0 B12R2.27 CCN1CC1c2ccccc2 9688627107d4117581407497e721ccee [0,1,0,0,0,0|2,0,0]=3 1 B12R2.27 CCN1C[C@@H]1c2ccccc2 c32dec6f3160b9b7bc8c2839caf72878 [0,1,0,0,0,0|2,0,0]=3 2 B12R2.27 FCN1CC1c2ccccc2 961cd8c1338ecdce6a27ac300fedcc98 [0,1,0,0,0,0|2,0,0]=3 3 B12R2.27 FCN1C[C@@H]1c2ccccc2 186c23a739812eaa2456c8641683ea36 [0,1,0,0,0,0|2,0,0]=3 4 B12R2.27 O=CN1CC1c2ccccc2 762f19a034f772a367d3e7ac6806d5e0 [0,1,0,0,0,0|2,0,0]=3 5 B12R2.27 O=CN1C[C@@H]1c2ccccc2 3cd739dd6b25e8af9413dc2836c79b56 [0,1,0,0,0,0|2,0,0]=3 6 B12R2.27 OCN1CC1c2ccccc2 380946bf56a518a4f82b6f06607820f1 [0,1,0,0,0,0|2,0,0]=3 7 B12R2.27 OCN1C[C@@H]1c2ccccc2 b0131158d23691f2ccd2899d00b705c5 [0,1,0,0,0,0|2,0,0]=3 8 B10R1.15 CCN(C)c1ccccc1 9cc6568b1f30abe04427bdea858da30e [0,0,1,0,0,0|2,0,0]=3 9 B10R1.15 CCN(C)c1cccnc1 04b21f569d4c75e23135eca19e8dfd7f [0,0,1,0,0,0|3,0,0]=4 10 B10R1.15 CCN(C)c1ccncc1 b94b8554b6698451ca404459911593cc [0,0,1,0,0,0|3,0,0]=4 11 B10R1.15 CN(CF)c1ccccn1 1bdd19ff0d205b3af825ce3149dae35a [0,0,1,0,0,0|3,0,0]=4 12 B10R1.15 CN(CF)c1cccnc1 242d56eee61bf5da227aba2cc8ffb8a2 [0,0,1,0,0,0|3,0,0]=4 13 B10R1.15 CN(CF)c1ccncc1 ce40ba3bf88af1d1b771c6b7bb26d1be [0,0,1,0,0,0|3,0,0]=4 14 B10R1.15 CN(CO)c1ccccn1 a93cc933fdb4d1c91563e07701d40cda [0,0,1,0,0,0|3,0,0]=4 15 B10R1.15 CN(CO)c1cccnc1 021ae75de63d9271d48b9d5b4bd35a1c [0,0,1,0,0,0|3,0,0]=4 16 B10R1.15 CN(CO)c1ccncc1 80b84f29ca23cc8379579376d55abff3 [0,0,1,0,0,0|3,0,0]=4 17 B10R1.17 BrCCNc1ccccc1 08c39138e90dcc3ad4c25fdba0569b67 [0,0,1,0,0,0|2,0,0]=3 18 B10R1.17 BrCCNc1ccccn1 3e3884def368abe14a8394ce1a1093e4 [0,0,1,0,0,0|3,0,0]=4 19 B10R1.17 BrCCNc1cccnc1 2d13be8c88ebb7269676c6abc03a383d [0,0,1,0,0,0|3,0,0]=4 20 B10R1.17 BrCCNc1ccncc1 aa3f433af4f4f2183977f3124b404d50 [0,0,1,0,0,0|3,0,0]=4 21 B10R1.17 C#CCNc1ccccc1 61f0baab40ac49dd5c7bdcf3c0e69fb4 [0,0,1,0,0,0|2,0,1]=4 22 B10R1.17 C=CCNc1ccccc1 47db636c74d7e6cdd4488df2cb146b26 [0,0,1,0,0,0|2,0,1]=4 23 B10R1.17 CCCNc1ccccc1 b539dcf8361adb43cc5ffbb8617222f9 [0,0,1,0,0,0|2,0,0]=3 24 B10R1.17 CCCNc1ccccn1 d0e3424364e1c8a55b80e6e83d3696ba [0,0,1,0,0,0|3,0,0]=4 25 B10R1.17 CCCNc1cccnc1 54f0ece250e78709faf1eb2fd4dc869b [0,0,1,0,0,0|3,0,0]=4 26 B10R1.17 CCCNc1ccncc1 d6095b2a5c05617a6cec49b81fb053c5 [0,0,1,0,0,0|3,0,0]=4 27 B10R1.17 CCCOc1ccccn1 6e04423b9fd777130a88eaa9fd38fe0c [0,0,1,0,0,0|3,0,0]=4 28 B10R1.17 CCCOc1cccnc1 a97f517fc793a805aaab3ac7468bbd26 [0,0,1,0,0,0|3,0,0]=4 29 B10R1.17 CCCOc1ccncc1 f349ca52270425380eacc7a2a158cca4 [0,0,1,0,0,0|3,0,0]=4 30 B10R1.17 CCNCc1ccccc1 b1285c6596ffdf0473a3780bf23df272 [0,0,1,0,0,0|2,0,0]=3 31 B10R1.17 CCNCc1ccccn1 18cfef8413e038075fdfe85720c8bb60 [0,0,1,0,0,0|3,0,0]=4 32 B10R1.17 CCNCc1cccnc1 ef83bfb13d2744bc293d6f1d68f67b86 [0,0,1,0,0,0|3,0,0]=4 33 B10R1.17 CCNCc1ccncc1 2e26d8de78e71e06bcd28df387653244 [0,0,1,0,0,0|3,0,0]=4 34 B10R1.17 CCOCc1ccccc1 551a24ad73c54bc42b4e27015fdb411f [0,0,1,0,0,0|2,0,0]=3 35 B10R1.17 CCOCc1ccccn1 0c63694580ac3136b3801886d248907b [0,0,1,0,0,0|3,0,0]=4 36 B10R1.17 CCOCc1cccnc1 5f09f824e7a9d5177841898d80553992 [0,0,1,0,0,0|3,0,0]=4 37 B10R1.17 CCOCc1ccncc1 1d1afe04b02325a5cf955e686c22ba10 [0,0,1,0,0,0|3,0,0]=4 38 B10R1.17 COCNc1ccccc1 6c62c6b48b6ce69fe29d4b52e03d5674 [0,0,1,0,0,0|3,0,0]=4 39 B10R1.17 CSCNc1ccccc1 7a27a5c68b132b0ae36908396631930e [0,0,1,0,0,0|3,0,0]=4 40 B10R1.17 FCCNc1ccccc1 f275d2eb426a2818882d3c7dcacca572 [0,0,1,0,0,0|2,0,0]=3 41 B10R1.17 FCCNc1ccccn1 6ab197fb6cbd8dea7ad6d85c80356b58 [0,0,1,0,0,0|3,0,0]=4 42 B10R1.17 FCCNc1cccnc1 948881de1f8cebdb00d3305a89cccf21 [0,0,1,0,0,0|3,0,0]=4 43 B10R1.17 FCCNc1ccncc1 261e26a80d82936049687c2cbf67d868 [0,0,1,0,0,0|3,0,0]=4 44 B10R1.17 FCCOc1ccccn1 06b65dfb48082d4779fc37c34dadb476 [0,0,1,0,0,0|3,0,0]=4 45 B10R1.17 FCCOc1cccnc1 7a88b89adbe5c70a007fa3204bf675ab [0,0,1,0,0,0|3,0,0]=4 46 B10R1.17 FCCOc1ccncc1 7674fd5219d4fad9f3b2390ff6ade4b7 [0,0,1,0,0,0|3,0,0]=4 47 B10R1.17 FCNCc1ccccc1 0dcd541b35f2d813e3bd4529f13aa61b [0,0,1,0,0,0|2,0,0]=3 48 B10R1.17 FCNCc1ccccn1 14327276004818c05fc55a3ce987673c [0,0,1,0,0,0|3,0,0]=4 49 B10R1.17 FCNCc1cccnc1 303a68c3e72902076a5285aac654492a [0,0,1,0,0,0|3,0,0]=4 50 B10R1.17 FCNCc1ccncc1 f86a74e0d1d92929ce958fb624476f4c [0,0,1,0,0,0|3,0,0]=4 51 B10R1.17 FCOCc1ccccc1 602c85a0828834d1798ab6d91c5aa92b [0,0,1,0,0,0|2,0,0]=3 52 B10R1.17 FCOCc1ccccn1 52de5aacdb8cde16edb0cbea31183c40 [0,0,1,0,0,0|3,0,0]=4 53 B10R1.17 FCOCc1cccnc1 d58467b55ec7fcb175961d4ef6210edb [0,0,1,0,0,0|3,0,0]=4 54 B10R1.17 FCOCc1ccncc1 90104d817a6745d762aa8ebc5bd6efa2 [0,0,1,0,0,0|3,0,0]=4 55 B10R1.17 ICCNc1ccccc1 2e8d29f41a7952c3a309dd8ce57744b3 [0,0,1,0,0,0|2,0,0]=3 56 B10R1.17 ICCNc1cccnc1 bd2873fb4e8705ac6b2391510b61aca0 [0,0,1,0,0,0|3,0,0]=4 57 B10R1.17 N#CCNc1ccccc1 fb8b42e8ff84ada914e54c1d3d6bf55b [0,0,1,0,0,0|1,0,2]=4 58 B10R1.17 N#CNCc1ccccc1 a34d70ab939a88101ebb668f17250d10 [0,0,1,0,0,0|1,0,2]=4 59 B10R1.17 O=CCNc1ccccc1 c4995b86d7297371e551e9130c388474 [0,0,1,0,0,0|2,0,1]=4 60 B10R1.17 O=CNCc1ccccc1 8c79f42269c527e7ed1741ce8019791f [0,0,1,0,0,0|2,0,1]=4 61 B10R1.17 OCCNc1ccccc1 39a30f826fab6ed2b66a9ec4a9dddbdb [0,0,1,0,0,0|2,0,0]=3 62 B10R1.17 OCCNc1ccccn1 14d1f9671b0391e7cf5b318b74673aa8 [0,0,1,0,0,0|3,0,0]=4 63 B10R1.17 OCCNc1cccnc1 528072d5adbbf320415662e70c05db36 [0,0,1,0,0,0|3,0,0]=4 64 B10R1.17 OCCNc1ccncc1 2d153fc0224e0960cc8e262d108ccf9f [0,0,1,0,0,0|3,0,0]=4 65 B10R1.17 OCNCc1ccccc1 c4aaeb48f32c090af3c65531a6e27cd4 [0,0,1,0,0,0|2,0,0]=3 66 B10R1.17 OCNCc1ccccn1 9488b9a65408dc593594baac432012ff [0,0,1,0,0,0|3,0,0]=4 67 B10R1.17 OCNCc1cccnc1 86bd6343ace558a3752eaa3d1a554844 [0,0,1,0,0,0|3,0,0]=4 68 B10R1.17 OCNCc1ccncc1 31d693e5cbaa1006fa13d8924b3493eb [0,0,1,0,0,0|3,0,0]=4 69 B10R1.17 SCCNc1ccccc1 9bbad99372906cf90d9dd5df1e41681f [0,0,1,0,0,0|2,0,0]=3 70 B10R1.17 SCCNc1ccccn1 de2447df01f4514b4267a28db291424f [0,0,1,0,0,0|3,0,0]=4 71 B10R1.17 SCCNc1cccnc1 d7661b93dffeb3e5de5eb3930ee71345 [0,0,1,0,0,0|3,0,0]=4 72 B10R1.17 SCCNc1ccncc1 577353449c24c89c4540584279fd2c55 [0,0,1,0,0,0|3,0,0]=4 73 B10R1.17 SCCOc1ccccn1 80884e7103538d273738856f1f9d4222 [0,0,1,0,0,0|3,0,0]=4 74 B10R1.17 SCCOc1cccnc1 84b759d60311f3e5695c1f1ffc5005e0 [0,0,1,0,0,0|3,0,0]=4 75 B10R1.17 SCCOc1ccncc1 bcb2c22e459aa7ecd2660e818a75429e [0,0,1,0,0,0|3,0,0]=4 76 B10R1.18 CC(C)Nc1ccccc1 678b2595d663b993cd638fb4df86366a [0,0,1,0,0,0|2,0,0]=3 77 B10R1.18 CC(C)Nc1ccccn1 8f41ba2831fdc97ef841b17526dcf604 [0,0,1,0,0,0|3,0,0]=4 78 B10R1.18 CC(C)Nc1cccnc1 b32b013363863cea153240b96e97c19f [0,0,1,0,0,0|3,0,0]=4 79 B10R1.18 CC(C)Nc1ccncc1 ed919cf6533ea85c87fe5a974cf5c4b4 [0,0,1,0,0,0|3,0,0]=4 80 B10R1.18 CC(C)Oc1ccccn1 0855bdc27823287e98107cda25a8e4de [0,0,1,0,0,0|3,0,0]=4 81 B10R1.18 CC(C)Oc1cccnc1 2d5fbf8b6573bcaaa6ad1437daf348fa [0,0,1,0,0,0|3,0,0]=4 82 B10R1.18 CC(C)Oc1ccncc1 fcbd1de824cfd0b7040632344868de57 [0,0,1,0,0,0|3,0,0]=4 83 B12R2.11 CC1CC1Nc2ccccc2 6c2b1ed9451679c2c2b0f3748602bd6d [0,0,0,0,0,1|1,0,0]=2 84 B12R2.11 CC1CC1Nc2cccnc2 e0f55178f08b4b2b54d9d876d97d2290 [0,0,0,0,0,1|2,0,0]=3 85 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccccc2 25c07123a823d9ea2969aff7da72cef4 [0,0,0,0,0,1|1,0,0]=2 