0 B21R3.29517666 Nc1nc(c2c(cccc2n1)NCC3(COC3)F)N 6a1a787ba13b29862823c13dbbce2591 [0,0,0,0,0,0|2,0,0]=2 1 B20R3.98823 CC1(COC1)CNc2cccc3c2ccc(n3)Cl 016d497a3f06138739936e18dfaac3ac [1,0,0,0,0,0|3,0,0]=4 2 B20R3.98823 CC1(COC1)CNc2cccc3c2ccc(n3)F 5985a7618b864833281c3a08ea92a685 [1,0,0,0,0,0|3,0,0]=4 3 B20R3.98823 CC1(COC1)COc2cccc3c2ccc(=O)[nH]3 70bbf49a660ff27ba6b267e64f67908d [1,0,0,0,0,0|2,0,1]=4 4 B20R3.98823 CC1(COC1)COc2cccc3c2ccc(c3)Br d1b4e7eefdf278d4eab01d79e015f931 [1,0,0,0,0,0|3,0,0]=4 5 B20R3.98823 CC1(COC1)COc2cccc3c2ccc(c3)Cl c38925f1758e15eef79ff3dc1de925d3 [1,0,0,0,0,0|3,0,0]=4 6 B20R3.98823 CC1(COC1)COc2cccc3c2ccc(c3)F 4b5b5142f8297808e155635145f583b4 [1,0,0,0,0,0|3,0,0]=4 7 B20R3.98823 Cc1cc2cccc(c2cn1)NCC3(COC3)C 8f6279e82722a6a0a0cfbd66c99383cc [1,0,0,0,0,0|3,0,0]=4 8 B20R3.98823 Cc1ccc2c(cccc2c1)OCC3(COC3)C efe95908f4642e5e9ee78c3be7c11d97 [1,0,0,0,0,0|3,0,0]=4 9 B20R3.98823 Cc1ccc2c(cccc2n1)NCC3(COC3)C 229d8a9c342077b453167d62effdf773 [1,0,0,0,0,0|3,0,0]=4 10 B20R3.98823 Cc1ccc2c(cccc2n1)OCC3(CCC3)C 30a00b96c2587f739080f949944d6e24 [1,0,0,0,0,0|3,0,0]=4 11 B20R3.98823 Cc1ccc2c(cccc2n1)OCC3(COC3)C 379e63b693b94637f25a1872e935038a [1,0,0,0,0,0|2,0,0]=3 12 B20R3.98823 Cc1ccc2c(cccc2n1)OCC3(COC3)F 69f33961b17530c4c5165eaaeeb35a6e [1,0,0,0,0,0|3,0,0]=4 13 B20R3.3465633 Nc1nc(c2c(cccc2n1)NCC3CCC3)N 918a7371bbac6398b3a07d91923980f3 [1,0,0,0,0,0|2,0,0]=3 14 B20R3.3465633 Nc1nc(c2c(cccc2n1)NCC3CCO3)N eaef54cf6cd7478d740887bef68b5428 [1,0,0,0,0,0|3,0,0]=4 15 B20R3.3465633 Nc1nc(c2c(cccc2n1)NC[C@@H]3CCO3)N 8b9f28352b5aad736c131068ffbb3f5e [1,0,0,0,0,0|3,0,0]=4 16 B20R3.3465633 Nc1nc(c2c(cccc2n1)NC[C@H]3CCO3)N 448c60c6b08b249d211ce174174cd13b [1,0,0,0,0,0|3,0,0]=4 17 B20R3.19469193 CC1(COC1)CNc2cccc3c2c(ccn3)Cl 8a9101468ccd137bc0603102a1688c7d [1,0,0,0,0,0|3,0,0]=4 18 B20R3.19469193 CC1(COC1)COc2cccc3c2c(=O)[nH]cc3 138e1cf9b7fac8766998cab4f6eb7759 [1,0,0,0,0,0|2,0,1]=4 19 B20R3.19469193 CC1(COC1)COc2cccc3c2c(=O)cco3 ab72c0a97bfc4bdb392fccc16aa4d4af [1,0,0,0,0,0|3,0,0]=4 20 B20R3.19469193 CC1(COC1)COc2cccc3c2c(ccc3)Br 8c9dd25d5728bd0ad1ed9b4f532b3323 [1,0,0,0,0,0|3,0,0]=4 21 B20R3.19469193 CC1(COC1)COc2cccc3c2c(ccc3)Cl 9e52a9e7893ea2a52269ec0a65a4709a [1,0,0,0,0,0|3,0,0]=4 22 