=4 62 B23R3.223044023 Nc1nc(c2c(cccc2n1)Nc3ccccc3CO)N e6ce9852fc46ab4a6ed1992a2f87ef68 [0,1,0,0,1,0|2,0,0]=4 63 B23R3.223044023 Nc1nc(c2c(cccc2n1)Nc3cccnc3C=O)N dee8970ee897d9870fed854bf99a23be [0,1,0,0,1,0|1,0,1]=4 64 B23R3.223044023 Nc1nc(c2c(cccc2n1)Nc3cccnc3CO)N d85b6c535544de15d397579380b08644 [0,1,0,0,1,0|1,0,0]=3 65 B25R3.351135267 COc1ccccc1CCNc2cccc3c2c(nc(n3)N)N 9dbc77146b1ed6633d1bea9989f91f71 [0,1,0,0,0,1|2,0,0]=4 66 B25R3.351135267 COc1ncccc1CCNc2cccc3c2c(nc(n3)N)N 350e37a490bafb4b7d20ea7d025e3c53 [0,1,0,0,0,1|1,0,0]=3 67 B25R3.19172111 CN(C)c1ncccc1CNc2cccc3c2c(nc(n3)N)N 8b9866f5fe85052820db1b9b63729559 [0,2,0,0,0,0|2,0,0]=4 68 B25R3.69455511 COc1ncc(cc1CNc2cccc3c2c(nc(n3)N)N)F 4b25c08fee71cd8cd8a5309d88ddbcab [0,2,0,0,0,0|2,0,0]=4 69 B25R3.245385547 CCOc1ncccc1CNc2cccc3c2c(nc(n3)N)N 656ca31d29b0b98d0050a79cc1bea09e [0,2,0,0,0,0|2,0,0]=4 70 B25R3.360057251 COc1nccc(c1CNc2cccc3c2c(nc(n3)N)N)C caa8fe161d6040e397c06bf3aab464e1 [0,2,0,0,0,0|2,0,0]=4 71 B25R3.367354716 COc1ccc(c(n1)C)CNc2cccc3c2c(nc(n3)N)N 441b6a37e390f57658b04ec5322c86b4 [0,2,0,0,0,0|2,0,0]=4 72 B23R3.112899 Cc1ccccc1OCc2ccccc2c3cc(n[nH]3)N 88830a12cc5210275a2ed6360fef8a75 [0,0,1,1,0,0|2,0,0]=4 73 B23R3.112899 Cc1ccccc1OCc2ccccc2c3nc(n[nH]3)N 8671b6db398a2a3424f16d29602d82f7 [0,0,1,1,0,0|1,0,0]=3 74 B23R3.112899 Cc1noc(n1)c2ccccc2COc3cccnc3C 4fed36cdd3f2e863c3fbfb36c6049d57 [0,0,1,1,0,0|2,0,0]=4 75 B23R3.112899 Nc1n[nH]c(n1)c2ccccc2COc3ccccc3Cl 51fa45e60a91210f0f8a44dc3971701b [0,0,1,1,0,0|2,0,0]=4 76 B23R3.112899 Nc1n[nH]c(n1)c2ccccc2COc3ccccc3F 8d5e4ba90261f39cefe50b367e702be0 [0,0,1,1,0,0|2,0,0]=4 77 B23R3.88254180 Cc1ncccc1CNc2ccc3c(nc(nc3c2)N)N 0049112d46897eee2ab11c6fe5574372 [0,0,1,1,0,0|2,0,0]=4 78 B25R4.27984139 Nc1nc(c2c(cccc2n1)NCC3Cc4c3cccc4)N 24e0822166911ab5f057d850cab4cd0b [0,0,0,1,0,1|2,0,0]=4 79 B25R4.261031739 Cc1c(oc2c1cccc2)c3cccc4c3c(nc(n4)N)N d53e192997a75ff24332800b2463185e [0,1,0,1,0,0|1,0,1]=4 80 B21R3.442649 Cc1ncccc1OCc2cccc3c2cnn3C c33beae312de8ef3f02ef178306a856b [1,0,0,0,1,0|2,0,0]=4 81 B21R3.442609 Cc1ncccc1OCc2cccc3c2n(nc3)C 0650ff3852c6aa5477d007c351e20ef4 [1,0,0,0,1,0|2,0,0]=4 82 B21R3.3965817 Cc1ncccc1OCc2ccn3c2c(ncn3)Cl 22e99c5c541190697035ece15d2e2582 [1,0,0,0,1,0|2,0,0]=4 83 B21R3.3965387 Cc1cccnc1c2cccc3c2c(nc(n3)N)N a78af62d9e2d8c1875eca49652c94adf [0,0,0,0,2,0|2,0,0]=4 84 B21R3.3965387 Cc1ccncc1c2cccc3c2c(nc(n3)N)N afdde73a5df36ef3a275307164774072 [0,0,0,0,2,0|2,0,0]=4 85 B21R3.3965387 Cc1cnccc1c2cccc3c2c(nc(n3)N)N c9441470fe8e4c8d68d9a9923e621c79 [0,0,0,0,2,0|2,0,0]=4 86 B21R3.3965387 Cc1ncccc1c2cccc3c2c(=O)[nH]c(n3)N 5d61d64f5ca687d54a38edf0df24aec1 [0,0,0,0,2,0|1,0,1]=4 87 B21R3.3965387 Cc1ncccc1c2cccc3c2c(nc(n3)N)N 2038afba84468005f0d8f66eb6dfa17a [0,0,0,0,2,0|0,0,0]=2 88 B21R3.3965387 Cc1ncncc1c2cccc3c2c(nc(n3)N)N 03e58bb68f58a98fa9daf5ab1be54319 [0,0,0,0,2,0|1,0,0]=3 89 B21R3.3965387 Nc1nc(c2c(cccc2n1)c3ccccc3Cl)N 7c35a419ad8dd2f6261e3754aa9408f7 [0,0,0,0,2,0|2,0,0]=4 90 B21R3.3965387 Nc1nc(c2c(cccc2n1)c3ccccc3F)N 9b394949d6be561e7d13dd94426212de [0,0,0,0,2,0|2,0,0]=4 91 B21R3.3965387 Nc1nc(c2c(cccc2n1)c3ccccc3I)N e1b9331e4cc6823b59650ef044f4cae4 [0,0,0,0,2,0|2,0,0]=4 92 B21R3.3965387 Nc1nc(c2c(cccc2n1)c3cccnc3Br)N 6b9468a83e0c06217d7188da8b9ce72c [0,0,0,0,2,0|1,0,0]=3 93 B21R3.3965387 Nc1nc(c2c(cccc2n1)c3cccnc3Cl)N 04011e23423e4dde98139f1f9dd0dad2 [0,0,0,0,2,0|1,0,0]=3 94 B21R3.3965387 Nc1nc(c2c(cccc2n1)c3cccnc3F)N 0da9785fdc963dd33cd31d3c37df0fb4 [0,0,0,0,2,0|1,0,0]=3 95 B21R3.4394170 Cc1ncsc1Nc2cccc3c2c(nc(n3)N)N c165613c9480f82def5f21125a631c1e [0,0,0,0,2,0|2,0,0]=4 96 B23R3.161765 Cc1cc2cccc(c2cn1)COCc3cccnc3C 856fa573ea3a8b4f95972bbc19f42944 [1,0,0,0,0,1|2,0,0]=4 97 B23R3.76298199 Cc1ncccc1CNc2ccc3nc(nc(c3c2)N)N bdd8a3c4ccc1eeb5de8a30d286217838 [0,0,0,0,1,1|2,0,0]=4 98 B23R3.76298199 Cc1ncccc1CNc2ccc3nc(nc(c3n2)N)N 468fe7072f428c1dcbe2cd0dcdf2a7bb [0,0,0,0,1,1|2,0,0]=4 99 B25R3.213939337 Cc1ccccc1CCCNc2cccc3c2c(nc(n3)N)N 0f5149803be89fd5062c651ae6922b46 [0,0,0,0,0,2|2,0,0]=4 100 B25R3.213939337 Cc1ccccc1OCCNc2cccc3c2c(nc(n3)N)N 239c2b93b925de0913eb760ec54e6512 [0,0,0,0,0,2|1,0,0]=3 101 B25R3.213939337 Nc1nc(c2c(cccc2n1)NCCOc3ccccc3F)N 9b7b102eacc72e6e2d57c04629eb5ea0 [0,0,0,0,0,2|2,0,0]=4