86 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccccn2 fc41faec2161d9bc088f35169f0fc9e1 [0,0,0,0,0,1|2,0,0]=3 87 B12R2.11 F[C@@H]1C[C@@H]1Nc2cccnc2 9a55f17e12e7bd55a0d9204d46e602d2 [0,0,0,0,0,1|2,0,0]=3 88 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccncc2 e875be7aa53cc8868d0dc6f2280dccb1 [0,0,0,0,0,1|2,0,0]=3 89 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccncn2 a97eeedc63e1e7d9830b83980c492513 [0,0,0,0,0,1|3,0,0]=4 90 B12R2.11 F[C@@H]1C[C@@H]1Nc2cnccn2 17ad0f6a412e18d1388640b2dd918d1e [0,0,0,0,0,1|3,0,0]=4 91 B12R2.11 F[C@@H]1C[C@H]1Nc2ccccc2 b0efbced164dabbe532e6255951097b4 [0,0,0,0,0,1|1,0,0]=2 92 B12R2.11 F[C@@H]1C[C@H]1Nc2ccccn2 fc17ffe1e9ad6aa28e2159d2a121a181 [0,0,0,0,0,1|2,0,0]=3 93 B12R2.11 F[C@@H]1C[C@H]1Nc2cccnc2 0d6be40ecda6b776d8730416c6199b26 [0,0,0,0,0,1|2,0,0]=3 94 B12R2.11 F[C@@H]1C[C@H]1Nc2ccncc2 9a1a1d0be717c0e6f1c430f271f30434 [0,0,0,0,0,1|2,0,0]=3 95 B12R2.11 F[C@@H]1C[C@H]1Nc2ccncn2 db20e6e5f8bed0c08026296876d7ccc8 [0,0,0,0,0,1|3,0,0]=4 96 B12R2.11 F[C@@H]1C[C@H]1Nc2cnccn2 847448d513daab96512baf4a4956cf38 [0,0,0,0,0,1|3,0,0]=4 97 B12R2.11 F[C@H]1C[C@@H]1Nc2ccccc2 e610ffc6a467ed241d6c7f91606b201b [0,0,0,0,0,1|1,0,0]=2 98 B12R2.11 F[C@H]1C[C@@H]1Nc2ccccn2 59b89bc513bfcbe6b29399fe485506d9 [0,0,0,0,0,1|2,0,0]=3 99 B12R2.11 F[C@H]1C[C@@H]1Nc2cccnc2 8475542138490fb913b76b598d12ad5e [0,0,0,0,0,1|2,0,0]=3 100 B12R2.11 F[C@H]1C[C@@H]1Nc2ccncc2 f538efd1a15bc37e881d8b371d907da9 [0,0,0,0,0,1|2,0,0]=3 101 B12R2.11 F[C@H]1C[C@@H]1Nc2ccncn2 38cf8b56ac7318bbf6a7ae18fa483726 [0,0,0,0,0,1|3,0,0]=4 102 B12R2.11 F[C@H]1C[C@@H]1Nc2cnccn2 0f117c1c77e8c296447cda49159d8ccc [0,0,0,0,0,1|3,0,0]=4 103 B9R1.8 CCNc1ccccc1 33257e4a9e1d882742dfd4cfddb78cda [1,0,1,0,0,0|1,0,0]=3 104 B9R1.8 CCNc1ccccn1 2525c23bd886b96c78c0be1e9ad1905b [1,0,1,0,0,0|2,0,0]=4 105 B9R1.8 CCNc1cccnc1 e16c06cad87ecb5a3a4a58b6d8537631 [1,0,1,0,0,0|2,0,0]=4 106 B9R1.8 CCNc1ccncc1 76118d388bf159fc52a5b3b43773c6d0 [1,0,1,0,0,0|2,0,0]=4 107 B9R1.8 CCOc1ccccn1 8b10ed115fcb5b65f209d3b07c05b728 [1,0,1,0,0,0|2,0,0]=4 108 B9R1.8 CCOc1cccnc1 efa582b018c37c3ab155936515b551ea [1,0,1,0,0,0|2,0,0]=4 109 B9R1.8 CCOc1ccncc1 365c1eef106f5326bc3144a980f01ba5 [1,0,1,0,0,0|2,0,0]=4 110 B9R1.8 FCNc1ccccc1 c8185de2a7206057ede93409452a493c [1,0,1,0,0,0|2,0,0]=4 111 B9R1.8 OCNc1ccccc1 6a26daba1a11b7282126aadb7f7b8f97 [1,0,1,0,0,0|2,0,0]=4 112 B11R1.12 CCN(CF)c1ccccc1 64bfdf9f1ec7c91dbb7909bf38760f4f [0,1,1,0,0,0|2,0,0]=4 113 B11R1.16 C#CCN(C)c1ccccc1 3ca89e194431e8e98a41325339f135b2 [0,1,1,0,0,0|2,0,0]=4 114 B11R1.16 C=CCN(C)c1ccccc1 cb57bdb31a063701918aa00f058638bf [0,1,1,0,0,0|2,0,0]=4 115 B11R1.16 CC(NC=O)c1ccccc1 912f825ae8ec09ad8cb929f90e443d73 [0,1,1,0,0,0|1,0,1]=4 116 B11R1.16 CC(NCF)c1ccccn1 0905269fa9a0af5b89b0863135e0ba86 [0,1,1,0,0,0|2,0,0]=4 117 B11R1.16 CC(NCF)c1cccnc1 06f634f0617dadb8cf037734a8a97de2 [0,1,1,0,0,0|2,0,0]=4 118 B11R1.16 CC(NCF)c1ccncc1 52244c9bda4d3b96fb892679ba84673a [0,1,1,0,0,0|2,0,0]=4 119 B11R1.16 CC(NCO)c1ccccn1 92e2d7a3e5eb4a0cf656a3abd8120ca1 [0,1,1,0,0,0|2,0,0]=4 120 B11R1.16 CC(NCO)c1cccnc1 862c30acc11398ef9d9eed839c208db8 [0,1,1,0,0,0|2,0,0]=4 121 B11R1.16 CC(NCO)c1ccncc1 c1d5cc5db08b36fc1a8cd8b573f9e139 [0,1,1,0,0,0|2,0,0]=4 122 B11R1.16 CC(OCF)c1ccccc1 a5a4510633c1500ac034b294490d7f65 [0,1,1,0,0,0|1,0,0]=3 123 B11R1.16 CC(OCF)c1ccccn1 2375003933f3ce846737f38420e767b3 [0,1,1,0,0,0|2,0,0]=4 124 B11R1.16 CC(OCF)c1cccnc1 38385d8a804ea3beb03ef81ac1897631 [0,1,1,0,0,0|2,0,0]=4 125 B11R1.16 CC(OCF)c1ccncc1 6bf0979779201a0d2383a11ee6cede62 [0,1,1,0,0,0|2,0,0]=4 126 B11R1.16 CCCN(C)c1ccccc1 5333b12ce18e2a38096b8e486fed114a [0,1,1,0,0,0|2,0,0]=4 127 B11R1.16 CCNC(C)c1ccccc1 af03e39d181c5fd668bda5d6f7d06e14 [0,1,1,0,0,0|1,0,0]=3 128 B11R1.16 CCNC(C)c1ccccn1 1349d82fdb3aca31d54d33a892f4429f [0,1,1,0,0,0|2,0,0]=4 129 B11R1.16 CCNC(C)c1cccnc1 c47433cc5cae1ddbdb53f6ca3e6bfaaf [0,1,1,0,0,0|2,0,0]=4 130 B11R1.16 CCNC(C)c1ccncc1 4381b6d20643b9397cf1c3275f14ef7f [0,1,1,0,0,0|2,0,0]=4 131 B11R1.16 CCN[C@@H](C)c1ccccc1 994b5b0b50363ecab1efd5b7f9e6d7cd [0,1,1,0,0,0|1,0,0]=3 132 B11R1.16 CCN[C@@H](C)c1ccccn1 6becaa5dd299afbde8d9e40b8df2b64b [0,1,1,0,0,0|2,0,0]=4 133 B11R1.16 CCN[C@@H](C)c1cccnc1 330151f91eef2953e097f24cd8fe5255 [0,1,1,0,0,0|2,0,0]=4 134 B11R1.16 CCN[C@@H](C)c1ccncc1 00312d91ebda62098fbd65a2d65ba17c [0,1,1,0,0,0|2,0,0]=4 135 B11R1.16 CCN[C@H](C)c1ccccc1 af432512ad94856da6ef9d44592c3502 [0,1,1,0,0,0|1,0,0]=3 136 B11R1.16 CCN[C@H](C)c1ccccn1 de5b9d337b6c15bb985fd6d76426b016 [0,1,1,0,0,0|2,0,0]=4 137 B11R1.16 CCN[C@H](C)c1cccnc1 7cb1b35ff9549b4a705f07ae86659632 [0,1,1,0,0,0|2,0,0]=4 138 B11R1.16 CCN[C@H](C)c1ccncc1 d9dd8baf03e60276588d8bf323f0d599 [0,1,1,0,0,0|2,0,0]=4 139 B11R1.16 CCOC(C)c1ccccc1 37108e833ff536d25c550cb5b37c873d [0,1,1,0,0,0|1,0,0]=3 140 B11R1.16 CCOC(C)c1ccccn1 2349fef21e807c42cd2b612eadfb89fd [0,1,1,0,0,0|2,0,0]=4 141 B11R1.16 CCOC(C)c1cccnc1 9c9e8ee26a948f6734fe8bca4ac259d1 [0,1,1,0,0,0|2,0,0]=4 142 B11R1.16 CCOC(C)c1ccncc1 e4e418e4b9933d9ffab69561c2ee0b8d [0,1,1,0,0,0|2,0,0]=4 143 B11R1.16 CCO[C@@H](C)c1ccccc1 e4f11a13dd3f609e6f25ac3a3b969fe2 [0,1,1,0,0,0|1,0,0]=3 144 B11R1.16 CCO[C@@H](C)c1ccccn1 d31d85c16530817c2b81fb1a03fe7e57 [0,1,1,0,0,0|2,0,0]=4 145 B11R1.16 CCO[C@@H](C)c1cccnc1 4f79e80bc80f924c1d9263e4c7a80e48 [0,1,1,0,0,0|2,0,0]=4 146 B11R1.16 CCO[C@@H](C)c1ccncc1 10c7e45b7f2432aed0d2d85f0e9de43f [0,1,1,0,0,0|2,0,0]=4 147 B11R1.16 CCO[C@H](C)c1ccccc1 54694971b3853f962e687b61e7c698c1 [0,1,1,0,0,0|1,0,0]=3 148 B11R1.16 CCO[C@H](C)c1ccccn1 c768b24f1cd72ff8137851b753ae2d04 [0,1,1,0,0,0|2,0,0]=4 149 B11R1.16 CCO[C@H](C)c1cccnc1 cd637b20fb4bf525c6de41c7953f4069 [0,1,1,0,0,0|2,0,0]=4 150 B11R1.16 CCO[C@H](C)c1ccncc1 be826d73c7c9b4a2a044295b6bfe0a2c [0,1,1,0,0,0|2,0,0]=4 151 B11R1.16 CN(CC#N)c1ccccc1 e4996d8d05652ac5f69757d7a543c8c3 [0,1,1,0,0,0|1,0,1]=4 152 B11R1.16 CN(CC=O)c1ccccc1 669b7315010cb1229c9893a5bac75e38 [0,1,1,0,0,0|2,0,0]=4 153 B11R1.16 CN(CCF)c1ccccc1 10541e2e32dac0db7a85ea44620c0e3e [0,1,1,0,0,0|2,0,0]=4 154 B11R1.16 CN(CCO)c1ccccc1 4b734b8d391d02ddf47f0308fb1d22c8 [0,1,1,0,0,0|2,0,0]=4 155 B11R1.16 COCN(C)c1ccccc1 6231e4bc9ebe3bdb02fd15faeb34634f [0,1,1,0,0,0|2,0,0]=4 156 B11R1.16 CSCN(C)c1ccccc1 6fe637e44a17092ac12098dbdcb5352f [0,1,1,0,0,0|2,0,0]=4 157 B11R1.16 C[C@@H](NC=O)c1ccccc1 ed3cbc790dab943801487e30e3a37c11 [0,1,1,0,0,0|1,0,1]=4 158 B11R1.16 C[C@@H](NCF)c1ccccn1 99b97b5aa9cfaef5c750c0b6f424a155 [0,1,1,0,0,0|2,0,0]=4 159 B11R1.16 C[C@@H](NCF)c1cccnc1 661209de32fd81ce54914e1bd942009a [0,1,1,0,0,0|2,0,0]=4 160 B11R1.16 C[C@@H](NCF)c1ccncc1 7c723b81de2f22629dc13a66a3539cc2 [0,1,1,0,0,0|2,0,0]=4 161 B11R1.16 C[C@@H](NCO)c1ccccn1 06a1df171fb3e867c231d94d30fe4c59 [0,1,1,0,0,0|2,0,0]=4 162 B11R1.16 C[C@@H](NCO)c1cccnc1 cf5dbaaa37b8cb4e2f16350a55683027 [0,1,1,0,0,0|2,0,0]=4 163 B11R1.16 C[C@@H](NCO)c1ccncc1 7d10d857a4fd7fe5ca5ccba46504091e [0,1,1,0,0,0|2,0,0]=4 164 B11R1.16 C[C@@H](OCF)c1ccccc1 f6dc1405e5744871891f84657f997fd4 [0,1,1,0,0,0|1,0,0]=3 165 B11R1.16 C[C@@H](OCF)c1ccccn1 452563b793d445f90c7b5445d0861252 [0,1,1,0,0,0|2,0,0]=4 