B20R3.19469193 CC1(COC1)COc2cccc3c2c(ccc3)F d1d1256dedde512f53e4ea8bc3fa5c26 [1,0,0,0,0,0|3,0,0]=4 23 B20R3.19469193 Cc1ccnc2c1c(ccc2)NCC3(COC3)C 5ac2f5dfb5cfe51915b1ca64c4a04edf [1,0,0,0,0,0|3,0,0]=4 24 B22R3.53624906 Nc1nc(c2c(cccc2n1)NCC3(CC(C3)O)O)N 1d1b3c45bcf22e58bc551043e9584caf [0,1,0,0,0,0|3,0,0]=4 25 B22R3.72913062 CC1(COC1)CNc2c(ccc3c2c(=O)[nH]c(n3)N)N 874b90d4142c6dd6ea5a6d4c407f6b26 [0,1,0,0,0,0|2,0,1]=4 26 B22R3.248264886 CN(CC1(CCC1)O)c2cccc3c2c(nc(n3)N)N 5f9004659baaba94cbbce6875a1f683e [0,1,0,0,0,0|3,0,0]=4 27 B22R3.248264886 CN(CC1(COC1)C)c2cccc3c2c(nc(n3)N)N 41ec0b3f45bc2560b5fb256abb6c56c4 [0,1,0,0,0,0|1,0,0]=2 28 B22R3.248264886 CN(CC1(COC1)F)c2cccc3c2c(nc(n3)N)N 4545a46c2d47e0f8ecf354fe259277e8 [0,1,0,0,0,0|2,0,0]=3 29 B20R3.15808146 Nc1nc(c2c(cccc2n1)NCC3(CC3)F)N feae93e2ebc9845c218fda2a4d3b9aa4 [0,0,0,0,1,0|2,0,0]=3 30 B22R3.53624905 Nc1nc(c2c(cccc2n1)NCC3(CCCC3)F)N 4da9184e2deeb97dd67dd9a524745856 [0,0,0,0,0,1|3,0,0]=4 31 B19R2.4427914 COCCCNc1cccc2c1c(nc(n2)N)N a77b85595cc3fb4c002d26df884ce87b [1,0,1,0,0,0|1,0,0]=3 32 B19R2.4427914 CSCCCNc1cccc2c1c(nc(n2)N)N 657627f4f5fba2544aae3957e9a8edd0 [1,0,1,0,0,0|1,1,0]=4 33 B19R2.7037027 Nc1nc(c2c(cccc2n1)NCC(F)CO)N fa3aad2c22c2546c6d37e59b57017f8b [1,0,1,0,0,0|2,0,0]=4 34 B19R2.7037027 Nc1nc(c2c(cccc2n1)NCC(O)CO)N 369d514dc2f1a264372514f286653273 [1,0,1,0,0,0|2,0,0]=4 35 B19R2.7037027 Nc1nc(c2c(cccc2n1)NC[C@@H](F)CO)N 974081074f7f02dcb0bdbef8259d335e [1,0,1,0,0,0|2,0,0]=4 36 B19R2.7037027 Nc1nc(c2c(cccc2n1)NC[C@@H](O)CO)N 50964503e5dc8ecd47919a2f884c60fe [1,0,1,0,0,0|2,0,0]=4 37 B19R2.7037027 Nc1nc(c2c(cccc2n1)NC[C@H](F)CO)N cc4da17f6450a8a84a294e1df0bd4957 [1,0,1,0,0,0|2,0,0]=4 38 B19R2.7037027 Nc1nc(c2c(cccc2n1)NC[C@H](O)CO)N 3fec9c67cedb8d29cc64e702c9cd3a0d [1,0,1,0,0,0|2,0,0]=4 39 B19R3.59498 Cc1ccc2c(cccc2n1)OCC3COC3 d46dc6613a9b370fb469e0812463c7f2 [2,0,0,0,0,0|2,0,0]=4 40 B19R3.59821 CC1(CCC1)CNc2cccc3c2cncn3 8836b0ce2aa186d81151730dec0008d6 [2,0,0,0,0,0|2,0,0]=4 41 B19R3.59821 CC1(CCC1)COc2cccc3c2cccn3 f5ca4b0e7cdef3088d5727cd66fc6024 [2,0,0,0,0,0|2,0,0]=4 42 B19R3.59821 CC1(CCC1)COc2cccc3c2cncc3 cbf27eee7f912a1b26f09d11cd2be992 [2,0,0,0,0,0|2,0,0]=4 43 B19R3.59821 CC1(COC1)CNc2cccc3c2cccn3 5b35ffbdec7e888e654ca80f582940a6 [2,0,0,0,0,0|2,0,0]=4 44 B19R3.59821 CC1(COC1)CNc2cccc3c2cncc3 030dbb5c3739cffd60bc54944d9fa4de [2,0,0,0,0,0|2,0,0]=4 45 B19R3.59821 CC1(COC1)CNc2cccc3c2cncn3 ce7775821d259c66d370fc84ed752b32 [2,0,0,0,0,0|1,0,0]=3 46 B19R3.59821 CC1(COC1)COc2cccc3c2cccc3 2ca47316ccb433aa562b3a339b852a83 [2,0,0,0,0,0|2,0,0]=4 47 B19R3.59821 CC1(COC1)COc2cccc3c2cccn3 6bd5f03679529173d3f5b408822e643d [2,0,0,0,0,0|1,0,0]=3 48 B19R3.59821 CC1(COC1)COc2cccc3c2cncc3 f860f449da8bebd37f41b7e647ad8500 [2,0,0,0,0,0|1,0,0]=3 49 B19R3.59821 CC1(COC1)COc2cccc3c2nccn3 bddfcdc59b8404d8d923c25a2d8aa9ec [2,0,0,0,0,0|2,0,0]=4 50 B19R3.59821 CC1(COC1)COc2ccnc3c2cccn3 57fadd3e4fcd623d4096e87c04204f7b [2,0,0,0,0,0|2,0,0]=4 51 B19R3.59821 FC1(COC1)CNc2cccc3c2cncn3 d2a3b546790b4483631706826b51e5a5 [2,0,0,0,0,0|2,0,0]=4 52 B19R3.59821 FC1(COC1)COc2cccc3c2cccn3 c02aef50f04f1e2c1b9c78b3bdaaeaaa [2,0,0,0,0,0|2,0,0]=4 53 B19R3.59821 FC1(COC1)COc2cccc3c2cncc3 2f36e24c59c7b58f9a6cd1ca53b4e2f0 [2,0,0,0,0,0|2,0,0]=4 54 B21R2.3650939 CC(CNc1cccc2c1c(nc(n2)N)N)CN(C)C cafeb7b16125f872cb404be2e706c1e4 [0,1,1,0,0,0|2,0,0]=4 55 B21R2.35775680 COCC(O)CN(C)c1cccc2c1c(nc(n2)N)N 6ee14577c32415bbefd7602af0254d24 [0,1,1,0,0,0|2,0,0]=4 56 B21R3.77489 CC1(COC1)COc2cccc3c2ccc(n3)C#N f01f59db23286c2dbbdd176532821e63 [1,1,0,0,0,0|1,0,1]=4 57 B21R3.40124749 CC1(COC1)COc2ccc(c3c2ccc(n3)Cl)Br 5ac27ae5f23f1f61936955187a70dcdc [1,1,0,0,0,0|2,0,0]=4 58 B21R3.85402748 CCC1(COC1)COc2cccc3c2ccc(n3)C caabaea10e978f1a61a02523fa2c58a5 [1,1,0,0,0,0|2,0,0]=4 59 B21R3.85402748 COC1(COC1)COc2cccc3c2ccc(n3)C a010013c91a344525620faaf3b90223c [1,1,0,0,0,0|2,0,0]=4 60 B21R3.85402748 Cc1ccc2c(cccc2n1)OCC3(COC3)CF 2e9c09279e58219688e3a11959a37e2f [1,1,0,0,0,0|2,0,0]=4 61 B21R3.4952862 CN(CC1CCC1)c2cccc3c2c(nc(n3)N)N 43b0bfc03bafd2db034d55f6916d9ad0 [1,1,0,0,0,0|2,0,0]=4 62 B21R3.4952862 CN(CC1COC1)c2cccc3c2c(nc(n3)N)N 22d867139306af60fddfd4afa8a0619b [1,1,0,0,0,0|1,0,0]=3 63 B21R3.29517616 Nc1nc(c2c(cccc2n1)NCC3CC(C3)O)N 097d93be86372f5e682f88880a03ccd4 [1,1,0,0,0,0|2,0,0]=4 64 B21R3.29517616 Nc1nc(c2c(cccc2n1)NC[C@H]3C[C@@H](C3)O)N d9524007cf8724cce31b75451b893d12 [1,1,0,0,0,0|2,0,0]=4 65 B21R3.29517616 Nc1nc(c2c(cccc2n1)NC[C@H]3C[C@H](C3)O)N ad6182a285377996b1a170488416dc89 [1,1,0,0,0,0|2,0,0]=4 66 B21R3.38118273 Cc1ccnc2c1c(ccc2Cl)OCC3(COC3)C aadcd6d2fdd28fc5eb4d20edb787e6fc [1,1,0,0,0,0|2,0,0]=4 67 B23R3.493275660 CN(CC1(CCCO1)C)c2cccc3c2c(nc(n3)N)N a2e33da5ca79b4dadd830b994a4efb5e [0,1,0,0,0,1|2,0,0]=4 68 B23R3.94567381 CC(C)C1(COC1)CNc2cccc3c2c(nc(n3)N)N f75cbeeaebc48e51a837e63284ac04f3 [0,2,0,0,0,0|1,0,0]=3 69 B23R3.94567381 CN(C)C1(COC1)CNc2cccc3c2c(nc(n3)N)N 42813ca04874a57bcd461df9e57b2421 [0,2,0,0,0,0|1,0,0]=3 70 B23R3.94567381 Nc1nc(c2c(cccc2n1)NCC3(COC3)C(F)F)N b5d5482ac59c757a9568ebfd8bed3418 [0,2,0,0,0,0|1,0,0]=3 71 B21R3.41233566 Nc1nc(c2ccc(cc2n1)NCC3(COC3)F)N 1e138d474783161162a12a4011d15a2e [0,0,1,1,0,0|2,0,0]=4 72 B21R3.3731203 Cc1n[nH]c(n1)c2ccccc2NCC3(COC3)C 2370ef4b95d03f51bcea19b7d2b58550 [0,0,1,1,0,0|2,0,0]=4 73 B21R3.3731203 Cc1noc(n1)c2ccccc2OCC3(COC3)C e0449a4ea852b7d1d359a3afd4b97f2c [0,0,1,1,0,0|2,0,0]=4 74 B21R3.43484242 CC1(COC1)COc2ccc3[nH]cnc3c2C(=O)O 5a4493f1f04db549015353fb952d88e9 [0,0,1,1,0,0|2,0,0]=4 75 B19R3.18875 CC1(COC1)COc2cccc3c2[nH]nc3Br 90b6a56fa36107a569fc86ec593e6298 [1,0,0,0,1,0|2,0,0]=4 76 B19R3.18875 Cc1n[nH]c2c1cccc2OCC3(COC3)C 85b316fc54dd700f95fe2919691438dc [1,0,0,0,1,0|2,0,0]=4 77 B19R3.18875 Cn1ncc2c1cccc2OCC3(COC3)C bed7b50c77cd85bbf349133b88d75f3b [1,0,0,0,1,0|2,0,0]=4 78 B19R3.58636 Cc1ccc2c(cccc2n1)OCC3(CC3)C 7a8a2eb24beb526a348c1c2ea1066c20 [1,0,0,0,1,0|2,0,0]=4 79 B19R3.181112 CC1(COC1)CNc2cccc3c2nc([nH]3)N 46f4c0a4057c0d8f4060ca78e3811476 [1,0,0,0,1,0|1,0,1]=4 80 B19R3.181112 CC1(COC1)CNc2cccc3c2nc(o3)N 1246fc3e56851f605e5b17d8e8f2641f [1,0,0,0,1,0|2,0,0]=4 81 B19R3.181112 CC1(COC1)CNc2cccc3c2nc(s3)N b989772f77a5dc3f1f996b8e6244ce7a [1,0,0,0,1,0|2,0,0]=4 82 B19R3.181112 CC1(COC1)CNc2cccc3c2oc(n3)N 6cc05699e4d1eaf9615b02e56b77dcf7 [1,0,0,0,1,0|2,0,0]=4 83 B19R3.181112 CC1(COC1)CNc2cccc3c2sc(n3)N a396f42feca8cd041daccd107ecc4f3b [1,0,0,0,1,0|2,0,0]=4 84 B19R3.181112 CC1(COC1)COc2cccc3c2nc(s3)Br be98c340fc36036e95b62f6c8e6ec1af [1,0,0,0,1,0|2,0,0]=4 85 B19R3.181112 CC1(COC1)COc2cccc3c2nc(s3)Cl 9835b881f5a6c06d1f8db55dc36a7eb4 [1,0,0,0,1,0|2,0,0]=4 86 B19R3.181112 CC1(COC1)COc2cccc3c2sc(n3)Cl 73e4c74c4e26fb305e3e230844d0bd02 [1,0,0,0,1,0|2,0,0]=4 87 B19R3.181112 Cc1cc2c(cccc2[nH]1)OCC3(COC3)C