166 B11R1.16 C[C@@H](OCF)c1cccnc1 700f73ac95c9eff915753055610d6829 [0,1,1,0,0,0|2,0,0]=4 167 B11R1.16 C[C@@H](OCF)c1ccncc1 1ab9725f241037c368e977085ea4a520 [0,1,1,0,0,0|2,0,0]=4 168 B11R1.16 C[C@H](NC=O)c1ccccc1 0ca5dec48ba28ecff3cefea41bc874f0 [0,1,1,0,0,0|1,0,1]=4 169 B11R1.16 C[C@H](NCF)c1ccccn1 3f81f6af69df7aaa916f5a60f5ffdf6c [0,1,1,0,0,0|2,0,0]=4 170 B11R1.16 C[C@H](NCF)c1cccnc1 66a2dcad38cbf0d519df63526d229e46 [0,1,1,0,0,0|2,0,0]=4 171 B11R1.16 C[C@H](NCF)c1ccncc1 01b512844ac187d8e5e90b8a3d251ae9 [0,1,1,0,0,0|2,0,0]=4 172 B11R1.16 C[C@H](NCO)c1ccccn1 d98746896574333cf45787ddae8ffaa8 [0,1,1,0,0,0|2,0,0]=4 173 B11R1.16 C[C@H](NCO)c1cccnc1 476af247167559627f6aa699dfa54495 [0,1,1,0,0,0|2,0,0]=4 174 B11R1.16 C[C@H](NCO)c1ccncc1 6f6a1ba3773069295a22e913e615ab17 [0,1,1,0,0,0|2,0,0]=4 175 B11R1.16 C[C@H](OCF)c1ccccc1 0bdd092ad3daed19f52c193b52481cfc [0,1,1,0,0,0|1,0,0]=3 176 B11R1.16 C[C@H](OCF)c1ccccn1 6ecec266ea2cccd56a91b2c7f7312784 [0,1,1,0,0,0|2,0,0]=4 177 B11R1.16 C[C@H](OCF)c1cccnc1 1642ade6f48ada445386d02dbd40b795 [0,1,1,0,0,0|2,0,0]=4 178 B11R1.16 C[C@H](OCF)c1ccncc1 1ba2b2d00b1ff65d044471b9d6a9a89a [0,1,1,0,0,0|2,0,0]=4 179 B11R1.22 CCN(C)c1ccc(cc1)F 37e2d475a9bd3cfcf296a94fc69fd067 [0,1,1,0,0,0|2,0,0]=4 180 B11R1.22 CCN(C)c1ccc(cc1)I 6deef7aec400603f68eb68f0833942ec [0,1,1,0,0,0|2,0,0]=4 181 B11R1.22 CCN(C)c1ccc(cc1)S 429f96f94511567839fe68b5edd62f1c [0,1,1,0,0,0|2,0,0]=4 182 B11R1.22 CN(CF)c1ccc(cc1)Br 6b91b8da88ddbfb295c2dccdb6cb4076 [0,1,1,0,0,0|2,0,0]=4 183 B11R1.22 CN(CF)c1ccc(cc1)Cl 0c4cb302bade12f5a411b01a9042b3ea [0,1,1,0,0,0|2,0,0]=4 184 B11R1.22 CN(CF)c1ccc(cc1)F 7a7162e57e22a4f5e6a55d2c6d204d3d [0,1,1,0,0,0|2,0,0]=4 185 B11R1.22 CN(CF)c1ccc(cc1)I 6d998585b1c8e8e7964bc459bdd74230 [0,1,1,0,0,0|2,0,0]=4 186 B11R1.22 CN(CF)c1ccc(cc1)S 790104648dfcde077abfb3f2fb190f26 [0,1,1,0,0,0|2,0,0]=4 187 B11R1.22 CN(CO)c1ccc(cc1)Br a0ee612d9ade0f057f40eda0edee63d6 [0,1,1,0,0,0|2,0,0]=4 188 B11R1.22 CN(CO)c1ccc(cc1)Cl 2c0dfaf13b4e02b467d222656644d816 [0,1,1,0,0,0|2,0,0]=4 189 B11R1.22 CN(CO)c1ccc(cc1)F c1ecf99a3d9f55a2562607c88c44d1b8 [0,1,1,0,0,0|2,0,0]=4 190 B11R1.22 CN(CO)c1ccc(cc1)I 148086324dd93cd760089e4e94a122ba [0,1,1,0,0,0|2,0,0]=4 191 B11R1.22 CN(CO)c1ccc(cc1)S 7e6f64a1230a5e349b82adbdac7f2cd1 [0,1,1,0,0,0|2,0,0]=4 192 B11R1.22 Cc1ccc(cc1)N(C)CF d9ca75efcf22688224e11802328b1cd1 [0,1,1,0,0,0|2,0,0]=4 193 B11R1.22 Cc1ccc(cc1)N(C)CO 3f90488aa46443ae7ceb46a9828e79d3 [0,1,1,0,0,0|2,0,0]=4 194 B11R1.23 CCN(C)c1cccc(c1)Br b9912e02c1f17bb41ebd144c9e9202ee [0,1,1,0,0,0|2,0,0]=4 195 B11R1.23 CCN(C)c1cccc(c1)F 430101ed975145c517dcbcb463820b73 [0,1,1,0,0,0|2,0,0]=4 196 B11R1.23 CN(CF)c1cccc(c1)Br 7a123ee73cafbdd957621bfb9faccc3f [0,1,1,0,0,0|2,0,0]=4 197 B11R1.23 CN(CF)c1cccc(c1)Cl 3c5b88557b8c81a0b3c7ed9ad71bde08 [0,1,1,0,0,0|2,0,0]=4 198 B11R1.23 CN(CF)c1cccc(c1)F 222030735d42d27fe394bc21ac4ac2c3 [0,1,1,0,0,0|2,0,0]=4 199 B11R1.23 CN(CF)c1cccc(c1)I a4932831bd90a86126da38899926fb81 [0,1,1,0,0,0|2,0,0]=4 200 B11R1.23 CN(CO)c1cccc(c1)Br 338387980ae1b5bd1aeb8f0f3d8c21d1 [0,1,1,0,0,0|2,0,0]=4 201 B11R1.23 CN(CO)c1cccc(c1)Cl cddd29b5bf9afdf9ebf4b5b2535c5ce6 [0,1,1,0,0,0|2,0,0]=4 202 B11R1.23 CN(CO)c1cccc(c1)F 0413508efd514c5105c44e46cec3cac8 [0,1,1,0,0,0|2,0,0]=4 203 B11R1.23 CN(CO)c1cccc(c1)I 1efe9cbcfb545c4004f668bff7e82fc4 [0,1,1,0,0,0|2,0,0]=4 204 B11R1.222 CCN(C)c1ccccc1C 9f04b12bb5b89a6592eb728905a01c8b [0,1,1,0,0,0|2,0,0]=4 205 B11R1.222 CCN(C)c1ccccc1F f232548c9b2f85032dbceb393dfbf769 [0,1,1,0,0,0|2,0,0]=4 206 B11R1.222 CN(CF)c1ccccc1F 664f2d950c125d3a1fa31610e43e1d60 [0,1,1,0,0,0|2,0,0]=4 207 B11R1.222 CN(CO)c1ccccc1Cl 93c8a0a05d68ffe0b62289d5206a4d45 [0,1,1,0,0,0|2,0,0]=4 208 B11R1.222 CN(CO)c1ccccc1F 37525b3659f76f6cb84994c550b2f6ca [0,1,1,0,0,0|2,0,0]=4 209 B11R1.222 Cc1ccccc1N(C)CF 151ec0fcc79157784dd7bc5d5aa488f4 [0,1,1,0,0,0|2,0,0]=4 210 B11R1.222 Cc1ccccc1N(C)CO 360a66e6984b8285375a37f5a2a3ef94 [0,1,1,0,0,0|2,0,0]=4 211 B11R1.1 CCCNc1ccc(cc1)Br 95e3de2d252597fde5ce9a477304d00e [0,1,1,0,0,0|2,0,0]=4 212 B11R1.1 CCCNc1ccc(cc1)C 60206ed79d50ce0b51d2c9baa6a9bfd8 [0,1,1,0,0,0|2,0,0]=4 213 B11R1.1 CCCNc1ccc(cc1)Cl 78619a742ccf6ba08a4394e2ee033c54 [0,1,1,0,0,0|2,0,0]=4 214 B11R1.1 CCCNc1ccc(cc1)F 03593481ab116133e85310d463cb3940 [0,1,1,0,0,0|2,0,0]=4 215 B11R1.1 CCCNc1ccc(cc1)I 1d619469e460bbb1d49ca10b65682c62 [0,1,1,0,0,0|2,0,0]=4 216 B11R1.1 CCCNc1ccc(cc1)S 5de90476a8c0464c76157dc952d2c04c [0,1,1,0,0,0|2,0,0]=4 217 B11R1.1 CCCOc1ccc(cc1)Br fcee74d69e8e023a5434abc8b0385424 [0,1,1,0,0,0|2,0,0]=4 218 B11R1.1 CCCOc1ccc(cc1)C 4fdcf2ff939bb0420513a197f77843e9 [0,1,1,0,0,0|2,0,0]=4 219 B11R1.1 CCCOc1ccc(cc1)Cl 6ca291266ab2c05a274ea67a7fbcb647 [0,1,1,0,0,0|2,0,0]=4 220 B11R1.1 CCCOc1ccc(cc1)F 18444060e70b801a4550e15d090495f3 [0,1,1,0,0,0|2,0,0]=4 221 B11R1.1 CCCOc1ccc(cc1)I 1cc2cc68a2ed4244fd1e94b3d6df9d5e [0,1,1,0,0,0|2,0,0]=4 222 B11R1.1 CCCOc1ccc(cc1)S 5c2ad8fc9e5698065bd7177da22c3e46 [0,1,1,0,0,0|2,0,0]=4 223 B11R1.1 CCNCc1ccc(cc1)Br 2cd51938999c20d02733c25a0b5c4804 [0,1,1,0,0,0|2,0,0]=4 224 B11R1.1 CCNCc1ccc(cc1)C 587aa1ee1f45a7f7f3762adcf6ab1e89 [0,1,1,0,0,0|2,0,0]=4 225 B11R1.1 CCNCc1ccc(cc1)Cl 521dc09ab663236062b599824b274153 [0,1,1,0,0,0|2,0,0]=4 226 B11R1.1 CCNCc1ccc(cc1)F 507a49f5c428a46a95718b00a3fd1bd9 [0,1,1,0,0,0|2,0,0]=4 227 B11R1.1 CCNCc1ccc(cc1)I cb00fc5924e1405950f010ec806d6a94 [0,1,1,0,0,0|2,0,0]=4 228 B11R1.1 CCOCc1ccc(cc1)Br 55e365425e5287f17bedcdf9c6cf8797 [0,1,1,0,0,0|2,0,0]=4 229 B11R1.1 CCOCc1ccc(cc1)C 4d215a4a9529a309b910ed7006942890 [0,1,1,0,0,0|2,0,0]=4 230 B11R1.1 CCOCc1ccc(cc1)Cl 162fb8a5396843344a75f2243153a2a9 [0,1,1,0,0,0|2,0,0]=4 231 B11R1.1 CCOCc1ccc(cc1)F 67e386059816bee45125127b16cfcbee [0,1,1,0,0,0|2,0,0]=4 232 B11R1.1 CCOCc1ccc(cc1)I 25d977d51d9f47d9f153070d57dca8b8 [0,1,1,0,0,0|2,0,0]=4 233 B11R1.1 CCOCc1ccc(cc1)S 51de74da01a41ad35713330690173be6 [0,1,1,0,0,0|2,0,0]=4 234 B11R1.1 Cc1ccc(cc1)CNCF 3d235376bf58ba37ce4fc4687e7358b9 [0,1,1,0,0,0|2,0,0]=4 235 B11R1.1 Cc1ccc(cc1)CNCO a64a75f18e5667093ebf917d1b07eefc [0,1,1,0,0,0|2,0,0]=4 236 B11R1.1 Cc1ccc(cc1)COCF be23a3cdf78a8f91f485a087d32e2751 [0,1,1,0,0,0|2,0,0]=4 237 B11R1.1 Cc1ccc(cc1)NCCF 386681a63315a2a02458b9e317339172 [0,1,1,0,0,0|2,0,0]=4 238 B11R1.1 Cc1ccc(cc1)NCCI 021b0820ca00ee1bd1c722072e28fcea [0,1,1,0,0,0|2,0,0]=4 239 B11R1.1 Cc1ccc(cc1)NCCO c023022501f62f6373bdd984b07a8e61 [0,1,1,0,0,0|2,0,0]=4 240 B11R1.1 Cc1ccc(cc1)NCCS 6ed2fe969f35f3c0b0884c2a5f799763 [0,1,1,0,0,0|2,0,0]=4 241 B11R1.1 Cc1ccc(cc1)OCCF e658fde0065759000a395a993eb3f831 [0,1,1,0,0,0|2,0,0]=4 242 B11R1.1 Cc1ccc(cc1)OCCS 11a5d5c742743cac8e072d93bc1a4fc6 [0,1,1,0,0,0|2,0,0]=4 243 B11R1.1 FCCNc1ccc(cc1)Br 795a720a4c9b19afbc5301fa123947f2 [0,1,1,0,0,0|2,0,0]=4 244 B11R1.1 FCCNc1ccc(cc1)Cl e3d2a59ab56b1cb94b6555756f53e4df [0,1,1,0,0,0|2,0,0]=4 245 B11R1.1 FCCNc1ccc(cc1)F 7c335ec10923f1e5e1c0a802d22815aa [0,1,1,0,0,0|2,0,0]=4 246 B11R1.1 FCCNc1ccc(cc1)I 7a3114f1b82f1ae9c3e9d91f867c2aec [0,1,1,0,0,0|2,0,0]=4 247 B11R1.1 FCCNc1ccc(cc1)S 4cf1191b5d4fa0438db5fb212abc0568 [0,1,1,0,0,0|2,0,0]=4 248 B11R1.1 FCCOc1ccc(cc1)Br 44af21b9bd08ebef7a3593bbf1c00f13 [0,1,1,0,0,0|2,0,0]=4 249 B11R1.1 FCCOc1ccc(cc1)Cl f8953730f3c70ba1c351ddf061f5adb9 [0,1,1,0,0,0|2,0,0]=4 250 B11R1.1 FCCOc1ccc(cc1)F b8491737d875b8a9ba1853dfb7c71826 [0,1,1,0,0,0|2,0,0]=4 251 B11R1.1 FCCOc1ccc(cc1)I b3c3da697e2c7b319e1842d4b6e652a6 [0,1,1,0,0,0|2,0,0]=4 252 B11R1.1 FCCOc1ccc(cc1)S c0287c49d3bee2c771e7d9f8b8b1a91d [0,1,1,0,0,0|2,0,0]=4 253 B11R1.1 FCNCc1ccc(cc1)Br b716c1dcd41bf6fd6d535897c1b8ce0c [0,1,1,0,0,0|2,0,0]=4 254 B11R1.1 FCNCc1ccc(cc1)Cl 699409f205c611587d6f375bf5f31fce [0,1,1,0,0,0|2,0,0]=4 255 B11R1.1 FCNCc1ccc(cc1)F 25a744931aeb914e659c9f9632eb93fc [0,1,1,0,0,0|2,0,0]=4 256 B11R1.1 FCNCc1ccc(cc1)I d9e1151471912873877eda8a2b6050e5 [0,1,1,0,0,0|2,0,0]=4 257 B11R1.1 FCOCc1ccc(cc1)Br 5272f40abeb8f9788218e0855efe7f99 [0,1,1,0,0,0|2,0,0]=4 258 B11R1.1 FCOCc1ccc(cc1)Cl a424b465d05ec98f468ea1690dfb41e3 [0,1,1,0,0,0|2,0,0]=4 259 B11R1.1 FCOCc1ccc(cc1)F 40afdc034cb36d38932d0008a2d4420f [0,1,1,0,0,0|2,0,0]=4 260 B11R1.1 FCOCc1ccc(cc1)I 614cbd3d7d1898e18b49cf57a3be3c96 [0,1,1,0,0,0|2,0,0]=4 261 B11R1.1 FCOCc1ccc(cc1)S caeca7060fe6aa9edb0562b9e232c2bd [0,1,1,0,0,0|2,0,0]=4 262 B11R1.1 Fc1ccc(cc1)NCCS 96eb09cf1d4b57152e2f391fd4e4c79f [0,1,1,0,0,0|2,0,0]=4 263 B11R1.1 Fc1ccc(cc1)OCCS c98699e8299c427f19ef74ef43ecdb98 [0,1,1,0,0,0|2,0,0]=4 264 B11R1.1 OCCNc1ccc(cc1)Br 535465584ac9d4ff57889448ec1b0af0 [0,1,1,0,0,0|2,0,0]=4 265 B11R1.1 OCCNc1ccc(cc1)Cl 4d55580a2576d97655667590feb9394c [0,1,1,0,0,0|2,0,0]=4 266 B11R1.1 OCCNc1ccc(cc1)F f0dccf24099a23c54c8c24ea89525ac0 [0,1,1,0,0,0|2,0,0]=4 267 B11R1.1 OCCNc1ccc(cc1)I 9010f3f5111bb57e7ee5fcc7037cafde [0,1,1,0,0,0|2,0,0]=4 268 B11R1.1 OCCNc1ccc(cc1)S 4de960e6b8963c27bc320732a003972b [0,1,1,0,0,0|2,0,0]=4 269 B11R1.1 OCNCc1ccc(cc1)Br 29941d371c032fabf1b94e49679e2b91 [0,1,1,0,0,0|2,0,0]=4 270 B11R1.1 OCNCc1ccc(cc1)Cl 66d7e1612c59e389035460da5f165c29 [0,1,1,0,0,0|2,0,0]=4 271 B11R1.1 OCNCc1ccc(cc1)F e82a245e5fea20cb06713ef60eb282ff [0,1,1,0,0,0|2,0,0]=4 272 B11R1.1 OCNCc1ccc(cc1)I bba7fc5edf7c0932c8de644faad89e3d [0,1,1,0,0,0|2,0,0]=4 273 B11R1.1 SCCNc1ccc(cc1)Br 41e93a2a025b2d31a08348072d46995d [0,1,1,0,0,0|2,0,0]=4 274 B11R1.1 SCCNc1ccc(cc1)Cl ee69b35444ec478b79ac20b53c76c74b [0,1,1,0,0,0|2,0,0]=4 275 B11R1.1 SCCNc1ccc(cc1)I feb446bc7f74f6fc3358374bc85a5fa6 [0,1,1,0,0,0|2,0,0]=4 276 B11R1.1 SCCNc1ccc(cc1)S 2b2c1e7e53c6fe298543f5113fe04de1 [0,1,1,0,0,0|2,0,0]=4 277 B11R1.1 SCCOc1ccc(cc1)Br bec71d6fa1c3471b8eb02dbdf51052b8 [0,1,1,0,0,0|2,0,0]=4 278 B11R1.1 SCCOc1ccc(cc1)Cl 4097eb53f6e8a186542d58da584632ba [0,1,1,0,0,0|2,0,0]=4 279 B11R1.1 SCCOc1ccc(cc1)I d7cb4bc51a02120fb1493ad10574d07c [0,1,1,0,0,0|2,0,0]=4 280 B11R1.1 SCCOc1ccc(cc1)S 82e09f61a6f4576bab72abe9784dd780 [0,1,1,0,0,0|2,0,0]=4 281 B11R1.1 Sc1ccc(cc1)NCCBr 2fd36e3b90e35bd113cc6aa6559ccbb3 [0,1,1,0,0,0|2,0,0]=4 282 B11R1.1 Sc1ccc(cc1)NCCI 3102b13fbfd44fa9c9c245c461b01292 [0,1,1,0,0,0|2,0,0]=4 283 B11R1.17 CCCNc1ccccc1Cl f06644db92e5a5e5c88ba3d72e76b09c [0,1,1,0,0,0|2,0,0]=4 284 B11R1.17 CCCNc1ccccc1F b26d422a9020f42016e9a773ea4da59b [0,1,1,0,0,0|2,0,0]=4 285 B11R1.17 CCCNc1ccccc1I 9667c1f0fcc826e8e0c3d31e03051206 [0,1,1,0,0,0|2,0,0]=4 286 B11R1.17 CCCOc1ccccc1C 6c1a4dc1e6028f3da6f849553f219900 [0,1,1,0,0,0|2,0,0]=4 287 B11R1.17 CCCOc1ccccc1Cl 4721246108b2629d9b8b29c6ad627685 [0,1,1,0,0,0|2,0,0]=4 288 B11R1.17 CCCOc1ccccc1F e002653ab86def653a9f4f2e92420612 [0,1,1,0,0,0|2,0,0]=4 289 B11R1.17 CCCOc1ccccc1I 2ec532f87a4a1971649b297302a06402 [0,1,1,0,0,0|2,0,0]=4 290 B11R1.17 CCCOc1ccccc1S a0d26031bd542d5d05da52b2adf5a399 [0,1,1,0,0,0|2,0,0]=4 291 B11R1.17 CCNCc1ccccc1Br 8f6bd2781373b66afc29396cae666f02 [0,1,1,0,0,0|2,0,0]=4 292 B11R1.17 CCNCc1ccccc1C 284345fa1eb882542c433fcb95919ca4 [0,1,1,0,0,0|2,0,0]=4 293 B11R1.17 CCNCc1ccccc1Cl db65b4e8d8ccf115e617990e552ab4c8 [0,1,1,0,0,0|2,0,0]=4 294 B11R1.17 CCNCc1ccccc1F 9048c9b0864184d75154ea96f3fe50b8 [0,1,1,0,0,0|2,0,0]=4 295 B11R1.17 CCNCc1ccccc1I d0f5abf080424e879ba8e6dfea920ca7 [0,1,1,0,0,0|2,0,0]=4 296 B11R1.17 CCOCc1ccccc1C 939ca93b69bfa487d1d8ecb62c2d84e3 [0,1,1,0,0,0|2,0,0]=4 297 B11R1.17 CCOCc1ccccc1Cl e7556758f6c778f3c386ca652094b5cc [0,1,1,0,0,0|2,0,0]=4 298 B11R1.17 CCOCc1ccccc1F 5a297cb41f57dfedbabc975eceaf6126 [0,1,1,0,0,0|2,0,0]=4 299 B11R1.17 CCOCc1ccccc1I 7a255f979ee626f845777c39e07b9738 [0,1,1,0,0,0|2,0,0]=4 300 B11R1.17 Cc1ccccc1CNCF 15e4bda543c50e3e0f080863eb75d61e [0,1,1,0,0,0|2,0,0]=4 301 B11R1.17 Cc1ccccc1CNCO f33352c0e02ea4b4ea9a0720598f200e [0,1,1,0,0,0|2,0,0]=4 302 B11R1.17 Cc1ccccc1COCF 26a9ff4e1acee4455bed5578adee3d1b [0,1,1,0,0,0|2,0,0]=4 303 B11R1.17 Cc1ccccc1NCCBr 1a7be6e12078aed98559b61c844bde43 [0,1,1,0,0,0|2,0,0]=4 304 B11R1.17 Cc1ccccc1NCCF 0e5d4c97f9157c508297bd93ae8f5371 [0,1,1,0,0,0|2,0,0]=4 305 B11R1.17 Cc1ccccc1NCCO 5035e646db6f3a444835335ac8083c14 [0,1,1,0,0,0|2,0,0]=4 306 B11R1.17 Cc1ccccc1NCCS 2a25a74370bfe5d7316ba8388c7b4945 [0,1,1,0,0,0|2,0,0]=4 307 B11R1.17 Cc1ccccc1OCCF f6d7b302f46f820a9e73f4fb8f637bde [0,1,1,0,0,0|2,0,0]=4 308 B11R1.17 Cc1ccccc1OCCS b005873ca988c2b5b3e2488fe6505c14 [0,1,1,0,0,0|2,0,0]=4 309 B11R1.17 FCCNc1ccccc1Cl f556874146c6a72f9a84f0bd26070247 [0,1,1,0,0,0|2,0,0]=4 310 B11R1.17 FCCNc1ccccc1F e2cbe2a439b6bba8166d18f4a8de4742 [0,1,1,0,0,0|2,0,0]=4 311 B11R1.17 FCCNc1ccccc1I 3c8616ee89755bf6f05caef3c69371bd [0,1,1,0,0,0|2,0,0]=4 312 B11R1.17 FCCOc1ccccc1Cl 01c3ab339b3cc97f239d998f0df99ac6 [0,1,1,0,0,0|2,0,0]=4 313 B11R1.17 FCCOc1ccccc1F 89d9f7646bebd63d142c637ad96d7af6 [0,1,1,0,0,0|2,0,0]=4 314 B11R1.17 FCCOc1ccccc1I e68149bbe7bd740697745ed331d108ad [0,1,1,0,0,0|2,0,0]=4 315 B11R1.17 FCNCc1ccccc1Br dc60c3e5196679a6ad7a9fd07289336a [0,1,1,0,0,0|2,0,0]=4 316 B11R1.17 FCNCc1ccccc1Cl b2a7e5b738ab7ee1b7f97a02c137519e [0,1,1,0,0,0|2,0,0]=4 317 B11R1.17 FCNCc1ccccc1F c6a27c7f8e1ab840ee4f8b21e6ebec91 [0,1,1,0,0,0|2,0,0]=4 318 B11R1.17 FCNCc1ccccc1I 072ca4290b9a717a2a3ef28ccf6dc79f [0,1,1,0,0,0|2,0,0]=4 319 B11R1.17 FCOCc1ccccc1Br 1e405168174e3e5a39762fd8efcb0e02 [0,1,1,0,0,0|2,0,0]=4 320 B11R1.17 FCOCc1ccccc1Cl 1bf9ea1561018dfe59c2c98ef1a6a3e2 [0,1,1,0,0,0|2,0,0]=4 321 B11R1.17 FCOCc1ccccc1F 3daad749644938528762801a7655c80c [0,1,1,0,0,0|2,0,0]=4 322 B11R1.17 FCOCc1ccccc1I 31f2d72b4794f19953f85fef60c6eb00 [0,1,1,0,0,0|2,0,0]=4 323 B11R1.17 FCOCc1ccccc1S ccd959bb9897533e9284e6c6e657b910 [0,1,1,0,0,0|2,0,0]=4 324 B11R1.17 Fc1ccccc1NCCS 4e9be5faedc4f5d0920a07998748916a [0,1,1,0,0,0|2,0,0]=4 325 B11R1.17 Fc1ccccc1OCCS b5b3c652dc21fd01fc4857235680bf44 [0,1,1,0,0,0|2,0,0]=4 326 B11R1.17 OCCNc1ccccc1Cl 7e00c321a95d99f226af9355a5b8fd97 [0,1,1,0,0,0|2,0,0]=4 327 B11R1.17 OCCNc1ccccc1F 4c6208b79575fb1b4efb9bc595ec7419 [0,1,1,0,0,0|2,0,0]=4 328 B11R1.17 OCCNc1ccccc1I 7422a69e1fe9722f423454637884bff2 [0,1,1,0,0,0|2,0,0]=4 329 B11R1.17 OCCNc1ccccc1S 987e6c2de89f4ccfc6bc2df488fb2f56 [0,1,1,0,0,0|2,0,0]=4 330 B11R1.17 OCNCc1ccccc1Br 0209dca586483b54ccb56f7ccd9012ce [0,1,1,0,0,0|2,0,0]=4 331 B11R1.17 OCNCc1ccccc1Cl 5475d2d62064a77dd3e8f040ca795a73 [0,1,1,0,0,0|2,0,0]=4 332 B11R1.17 OCNCc1ccccc1F a78f02dd794e5b9637da439e4010cc0a [0,1,1,0,0,0|2,0,0]=4 333 B11R1.17 OCNCc1ccccc1I 6ad26aea5b9fc20136e87fd70971bc76 [0,1,1,0,0,0|2,0,0]=4 334 B11R1.17 SCCNc1ccccc1Cl 8eb275d5fd7aa75f04843d2c9b15e888 [0,1,1,0,0,0|2,0,0]=4 335 B11R1.17 SCCNc1ccccc1I 7aa64189a44cf315624ec283017501ec [0,1,1,0,0,0|2,0,0]=4 336 B11R1.17 SCCNc1ccccc1S 7f3f9d44512381b1f5e117db6c186831 [0,1,1,0,0,0|2,0,0]=4 337 B11R1.17 SCCOc1ccccc1Br 2c9be4111e88e1cef97e0afbaa43f88c [0,1,1,0,0,0|2,0,0]=4 338 B11R1.17 SCCOc1ccccc1Cl 3c48aa6ff52eb58ee2e3c87740c748bd [0,1,1,0,0,0|2,0,0]=4 339 B11R1.17 SCCOc1ccccc1I 5f761222ba044a2385a944adcc40619f [0,1,1,0,0,0|2,0,0]=4 340 B11R1.17 SCCOc1ccccc1S 761c20209c9eb8a0b566991b5c1ab081 [0,1,1,0,0,0|2,0,0]=4 341 B11R1.24 CCCNc1cccc(c1)Br acb1f2bb5e7b1b5520f3f6cb5aa22aaf [0,1,1,0,0,0|2,0,0]=4 342 B11R1.24 CCCNc1cccc(c1)C e421761759f1c746a8f404b8a3a2f9e1 [0,1,1,0,0,0|2,0,0]=4 343 B11R1.24 CCCNc1cccc(c1)Cl 5f3ddf9c366c2329c81257ae31beedbd [0,1,1,0,0,0|2,0,0]=4 344 B11R1.24 CCCNc1cccc(c1)F ea1b244e71e5a96c27eaf1a47c4045c2 [0,1,1,0,0,0|2,0,0]=4 345 B11R1.24 CCCNc1cccc(c1)I 25b73dbb892b7f389897d5a43a220453 [0,1,1,0,0,0|2,0,0]=4 346 B11R1.24 CCCNc1cccc(c1)S 225c14a2af7bde79a1ce2cf37e4d273b [0,1,1,0,0,0|2,0,0]=4 347 B11R1.24 CCCOc1cccc(c1)Br a13e2d3b97569660f2094ead5808f8a1 [0,1,1,0,0,0|2,0,0]=4 348 B11R1.24 CCCOc1cccc(c1)C d7061e70aaece534ca2df7008d458f1f [0,1,1,0,0,0|2,0,0]=4 349 B11R1.24 CCCOc1cccc(c1)Cl dd576836e51eec77f1708e34dc442061 [0,1,1,0,0,0|2,0,0]=4 350 B11R1.24 CCCOc1cccc(c1)F cef2c69d3852855819ee350cb218d7bc [0,1,1,0,0,0|2,0,0]=4 351 B11R1.24 CCCOc1cccc(c1)I 5e7b3431fe9595b36463e1f6c0c6091a [0,1,1,0,0,0|2,0,0]=4 352 B11R1.24 CCCOc1cccc(c1)S 9cc4d5ce9f1a372f0235b118438f64df [0,1,1,0,0,0|2,0,0]=4 353 B11R1.24 CCNCc1cccc(c1)Br 7cc097aea1efe8376684166a5d7a74a3 [0,1,1,0,0,0|2,0,0]=4 354 B11R1.24 CCNCc1cccc(c1)C 8711965bd65b9b9cae0b5574aaf9df19 [0,1,1,0,0,0|2,0,0]=4 355 B11R1.24 CCNCc1cccc(c1)Cl 35f4a4fcd3415e84e248be1142a75e6e [0,1,1,0,0,0|2,0,0]=4 356 B11R1.24 CCNCc1cccc(c1)F a045945dd7664750cd4517426a30ddec [0,1,1,0,0,0|2,0,0]=4 357 B11R1.24 CCNCc1cccc(c1)I a0250fe998532bc25a8c10c3d959951b [0,1,1,0,0,0|2,0,0]=4 358 B11R1.24 CCOCc1cccc(c1)Br 68ab38873ddd37fd78370dbba526e703 [0,1,1,0,0,0|2,0,0]=4 359 B11R1.24 CCOCc1cccc(c1)C a074366dc5260a76a26e1b3a17ce68f7 [0,1,1,0,0,0|2,0,0]=4 360 B11R1.24 CCOCc1cccc(c1)Cl 8933445146c771b808a03b867c201e1e [0,1,1,0,0,0|2,0,0]=4 361 B11R1.24 CCOCc1cccc(c1)F 01b8eda252200f38637020bb494cc211 [0,1,1,0,0,0|2,0,0]=4 362 B11R1.24 CCOCc1cccc(c1)I ee21a715b45c835bc7170e7ff62f202c [0,1,1,0,0,0|2,0,0]=4 363 B11R1.24 Cc1cccc(c1)CNCF 26331ce248fc61a15345fc123ac841ae [0,1,1,0,0,0|2,0,0]=4 364 B11R1.24 Cc1cccc(c1)CNCO d0a6ec7f4afcd99e7d28be3d4dacede0 [0,1,1,0,0,0|2,0,0]=4 365 B11R1.24 Cc1cccc(c1)COCF 11267dea5d808124a105735821eaa460 [0,1,1,0,0,0|2,0,0]=4 366 B11R1.24 Cc1cccc(c1)NCCBr b97f20affb757b68290bd66ce1b22b5b [0,1,1,0,0,0|2,0,0]=4 367 B11R1.24 Cc1cccc(c1)NCCF f4aa25c81ffda72c7e085e967a29bd7e [0,1,1,0,0,0|2,0,0]=4 368 B11R1.24 Cc1cccc(c1)NCCI 1dd161cd96cff309cd4fab79d94b8f2a [0,1,1,0,0,0|2,0,0]=4 369 B11R1.24 Cc1cccc(c1)NCCO 788520a7b5122ba23efd60ec7af11b62 [0,1,1,0,0,0|2,0,0]=4 370 B11R1.24 Cc1cccc(c1)NCCS 7b98a9c950cebe1dd8819c5a884e6fc9 [0,1,1,0,0,0|2,0,0]=4 371 B11R1.24 Cc1cccc(c1)OCCF a1c1a8f8d1b8dd943777980aef0cd973 [0,1,1,0,0,0|2,0,0]=4 372 B11R1.24 Cc1cccc(c1)OCCS c6d124754d0867f0c038fb362a7e43c1 [0,1,1,0,0,0|2,0,0]=4 373 B11R1.24 FCCNc1cccc(c1)Br a0d0349e1b2d40b05cc1bfe14bd197ca [0,1,1,0,0,0|2,0,0]=4 374 B11R1.24 FCCNc1cccc(c1)Cl 9349b62cb412641ee884eb579a3f9bdb [0,1,1,0,0,0|2,0,0]=4 375 B11R1.24 FCCNc1cccc(c1)F c96c058abaf24744205bd606ad9daa10 [0,1,1,0,0,0|2,0,0]=4 376 B11R1.24 FCCNc1cccc(c1)I 504a4adcecca797bc0ba40fa19488c7d [0,1,1,0,0,0|2,0,0]=4 377 B11R1.24 FCCNc1cccc(c1)S aece59adaa14c81c1f80f1dd56827823 [0,1,1,0,0,0|2,0,0]=4 378 B11R1.24 FCCOc1cccc(c1)Br dc7f08a58233cf92115127accf5a3b35 [0,1,1,0,0,0|2,0,0]=4 379 B11R1.24 FCCOc1cccc(c1)Cl c66ffbbe922aa739c018d5aa4816af47 [0,1,1,0,0,0|2,0,0]=4 380 B11R1.24 FCCOc1cccc(c1)F ce9f0d6a6eed787c7ba2b20b9d6cd5cc [0,1,1,0,0,0|2,0,0]=4 381 B11R1.24 FCCOc1cccc(c1)I 96f9406b79ce29e6a0cb635643af7fc7 [0,1,1,0,0,0|2,0,0]=4 382 B11R1.24 FCCOc1cccc(c1)S 5e27e494d241022e1e68313fade9dc4b [0,1,1,0,0,0|2,0,0]=4 383 B11R1.24 FCNCc1cccc(c1)Br 7d04e2339b42e8f2d0122b4fdbb3009d [0,1,1,0,0,0|2,0,0]=4 384 B11R1.24 FCNCc1cccc(c1)Cl e145b682fefd1d3baa7ebff04addc07b [0,1,1,0,0,0|2,0,0]=4 385 B11R1.24 FCNCc1cccc(c1)F 6e9400ce8cf9ff79d0c0062ec100268a [0,1,1,0,0,0|2,0,0]=4 386 B11R1.24 FCNCc1cccc(c1)I 3974009fe99bec9ffdffbaebd85438b2 [0,1,1,0,0,0|2,0,0]=4 387 B11R1.24 FCOCc1cccc(c1)Br 06fd5492a825faa19dd2b0a6ce53ff70 [0,1,1,0,0,0|2,0,0]=4 388 B11R1.24 FCOCc1cccc(c1)Cl bc6f623318574bc18fb6d005c3b19654 [0,1,1,0,0,0|2,0,0]=4 389 B11R1.24 FCOCc1cccc(c1)F 54b20c54954574867369722c4db6da9a [0,1,1,0,0,0|2,0,0]=4 390 B11R1.24 FCOCc1cccc(c1)I 20971ddf8a9eb4748299b05e02229bbd [0,1,1,0,0,0|2,0,0]=4 391 B11R1.24 Fc1cccc(c1)NCCI 8a6f044d8ed2ec996c87b3f7662b5d9e [0,1,1,0,0,0|2,0,0]=4 392 B11R1.24 Fc1cccc(c1)NCCS 111e99f9a18e94deed9c071f45698da5 [0,1,1,0,0,0|2,0,0]=4 393 B11R1.24 Fc1cccc(c1)OCCS 6a888b3fc77bfaa56db9101dd1183ce5 [0,1,1,0,0,0|2,0,0]=4 394 B11R1.24 OCCNc1cccc(c1)Br 72567362870bfac93c93e7b10c66dbef [0,1,1,0,0,0|2,0,0]=4 395 B11R1.24 OCCNc1cccc(c1)Cl e17e7e92e4c4d52ba070bc2481182aec [0,1,1,0,0,0|2,0,0]=4 396 B11R1.24 OCCNc1cccc(c1)F efdd551ee0f00745ebb911089af2cb0e [0,1,1,0,0,0|2,0,0]=4 397 B11R1.24 OCCNc1cccc(c1)I f3c298b6e86d76fb00282800b71da201 [0,1,1,0,0,0|2,0,0]=4 398 B11R1.24 OCCNc1cccc(c1)S bc3a43ad2a55514906329a47347a3147 [0,1,1,0,0,0|2,0,0]=4 399 B11R1.24 OCNCc1cccc(c1)Br 9ae94d6fc4c7aac28899119fef51b5ec [0,1,1,0,0,0|2,0,0]=4 400 B11R1.24 OCNCc1cccc(c1)Cl 713c7b0184423731a15a73fa223201b6 [0,1,1,0,0,0|2,0,0]=4 401 B11R1.24 OCNCc1cccc(c1)F a12edc0401d7c1be2d7abc20d4ca38fc [0,1,1,0,0,0|2,0,0]=4 402 B11R1.24 OCNCc1cccc(c1)I f7370a634a3488ab18a27f63d6247824 [0,1,1,0,0,0|2,0,0]=4 403 B11R1.24 Oc1cccc(c1)NCCS 90fb0bece5f4ef3440fd1c51e48f120a [0,1,1,0,0,0|2,0,0]=4 404 B11R1.24 SCCNc1cccc(c1)Br cbcc30b1e277f7e40eb9e326ae777bb5 [0,1,1,0,0,0|2,0,0]=4 405 B11R1.24 SCCNc1cccc(c1)Cl 2f57001a83ec8d5ce3c44dce9353a13f [0,1,1,0,0,0|2,0,0]=4 406 B11R1.24 SCCNc1cccc(c1)I f5616d4701847e6288fc4af92fec75a5 [0,1,1,0,0,0|2,0,0]=4 407 B11R1.24 SCCNc1cccc(c1)S 0e0fd34954253302d73110367a83e4a4 [0,1,1,0,0,0|2,0,0]=4 408 B11R1.24 SCCOc1cccc(c1)Br e29f1287cdedf4ced05629d8ec3308ee [0,1,1,0,0,0|2,0,0]=4 409 B11R1.24 SCCOc1cccc(c1)Cl c6106fdfdfada56aa5873825021fa0eb [0,1,1,0,0,0|2,0,0]=4 410 B11R1.24 SCCOc1cccc(c1)I fe2c18f3e6909e773b949d048cdd6619 [0,1,1,0,0,0|2,0,0]=4 411 B11R1.24 SCCOc1cccc(c1)S 9191721e00952c64cadf2154be9938a1 [0,1,1,0,0,0|2,0,0]=4 412 B11R1.28 BrCCNCc1ccccc1 ac057fc43e8d6ea85181427003cd8239 [0,1,1,0,0,0|1,0,0]=3 413 B11R1.28 BrCCNCc1ccccn1 90bb93ff46fc49bde9265b45b65f9d87 [0,1,1,0,0,0|2,0,0]=4 414 B11R1.28 BrCCNCc1cccnc1 a9888ba9b6c914af5c547c17a572df8f [0,1,1,0,0,0|2,0,0]=4 415 B11R1.28 C#CCCNc1ccccc1 a50e6468b9593b4ac45e12d5e3b3638a [0,1,1,0,0,0|1,0,1]=4 