f9a705318f1107509ea186bca2b725d8 [1,0,0,0,1,0|1,0,1]=4 88 B19R3.181112 Cc1nc2c(cccc2[nH]1)OCC3(COC3)C 345d130f4391c82b62f242ca72be22ce [1,0,0,0,1,0|1,0,1]=4 89 B19R3.181112 Cc1nc2c(cccc2o1)OCC3(COC3)C b9e634bed1f7c9adb6c7dc4a901624b7 [1,0,0,0,1,0|2,0,0]=4 90 B19R3.181112 Cc1nc2c(cccc2s1)OCC3(COC3)C 8270bf83c6d42101115a832bbe18ceac [1,0,0,0,1,0|2,0,0]=4 91 B19R3.181112 Cn1cc2c(cccc2n1)OCC3(COC3)C dfa44569e09ceeb969634f8219e2728b [1,0,0,0,1,0|2,0,0]=4 92 B19R3.2534853 Nc1nc(c2c(cccc2n1)NCC3CC3)N 61819d740460ac2b347b850bc94f94e8 [1,0,0,0,1,0|1,0,0]=3 93 B19R3.7689882 CC1(COC1)COc2cccc3c2c(n[nH]3)I ac5cc20e6a1cdfa6920f675aead88da5 [1,0,0,0,1,0|1,0,1]=4 94 B19R3.7689882 Cc1c[nH]c2c1c(ccc2)OCC3(COC3)C 44bc4e15b9df115af341687aea91262b [1,0,0,0,1,0|1,0,1]=4 95 B19R3.7689882 Cc1n[nH]c2c1c(ccc2)OCC3(COC3)C 3f2787459ad61a3fa76ed0aec7498a12 [1,0,0,0,1,0|1,0,1]=4 96 B19R3.7689882 Cc1noc2c1c(ccc2)OCC3(COC3)C 65bb6c4b2c844fcf33ae58b4a558e342 [1,0,0,0,1,0|2,0,0]=4 97 B19R3.7689882 Cn1ncc2c1c(ccc2)OCC3(COC3)C b9fc89cb6ba67c0c176c19041c781966 [1,0,0,0,1,0|2,0,0]=4 98 B21R3.162350 Cc1cc2cccc(c2cn1)COCC3(COC3)C e0d79967479d9807bcd90666d15b4703 [1,0,0,0,0,1|2,0,0]=4 99 B21R3.29517919 Nc1nc(c2c(cccc2n1)NCCC3(CC3)O)N 554a23eac61a0e18fad3932ef8cd79d1 [0,0,0,0,1,1|2,0,0]=4 100 B21R3.141921755 CC1(COC1)CNc2ccc3nc(nc(c3c2)N)N 5e6d0dbde64080a2846ae9950636132a [0,0,0,0,1,1|1,0,0]=3 101 B21R3.141921755 CC1(COC1)CNc2ccc3nc(nc(c3n2)N)N 77f6f43d80c79463548e7eaaa553a764 [0,0,0,0,1,1|1,0,0]=3 102 B21R3.141921755 CC1(COC1)COc2ccc3nc(nc(c3c2)Cl)Cl c60af881821044d74e4a9825fae8f8fc [0,0,0,0,1,1|2,0,0]=4 103 B21R3.141921755 Cc1nc(c2cc(ccc2n1)OCC3(COC3)C)Cl 3d26a068d46166010b2ca51e16edf827 [0,0,0,0,1,1|2,0,0]=4 104 B21R3.141921755 Nc1nc(c2cc(ccc2n1)NCC3(COC3)F)N c4246c133043b1505c687178ec456e37 [0,0,0,0,1,1|2,0,0]=4 105 B21R3.141921755 Nc1nc(c2cc(ccc2n1)NCC3(COC3)O)N f78ee65571568cf7eb47981d78b8507c [0,0,0,0,1,1|2,0,0]=4 106 B21R3.141921755 Nc1nc(c2nc(ccc2n1)NCC3(COC3)F)N 093280d0543cd6656127c5f773ae8304 [0,0,0,0,1,1|2,0,0]=4 107 B21R3.141921755 Nc1nc(c2nc(ccc2n1)NCC3(COC3)O)N b181ef942cf87740bb0180ae2445d177 [0,0,0,0,1,1|2,0,0]=4 108 B23R3.94567380 Nc1nc(c2c(cccc2n1)NCC3(CCOCC3)F)N 17916f872a805a4f4a4e1485fe5fc377 [0,0,0,0,0,2|2,0,0]=4