416 B11R1.28 C#CCNCc1ccccc1 5ab7d08152aaaf12430a9163e509ecd1 [0,1,1,0,0,0|1,0,1]=4 417 B11R1.28 C#CCOCc1ccccc1 4aff10236737b564a9b29132113db7f4 [0,1,1,0,0,0|1,0,1]=4 418 B11R1.28 C=CCCNc1ccccc1 41e5ae44107c117783190eb282a3dc50 [0,1,1,0,0,0|1,0,1]=4 419 B11R1.28 C=CCNCc1ccccc1 c3088ea78b0f7fe35bdb5a0a79f4eb2a [0,1,1,0,0,0|1,0,1]=4 420 B11R1.28 C=CCOCc1ccccc1 38f1b42f9627b73302287ed7d9c08f3f [0,1,1,0,0,0|1,0,1]=4 421 B11R1.28 CCCCNc1ccccc1 178647391839dfbe95aed182d7dc43ba [0,1,1,0,0,0|1,0,0]=3 422 B11R1.28 CCCCNc1ccccn1 91c5e93b79177d6bf2e79f08485f5335 [0,1,1,0,0,0|2,0,0]=4 423 B11R1.28 CCCCNc1cccnc1 b72453a6fd2f6ec63a951a849bd6d4ab [0,1,1,0,0,0|2,0,0]=4 424 B11R1.28 CCCCNc1ccncc1 24fb8abdae77c89030f13cd0949f55ff [0,1,1,0,0,0|2,0,0]=4 425 B11R1.28 CCCCOc1ccccn1 6484ab4f70c598bfd74c056129d64bfe [0,1,1,0,0,0|2,0,0]=4 426 B11R1.28 CCCCOc1cccnc1 5afbbe8f7376fe71bb9dd4caf03cbd91 [0,1,1,0,0,0|2,0,0]=4 427 B11R1.28 CCCCOc1ccncc1 fc01d35869db11789e0b4af0f1677b1b [0,1,1,0,0,0|2,0,0]=4 428 B11R1.28 CCCNCc1ccccc1 6e74fa6187fccbc3617e9cc264b3e7aa [0,1,1,0,0,0|1,0,0]=3 429 B11R1.28 CCCNCc1ccccn1 80119cb7f5f54b354b4e2a1110975477 [0,1,1,0,0,0|2,0,0]=4 430 B11R1.28 CCCNCc1cccnc1 bc1eb1c5ec13776685acded27d44c636 [0,1,1,0,0,0|2,0,0]=4 431 B11R1.28 CCCNCc1ccncc1 a4e33f26d038f90cea08a211a6327f1b [0,1,1,0,0,0|2,0,0]=4 432 B11R1.28 CCCOCc1ccccc1 112c1e14e862b8fbffa225764759b8ec [0,1,1,0,0,0|1,0,0]=3 433 B11R1.28 CCCOCc1ccccn1 a2de9c7a7551b2ca6641b10a888e1203 [0,1,1,0,0,0|2,0,0]=4 434 B11R1.28 CCCOCc1cccnc1 02843d33c5a54d2140670eb60a4dfb7b [0,1,1,0,0,0|2,0,0]=4 435 B11R1.28 CCCOCc1ccncc1 56ee45f2e5ce25d41ded46b7cfbb89b5 [0,1,1,0,0,0|2,0,0]=4 436 B11R1.28 CCNCCc1ccccc1 a4bcdd097e726e04ab2794cdb42f5f71 [0,1,1,0,0,0|1,0,0]=3 437 B11R1.28 CCNCCc1ccccn1 08ffb64a8c703d8e611cb4b81d73ea48 [0,1,1,0,0,0|2,0,0]=4 438 B11R1.28 CCNCCc1cccnc1 4a3a0c73e4e732e57ab84a312bb6bfb2 [0,1,1,0,0,0|2,0,0]=4 439 B11R1.28 CCNCCc1ccncc1 8e4e115f84a67e767e5e9ff1560cacbe [0,1,1,0,0,0|2,0,0]=4 440 B11R1.28 CCOCCc1ccccc1 4c8fc52cc53157c0b0cd10959d18f86a [0,1,1,0,0,0|1,0,0]=3 441 B11R1.28 CCOCCc1ccccn1 0d3553a98e2eb283c6e354f56bb7c09d [0,1,1,0,0,0|2,0,0]=4 442 B11R1.28 CCOCCc1cccnc1 fde9743ce24696d5aa5aa82dfaaaf4a7 [0,1,1,0,0,0|2,0,0]=4 443 B11R1.28 CCOCCc1ccncc1 630579b198392670c66e884689fb17ef [0,1,1,0,0,0|2,0,0]=4 444 B11R1.28 CCOCNc1ccccc1 00b4118c5fbc36d206f093517b5cafbb [0,1,1,0,0,0|2,0,0]=4 445 B11R1.28 COCCNc1ccccc1 5ef0d3255ad59be77d905fd9c0e71e6d [0,1,1,0,0,0|2,0,0]=4 446 B11R1.28 COCNCc1ccccc1 658bb4bb78d053244c07843f6f02f062 [0,1,1,0,0,0|2,0,0]=4 447 B11R1.28 COCOCc1ccccc1 33758b3ae4df68a136cb96076fbeb2ee [0,1,1,0,0,0|2,0,0]=4 448 B11R1.28 CSCCNc1ccccc1 f8eb965b60d0615781c928cdcd30bc15 [0,1,1,0,0,0|2,0,0]=4 449 B11R1.28 CSCNCc1ccccc1 5b3aef5f0ecdedc4b2903ec980e5dc72 [0,1,1,0,0,0|2,0,0]=4 450 B11R1.28 CSCOCc1ccccc1 5941de554d8996d7d45b8f8eee2daf73 [0,1,1,0,0,0|2,0,0]=4 451 B11R1.28 ClCCCNc1ccccc1 b7f587f82b83ca90917a5139ff536b22 [0,1,1,0,0,0|1,0,0]=3 452 B11R1.28 ClCCCNc1ccccn1 8bdf4144e9a2a7a9c2cc08aafaf861f1 [0,1,1,0,0,0|2,0,0]=4 453 B11R1.28 ClCCCNc1cccnc1 46d49c887f9c8f9ac001059b66aa76f9 [0,1,1,0,0,0|2,0,0]=4 454 B11R1.28 ClCCCNc1ccncc1 970fb2252914a50a867c4051715341da [0,1,1,0,0,0|2,0,0]=4 455 B11R1.28 FCCCNc1ccccc1 b3f41abfb84c10f658d04a58ad820f46 [0,1,1,0,0,0|1,0,0]=3 456 B11R1.28 FCCCNc1ccccn1 565f4368802921f33e165ca06a4e0884 [0,1,1,0,0,0|2,0,0]=4 457 B11R1.28 FCCCNc1cccnc1 bf0c678c727f753f2416107c8fb7c2aa [0,1,1,0,0,0|2,0,0]=4 458 B11R1.28 FCCCNc1ccncc1 6a3cdf6587efe4480e7c908186350ce5 [0,1,1,0,0,0|2,0,0]=4 459 B11R1.28 FCCCOc1ccccn1 cbed731556df3029ce519d57f9054d0b [0,1,1,0,0,0|2,0,0]=4 460 B11R1.28 FCCCOc1cccnc1 c358cc6076a85c51e04e470481f11a56 [0,1,1,0,0,0|2,0,0]=4 461 B11R1.28 FCCCOc1ccncc1 df30532896d176c22270c75c82382b5e [0,1,1,0,0,0|2,0,0]=4 462 B11R1.28 FCCNCc1ccccc1 562ef8707f4288c2162274968d966312 [0,1,1,0,0,0|1,0,0]=3 463 B11R1.28 FCCNCc1ccccn1 4b02ff9e4d9d7623f6691b060ab82228 [0,1,1,0,0,0|2,0,0]=4 464 B11R1.28 FCCNCc1cccnc1 baa596bf0364075f3290f4a60a205b9b [0,1,1,0,0,0|2,0,0]=4 465 B11R1.28 FCCNCc1ccncc1 50b686a8fc08fd5effeaeb333b2ed93d [0,1,1,0,0,0|2,0,0]=4 466 B11R1.28 FCCOCc1ccccc1 d9b83bdc5263ec616987dc5988d5ee5b [0,1,1,0,0,0|1,0,0]=3 467 B11R1.28 FCCOCc1ccccn1 eeb2239e9027d0ce3a24146b5979566a [0,1,1,0,0,0|2,0,0]=4 468 B11R1.28 FCCOCc1cccnc1 e02a816ea65f063a58402293132849f2 [0,1,1,0,0,0|2,0,0]=4 469 B11R1.28 FCCOCc1ccncc1 14445d664118b43034c3d85510da7389 [0,1,1,0,0,0|2,0,0]=4 470 B11R1.28 FCNCCc1ccccc1 0081f6dcce701ffe77378524f92f490b [0,1,1,0,0,0|1,0,0]=3 471 B11R1.28 FCNCCc1ccccn1 e15d9eaa28b96f67f0199ee7ab918bb8 [0,1,1,0,0,0|2,0,0]=4 472 B11R1.28 FCNCCc1cccnc1 ca44ff0aa2770a7476d8fe29ab7de27f [0,1,1,0,0,0|2,0,0]=4 473 B11R1.28 FCNCCc1ccncc1 534789a7dc9aa58bac25bdd251ebaa53 [0,1,1,0,0,0|2,0,0]=4 474 B11R1.28 FCOCCc1ccccc1 f68582be9a805c98452f747e5a13d902 [0,1,1,0,0,0|1,0,0]=3 475 B11R1.28 FCOCCc1ccccn1 a87eac3bbe6c96cceb2ad793702bad9f [0,1,1,0,0,0|2,0,0]=4 476 B11R1.28 FCOCCc1cccnc1 95fb7ccc93ac5365251261a770f3e438 [0,1,1,0,0,0|2,0,0]=4 477 B11R1.28 FCOCCc1ccncc1 6e5a2cb5c96fa3a2dd4f846c43af9a9a [0,1,1,0,0,0|2,0,0]=4 478 B11R1.28 ICCNCc1ccccc1 697ca1617b546014ae02b06ad2981d8a [0,1,1,0,0,0|1,0,0]=3 479 B11R1.28 ICCNCc1ccccn1 33a419599dd52be8486dfb89562c6ffa [0,1,1,0,0,0|2,0,0]=4 480 B11R1.28 ICCNCc1cccnc1 7ed4e3e46a4c12f8a4c531489f3ab39c [0,1,1,0,0,0|2,0,0]=4 481 B11R1.28 N#CCCNc1ccccc1 11cc2433e70294ae10477f88fd0e31d0 [0,1,1,0,0,0|0,0,2]=4 482 B11R1.28 N#CCNCc1ccccc1 f23a3b4a1088925db39a0117b8e4d4c1 [0,1,1,0,0,0|0,0,2]=4 483 B11R1.28 N#CCOCc1ccccc1 c6fb0c0fa9f97c70e5fbc997cccd1b4f [0,1,1,0,0,0|0,0,2]=4 484 B11R1.28 N#CNCCc1ccccc1 cc0f6fa18b1c1eb0550ef90401294e13 [0,1,1,0,0,0|0,0,2]=4 485 B11R1.28 NOCCNc1ccccc1 6c5b7062e9d75a57daf03317347aff96 [0,1,1,0,0,0|1,0,0]=3 486 B11R1.28 NOCCNc1ccccn1 e682b49988380a8ee2db570ecbf6f017 [0,1,1,0,0,0|2,0,0]=4 487 B11R1.28 NOCCNc1cccnc1 5721f45685d149370a94b93edd914a85 [0,1,1,0,0,0|2,0,0]=4 488 B11R1.28 NOCCNc1ccncc1 dbc7f0b0ff4b2266b3814bdc52c6fe58 [0,1,1,0,0,0|2,0,0]=4 489 B11R1.28 O=CCCNc1ccccc1 5adfd28b693cf17e4441c0e8b873a1f0 [0,1,1,0,0,0|1,0,1]=4 490 B11R1.28 O=CCNCc1ccccc1 2b4b8121ff6ad050b40b87d13d8f5a1a [0,1,1,0,0,0|1,0,1]=4 491 B11R1.28 O=CCOCc1ccccc1 7bd4c1ac5902422e7c3cafad9115c4f2 [0,1,1,0,0,0|1,0,1]=4 492 B11R1.28 O=CNCCc1ccccc1 d1fab3f35b45ae0bc45cf7bf9f19384c [0,1,1,0,0,0|1,0,1]=4 493 B11R1.28 OCCCNc1ccccc1 6f65c15387fc952c20110ea29ef53956 [0,1,1,0,0,0|1,0,0]=3 494 B11R1.28 OCCCNc1ccccn1 587693fe3960ae4ed00c51618661aeab [0,1,1,0,0,0|2,0,0]=4 495 B11R1.28 OCCCNc1cccnc1 90b07b63ba2da4339e6031d93f7df208 [0,1,1,0,0,0|2,0,0]=4 496 B11R1.28 OCCCNc1ccncc1 7676a46d9ab85382fda372d12f0ec436 [0,1,1,0,0,0|2,0,0]=4 497 B11R1.28 OCCNCc1ccccc1 6075728aab81556d5096d2980e4afa2d [0,1,1,0,0,0|1,0,0]=3 498 B11R1.28 OCCNCc1ccccn1 aee8d8851b64ae441b47dd7c19255c9b [0,1,1,0,0,0|2,0,0]=4 499 B11R1.28 OCCNCc1cccnc1 882a81680203d781920d7144e525a6cd [0,1,1,0,0,0|2,0,0]=4 500 B11R1.28 OCCNCc1ccncc1 9ecc8a72acff6784c82756ff768b065d [0,1,1,0,0,0|2,0,0]=4 501 B11R1.28 OCNCCc1ccccc1 dba1af705064b03a49f56a10af922b9a [0,1,1,0,0,0|1,0,0]=3 502 B11R1.28 OCNCCc1ccccn1 870a6b93d6f817d2b7b76ee4a753e49e [0,1,1,0,0,0|2,0,0]=4 503 B11R1.28 OCNCCc1cccnc1 5a238842d821729331c809bafe95118a [0,1,1,0,0,0|2,0,0]=4 504 B11R1.28 OCNCCc1ccncc1 d4fdef2a16a1c89c93b39a7d349558eb [0,1,1,0,0,0|2,0,0]=4 505 B11R1.28 SCCCNc1ccccc1 0ed9842b503e3cd70fca4624b001f5d8 [0,1,1,0,0,0|1,0,0]=3 506 B11R1.28 SCCCNc1ccccn1 6e9255137fb1e7130c483b51e209e603 [0,1,1,0,0,0|2,0,0]=4 507 B11R1.28 SCCCNc1cccnc1 9d7b88e69ec7c6b34ca7771b6e0b91e4 [0,1,1,0,0,0|2,0,0]=4 508 B11R1.28 SCCCNc1ccncc1 ca21b760b7ec316b64d15f3538d2549c [0,1,1,0,0,0|2,0,0]=4 509 B11R1.28 SCCCOc1ccccn1 a6c411fcae0c9e021a422469b3fdfe87 [0,1,1,0,0,0|2,0,0]=4 510 B11R1.28 SCCCOc1cccnc1 134743f8f7a869616fe16d61afd2d0e6 [0,1,1,0,0,0|2,0,0]=4 511 B11R1.28 SCCCOc1ccncc1 e86746acf63686675a8e18fe26221a62 [0,1,1,0,0,0|2,0,0]=4 512 B11R1.28 SCCNCc1ccccc1 842b711568e585283783756ca8279842 [0,1,1,0,0,0|1,0,0]=3 513 B11R1.28 SCCNCc1ccccn1 ace948b27200a431fbd41a7ba53deb87 [0,1,1,0,0,0|2,0,0]=4 514 B11R1.28 SCCNCc1cccnc1 8ab6cc5726329dc3b917c71b0e8e3a12 [0,1,1,0,0,0|2,0,0]=4 515 B11R1.28 SCCNCc1ccncc1 3b6ef2e293d7e6f2b9cd175d9cbecd46 [0,1,1,0,0,0|2,0,0]=4 516 B11R1.28 SCCOCc1ccccc1 ef1d3bfcf77b316513e3e84b7d85c143 [0,1,1,0,0,0|1,0,0]=3 517 B11R1.28 SCCOCc1ccccn1 922bd68bb819886f081031e9f73951e2 [0,1,1,0,0,0|2,0,0]=4 518 B11R1.28 SCCOCc1cccnc1 c1c52e309e8814a28fb8d713bda79484 [0,1,1,0,0,0|2,0,0]=4 519 B11R1.28 SCCOCc1ccncc1 5a71ae8d634b1ad8f983b65a8abfb1e3 [0,1,1,0,0,0|2,0,0]=4 520 B11R1.40 CC(CO)Nc1ccccc1 28944821b2a2502f940043c73e5bee97 [0,1,1,0,0,0|2,0,0]=4 521 B11R1.40 CCC(C)Nc1ccccc1 0d73dedeab1dd8f5149c3124f0b802dc [0,1,1,0,0,0|2,0,0]=4 522 B11R1.40 CCN(C)Cc1ccccc1 c214a7b7c23665abe56278baaf98348b [0,1,1,0,0,0|2,0,0]=4 523 B11R1.40 CC[C@@H](C)Nc1ccccc1 405a065880ecff40d5c3aba49f23a60f [0,1,1,0,0,0|2,0,0]=4 524 B11R1.40 CC[C@H](C)Nc1ccccc1 bdf0fca4eb541010d4b75cf2b0618571 [0,1,1,0,0,0|2,0,0]=4 525 B11R1.40 CN(CF)Cc1ccccc1 5e57d186c6f316353ffa6c809cb61d75 [0,1,1,0,0,0|2,0,0]=4 526 B11R1.40 CN(CO)Cc1ccccc1 c1d08d2d2c7de731954ebcb428d333e2 [0,1,1,0,0,0|2,0,0]=4 527 B11R1.40 C[C@@H](CO)Nc1ccccc1 d1a979ebd31c8c47073ae387eaa9c5f8 [0,1,1,0,0,0|2,0,0]=4 528 B11R1.40 C[C@H](CO)Nc1ccccc1 b7592eed2c2b10dda06f47547223c567 [0,1,1,0,0,0|2,0,0]=4 529 B11R1.91 CC(C)CNc1ccccc1 408d8a64ab70f9eca096d81d546b6049 [0,1,1,0,0,0|2,0,0]=4 530 B11R1.91 CC(C)NCc1ccccc1 60272e3c9303882f29d21331dcab1491 [0,1,1,0,0,0|2,0,0]=4 531 B11R1.91 CC(C)OCc1ccccc1 7aa508df1117d05227b589ad5630d192 [0,1,1,0,0,0|2,0,0]=4 532 B11R1.91 CC(O)CNc1ccccc1 bad1b8ce4c3d0d43f36328d30e7f1e89 [0,1,1,0,0,0|2,0,0]=4 533 B11R1.91 C[C@@H](O)CNc1ccccc1 3364bd989574177eabc4c47575206f02 [0,1,1,0,0,0|2,0,0]=4 534 B11R1.91 C[C@H](O)CNc1ccccc1 72a253baaf381f6699a10e01b0f0ab34 [0,1,1,0,0,0|2,0,0]=4 535 B11R1.91 FC(F)CNc1ccccc1 84c83ea792636e350c2a00840c340dda [0,1,1,0,0,0|2,0,0]=4 536 B11R1.91 NC(=O)CNc1ccccc1 cb8f4e233e85228cf5430aee72130ae8 [0,1,1,0,0,0|1,0,1]=4 537 B11R1.20 CC(C)Nc1ccc(cc1)Br e5f70783ec71726153c102e5801f7c8a [0,1,1,0,0,0|2,0,0]=4 538 B11R1.20 CC(C)Nc1ccc(cc1)Cl b33a847c825901d9dbcf3f8815c5869c [0,1,1,0,0,0|2,0,0]=4 539 B11R1.20 CC(C)Nc1ccc(cc1)F 689ddbde83a9a9429aa2388668fed19a [0,1,1,0,0,0|2,0,0]=4 540 B11R1.20 CC(C)Nc1ccc(cc1)I fa67ab606e8380aaae6be79fda5faf68 [0,1,1,0,0,0|2,0,0]=4 541 B11R1.20 CC(C)Nc1ccc(cc1)S e681327c1f8eccf785cd674735bc98be [0,1,1,0,0,0|2,0,0]=4 542 B11R1.20 CC(C)Oc1ccc(cc1)Br c830042d81f1762ab02a381b9eac79a4 [0,1,1,0,0,0|2,0,0]=4 543 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7f20d83f4f9b33a7fd797ee07caaf887 [0,1,1,0,0,0|2,0,0]=4 544 B11R1.20 CC(C)Oc1ccc(cc1)F 4b3257094d99fffc8c1b5f1ead656595 [0,1,1,0,0,0|2,0,0]=4 545 B11R1.20 CC(C)Oc1ccc(cc1)I d09c2b32d485e0c585ea84ecec015274 [0,1,1,0,0,0|2,0,0]=4 546 B11R1.20 CC(C)Oc1ccc(cc1)S bc2b7db7696d219aecddb9042131dcc3 [0,1,1,0,0,0|2,0,0]=4 547 B11R1.20 Cc1ccc(cc1)NC(C)C bd77af8bd7263855741bad7d9283a59e [0,1,1,0,0,0|2,0,0]=4 548 B11R1.20 Cc1ccc(cc1)OC(C)C afaa4b057d8f12ac5846fcc0accc69e4 [0,1,1,0,0,0|2,0,0]=4 549 B11R1.86 CC(C)Nc1ccccc1I 3eed1e6c2f407ecc428748af6151fed6 [0,1,1,0,0,0|2,0,0]=4 550 B11R1.86 CC(C)Oc1ccccc1Cl c23b66f89632f42c5d307b4af3111d42 [0,1,1,0,0,0|2,0,0]=4 551 B11R1.86 CC(C)Oc1ccccc1F 883d2c1cc9d854cb85fa804d83d6f507 [0,1,1,0,0,0|2,0,0]=4 552 B11R1.86 CC(C)Oc1ccccc1I 5b38c2c613687166fa94711069ce6a86 [0,1,1,0,0,0|2,0,0]=4 553 B11R1.86 CC(C)Oc1ccccc1S 75d24c98473e29b4fc09eb15793f8071 [0,1,1,0,0,0|2,0,0]=4 554 B11R1.86 Cc1ccccc1OC(C)C e336697c807367b5d2038eeb2d20cb38 [0,1,1,0,0,0|2,0,0]=4 555 B11R1.157 CC(C)Nc1cccc(c1)Br c1a310149209bebd05d401b8d9453768 [0,1,1,0,0,0|2,0,0]=4 556 B11R1.157 CC(C)Nc1cccc(c1)Cl 88b649511dda4c3138b09b24b4cdf85e [0,1,1,0,0,0|2,0,0]=4 557 B11R1.157 CC(C)Nc1cccc(c1)F 2469bb14dda7a11ffa1e171e9579afdb [0,1,1,0,0,0|2,0,0]=4 558 B11R1.157 CC(C)Nc1cccc(c1)I 28c8d38bd4c860795c7f6ab5b08202d3 [0,1,1,0,0,0|2,0,0]=4 559 B11R1.157 CC(C)Nc1cccc(c1)S 4d5403275c38f6ee6364ab78831bae52 [0,1,1,0,0,0|2,0,0]=4 560 B11R1.157 CC(C)Oc1cccc(c1)Br 03d6e4f39dc83644234524de153060f8 [0,1,1,0,0,0|2,0,0]=4 561 B11R1.157 CC(C)Oc1cccc(c1)Cl b05958621a80ad10943fb41bda6c4ff4 [0,1,1,0,0,0|2,0,0]=4 562 B11R1.157 CC(C)Oc1cccc(c1)F cc5136a263bfb966a933f5c182f882fd [0,1,1,0,0,0|2,0,0]=4 563 B11R1.157 CC(C)Oc1cccc(c1)I eecf4227dddae0c4ffe51c7d1a2196a6 [0,1,1,0,0,0|2,0,0]=4 564 B11R1.157 CC(C)Oc1cccc(c1)S c0ecc340d31d590be5ee243f9c89bfa6 [0,1,1,0,0,0|2,0,0]=4 565 B11R1.157 Cc1cccc(c1)NC(C)C 6995924353e7f43790a327361636dd3c [0,1,1,0,0,0|2,0,0]=4 566 B11R1.157 Cc1cccc(c1)OC(C)C 768a0b78053567f181c821d541878835 [0,1,1,0,0,0|2,0,0]=4 567 B11R1.509 CC(C)(C)Nc1ccccc1 820b34717c3d9476c22fcc3db6fccee9 [0,1,1,0,0,0|2,0,0]=4 568 B11R1.283 C=C/C=C/C(=O)NC1CC1C 03e281bceb0c0e566d3bc825536554f2 [0,1,1,0,0,0|2,0,0]=4 569 B11R1.283 C=C/C=C/C(=O)N[C@@H]1C[C@H]1F dcab89b59843909e4fd4d07c81355b40 [0,1,1,0,0,0|2,0,0]=4 570 B11R1.283 C=C/C=C/C(=O)N[C@H]1C[C@@H]1F 178d54b2f684948684fd0964e3dead4e [0,1,1,0,0,0|2,0,0]=4 571 B11R1.283 C=C/C=C/C(=O)N[C@H]1C[C@H]1F 6bc13f2d65318f6651728c7a881c98ac [0,1,1,0,0,0|2,0,0]=4 572 B11R1.283 C=C/C=C\C(=O)NC1CC1C a7a0a69ef58e898a0c1a5405502b62ab [0,1,1,0,0,0|2,0,0]=4 573 B11R1.283 C=C/C=C\C(=O)N[C@@H]1C[C@H]1F dfe855ff479f08594ae3e9d4a2ddf9c7 [0,1,1,0,0,0|2,0,0]=4 574 B11R1.283 C=C/C=C\C(=O)N[C@H]1C[C@@H]1F ef67b561ec8bbc362a41478e78fc8fd7 [0,1,1,0,0,0|2,0,0]=4 575 B11R1.283 C=C/C=C\C(=O)N[C@H]1C[C@H]1F 93618012d0bae4fe7258eb66c22e674b [0,1,1,0,0,0|2,0,0]=4 576 B11R1.283 C=CC=CC(=O)NC1CC1C 718d7b6455d432ccb09f854529129d60 [0,1,1,0,0,0|2,0,0]=4 577 B11R1.283 C=CC=CC(=O)N[C@@H]1C[C@H]1F bfd5c673277a8e223472f62477872c40 [0,1,1,0,0,0|2,0,0]=4 578 B11R1.283 C=CC=CC(=O)N[C@H]1C[C@@H]1F bd6fcb3e9ae2073cc9610d853d068ab5 [0,1,1,0,0,0|2,0,0]=4 579 B11R1.283 C=CC=CC(=O)N[C@H]1C[C@H]1F c38ba575a16131fc41a0c5788c9f6e5c [0,1,1,0,0,0|2,0,0]=4 580 B13R2.50 CCN1C[C@@H]1Cc2ccccc2 72eee314b16c58dc582e3e6a580d139e [0,1,0,0,0,1|2,0,0]=4 581 B13R2.50 CO[C@H]1C[C@H]1Nc2ccccc2 c907af03b24a61b55e237c5a004024cc [0,1,0,0,0,1|1,0,0]=3 582 B13R2.50 CO[C@H]1C[C@H]1Nc2cccnc2 547f9d4d68b0826efa95c856b5cccdf8 [0,1,0,0,0,1|2,0,0]=4 583 B13R2.50 CO[C@H]1C[C@H]1Nc2ccncc2 6b739a97ce0ade5163d8a064c3e135cb [0,1,0,0,0,1|2,0,0]=4 584 B13R2.50 FCN1C[C@@H]1Cc2ccccc2 2fe655d2e6a0d0b8abc537a648ad2309 [0,1,0,0,0,1|2,0,0]=4 585 B13R2.50 O=CC1CC1Nc2ccccc2 5edb64d99c77ee695f9b3ae79ba42ae1 [0,1,0,0,0,1|1,0,0]=3 586 B13R2.50 O=CC1CC1Nc2ccccn2 68ba8c6f18647ea890d86a06b572790a [0,1,0,0,0,1|2,0,0]=4 587 B13R2.50 O=CC1CC1Nc2cccnc2 44e75d781e065491facbff44af64bb88 [0,1,0,0,0,1|2,0,0]=4 588 B13R2.50 O=CC1CC1Nc2ccncc2 5a43c3bf43ac548019043fba0fc51494 [0,1,0,0,0,1|2,0,0]=4 589 B13R2.50 O=CC1CC1Oc2ccccn2 f2670eb94eb746da220e8bd834933275 [0,1,0,0,0,1|2,0,0]=4 590 B13R2.50 O=CC1CC1Oc2cccnc2 0c86dcee567df338fa42b3a4441e7ee8 [0,1,0,0,0,1|2,0,0]=4 591 B13R2.50 O=CC1CC1Oc2ccncc2 8929bb305481603802156e0b950dec42 [0,1,0,0,0,1|2,0,0]=4 592 B13R2.50 O=CN1C[C@@H]1Cc2ccccc2 5a3201b1a4fc78f9585897c7bc378194 [0,1,0,0,0,1|2,0,0]=4 593 B13R2.50 OCN1C[C@@H]1Cc2ccccc2 23c338218cf740a486abdd836934ba8d [0,1,0,0,0,1|2,0,0]=4 594 B13R2.50 OC[C@@H]1C[C@@H]1Nc2ccccc2 b25fe7a9e0e6df82ab17af5b293ded33 [0,1,0,0,0,1|1,0,0]=3 595 B13R2.50 OC[C@@H]1C[C@@H]1Nc2cccnc2 9819ed6ca6e9bc0f0e3f0e205cbe573a [0,1,0,0,0,1|2,0,0]=4 596 B13R2.50 OC[C@@H]1C[C@H]1Nc2ccccc2 7ada4cf4faab81f6024b1c8d048f713e [0,1,0,0,0,1|1,0,0]=3 597 B13R2.50 OC[C@@H]1C[C@H]1Nc2cccnc2 cb64ea04dcac2500f94e1ac8cbe21cf4 [0,1,0,0,0,1|2,0,0]=4 598 B13R2.50 OC[C@H]1C[C@@H]1Nc2ccccc2 45bcb86784bb39a18fadb0ac9283526b [0,1,0,0,0,1|1,0,0]=3 599 B13R2.50 OC[C@H]1C[C@@H]1Nc2cccnc2 b88d1d9c923c6bb7f250f8052dac4041 [0,1,0,0,0,1|2,0,0]=4 600 B13R2.153 CC1CC1Nc2ccc[n+](c2)[O-] 089263a1f8f5130887eb28e2150c896c [0,1,0,0,0,1|2,0,0]=4 601 B13R2.153 CC1CC1Nc2ccnc(c2)F e09b255c5d7fb97683bae06c2ad2767e [0,1,0,0,0,1|2,0,0]=4 602 B13R2.153 Cc1cccc(c1)NC2CC2C 6bea79ef13b6742280e4618a3c4c8e7a [0,1,0,0,0,1|1,0,0]=3 603 B13R2.153 Cc1cccc(c1)N[C@@H]2C[C@H]2F 508b6a473fd76b17a312abc3fbbd8b46 [0,1,0,0,0,1|1,0,0]=3 604 B13R2.153 Cc1cccc(c1)N[C@H]2C[C@@H]2F 78cc73ce9c9f42747c7f89b307b3c942 [0,1,0,0,0,1|1,0,0]=3 605 B13R2.153 Cc1cccc(c1)N[C@H]2C[C@H]2F d12bf0d7ed9a856c09c8762f4031eff2 [0,1,0,0,0,1|1,0,0]=3 606 B13R2.153 Fc1cc(ccn1)N[C@@H]2C[C@H]2F 98c47bd2985b9526dac5deb4a56ff0c2 [0,1,0,0,0,1|2,0,0]=4 607 B13R2.153 Fc1cc(ccn1)N[C@H]2C[C@@H]2F 12f7373f06fc36ffe7da9093ed905c6e [0,1,0,0,0,1|2,0,0]=4 608 B13R2.153 Fc1cc(ccn1)N[C@H]2C[C@H]2F bf81f81756f8a92c8bc39bb3c5778144 [0,1,0,0,0,1|2,0,0]=4 609 B13R2.153 Fc1cccc(c1)N[C@@H]2C[C@H]2F 9074905361c56aefe642529c0a9c6748 [0,1,0,0,0,1|1,0,0]=3 610 B13R2.153 Fc1cccc(c1)N[C@H]2C[C@@H]2F f631a58618c5a86766ef7371e59d765b [0,1,0,0,0,1|1,0,0]=3 611 B13R2.153 Fc1cccc(c1)N[C@H]2C[C@H]2F 1cdaf02bafcbb548820dc09e6a4d0789 [0,1,0,0,0,1|1,0,0]=3 612 B13R2.153 Fc1cncc(c1)N[C@@H]2C[C@H]2F ef75e76fc9f5ee50a24d795769e08fdb [0,1,0,0,0,1|2,0,0]=4 613 B13R2.153 Fc1cncc(c1)N[C@H]2C[C@@H]2F b4cefcbe133f7f8f71d324f860eecb23 [0,1,0,0,0,1|2,0,0]=4 614 B13R2.153 Fc1cncc(c1)N[C@H]2C[C@H]2F 78bc9f94e07d9823acf2b8002447cd3b [0,1,0,0,0,1|2,0,0]=4 615 B13R2.153 Oc1cccc(c1)N[C@@H]2C[C@H]2F 81ce029692511ef58e6c318377ee9f8d [0,1,0,0,0,1|1,0,0]=3 616 B13R2.153 Oc1cccc(c1)N[C@H]2C[C@@H]2F 03f9f8112b5a599b676697815f5b6617 [0,1,0,0,0,1|1,0,0]=3 617 B13R2.153 Oc1cccc(c1)N[C@H]2C[C@H]2F 44f7edecdb0148badfc0cc26828c8a82 [0,1,0,0,0,1|1,0,0]=3 618 B13R2.153 [O-][n+]1cccc(c1)N[C@@H]2C[C@H]2F 3922e5df5633d985bf814cd014194010 [0,1,0,0,0,1|2,0,0]=4 619 B13R2.153 [O-][n+]1cccc(c1)N[C@H]2C[C@@H]2F add4f9dc21fad1d0475ef140c3039c5f [0,1,0,0,0,1|2,0,0]=4 620 B13R2.153 [O-][n+]1cccc(c1)N[C@H]2C[C@H]2F dfff8f3e05b25d6407c2d722afc29a7a [0,1,0,0,0,1|2,0,0]=4 621 B13R2.187 CC1(CC1Nc2ccccc2)C 93e5b134d0f7db927f308848af5dc163 [0,1,0,0,0,1|1,0,0]=3 622 B13R2.187 CC1(CC1Nc2ccccn2)C d675a0665f97c2e697d6b55050fa6656 [0,1,0,0,0,1|2,0,0]=4 623 B13R2.187 CC1(CC1Nc2cccnc2)C ff49427f74100050425a897ca07b9470 [0,1,0,0,0,1|2,0,0]=4 624 B13R2.187 CC1(CC1Nc2ccncc2)C fdd7570e6b4d356e29f27138edf69c31 [0,1,0,0,0,1|2,0,0]=4 625 B13R2.187 CC1(CC1Oc2ccccn2)C 0f155b42ef173d269762e3658c2eb5d3 [0,1,0,0,0,1|2,0,0]=4 626 B13R2.187 CC1(CC1Oc2cccnc2)C 55b51860623379e3d993c191e375510a [0,1,0,0,0,1|2,0,0]=4 627 B13R2.187 CC1(CC1Oc2ccncc2)C 4e8bf299c9272829116d4ac78fc725ce [0,1,0,0,0,1|2,0,0]=4 628 B13R2.187 CC1(CN1Cc2ccccc2)C 809486764f942be742a7f44bea5d4c20 [0,1,0,0,0,1|2,0,0]=4 629 B13R2.187 CC1(C[C@@H]1Nc2ccccc2)C e4d47fb69ec4679d7af8da26d624bf0d [0,1,0,0,0,1|1,0,0]=3 630 B13R2.187 CC1(C[C@@H]1Nc2cccnc2)C 227730bf26bece2e762326832ff9c811 [0,1,0,0,0,1|2,0,0]=4 631 B13R2.187 CC1(C[C@H]1Nc2ccccc2)C e70944f25f328cba8b838d11767a7492 [0,1,0,0,0,1|1,0,0]=3 632 B13R2.187 CC1(C[C@H]1Nc2cccnc2)C 8c4baad5fa068138bff939ff89fe13cb [0,1,0,0,0,1|2,0,0]=4 633 B13R2.187 FC1(CC1Nc2ccccc2)F c00989354b57583589b34cf138bf5f9d [0,1,0,0,0,1|1,0,0]=3 634 B13R2.187 FC1(CC1Nc2ccccn2)F 9cc183fd759b37d7d1781bb48de199d1 [0,1,0,0,0,1|2,0,0]=4 635 B13R2.187 FC1(CC1Nc2cccnc2)F 8b1f4d1eb0d18e4d29756b8d17818ec2 [0,1,0,0,0,1|2,0,0]=4 636 B13R2.187 FC1(CC1Nc2ccncc2)F b4a325ff023bdd8eab3595de1b7763ac [0,1,0,0,0,1|2,0,0]=4 637 B13R2.187 FC1(CC1Oc2ccccn2)F 9e805c6ad1822b38e85090e5210c2c4f [0,1,0,0,0,1|2,0,0]=4 638 B13R2.187 FC1(CC1Oc2cccnc2)F 6e64bd2216f7c1c44d35f367bfd845b5 [0,1,0,0,0,1|2,0,0]=4 639 B13R2.187 FC1(CC1Oc2ccncc2)F 66ea6da185450e4841e00ad05ba0b018 [0,1,0,0,0,1|2,0,0]=4 640 B13R2.377 CC1CC1Nc2c[nH]ccc2=O c2b1031301b1925c3ab9c82f0817dc2b [0,1,0,0,0,1|2,0,0]=4 641 B13R2.377 CC1CC1Nc2ccc[nH]c2=O 1dd4152f1e030f514bf296719e6da4c5 [0,1,0,0,0,1|2,0,0]=4 642 B13R2.377 CC1CC1Nc2cccc[n+]2[O-] 291284cbcce01531f5a3fc284fac57c2 [0,1,0,0,0,1|2,0,0]=4 643 B13R2.377 CC1CC1Nc2ccccc2F 73fe8236b6c238cddff5b223a645ea98 [0,1,0,0,0,1|1,0,0]=3 644 B13R2.377 CC1CC1Nc2cccnc2S f01b0819013301f1fddb6e898cbf3a35 [0,1,0,0,0,1|2,0,0]=4 645 B13R2.377 CC1CC1Nc2cnccc2F 454dc66f73b5d2fba2483b95300c6218 [0,1,0,0,0,1|2,0,0]=4 646 B13R2.377 Cc1ccccc1NC2CC2C 09d878ade43953c226f1d280cce62851 [0,1,0,0,0,1|1,0,0]=3 647 B13R2.377 Cc1cccnc1N[C@@H]2C[C@H]2F 8324aaa4cbed528384592692e330069f [0,1,0,0,0,1|2,0,0]=4 648 B13R2.377 Cc1cccnc1N[C@H]2C[C@@H]2F c19d1d1bdb41f8bc4ed7a23555d03dfa [0,1,0,0,0,1|2,0,0]=4 649 B13R2.377 Cc1cccnc1N[C@H]2C[C@H]2F 44b7d217a7575cb610b2aa4795669987 [0,1,0,0,0,1|2,0,0]=4 650 B13R2.377 Cc1ccncc1NC2CC2C cd8eece59935fbf693591a2cf878f249 [0,1,0,0,0,1|2,0,0]=4 651 B13R2.377 Cc1ccncc1N[C@@H]2C[C@H]2F 4e4819cbf708824b7f3c3b0219524afd [0,1,0,0,0,1|2,0,0]=4 652 B13R2.377 Cc1ccncc1N[C@H]2C[C@@H]2F c9370c3967eedf604778b1da83a862bc [0,1,0,0,0,1|2,0,0]=4 653 B13R2.377 Cc1ccncc1N[C@H]2C[C@H]2F a1cc42629fce6db67996a55ea78140aa [0,1,0,0,0,1|2,0,0]=4 654 B13R2.377 F[C@@H]1C[C@@H]1Nc2cccnc2S 8a7e3934278908e185704510e9b6b6bb [0,1,0,0,0,1|2,0,0]=4 655 B13R2.377 F[C@@H]1C[C@H]1Nc2cccnc2S 5183997ae3e05e9d94e34c3333a8236a [0,1,0,0,0,1|2,0,0]=4 656 B13R2.377 F[C@H]1C[C@@H]1Nc2cccnc2S 6947e096721d4babae31f0a9e716990b [0,1,0,0,0,1|2,0,0]=4 657 B13R2.377 Fc1ccccc1N[C@@H]2C[C@H]2F dd36e2af7bfe324ce4076ec67a9216c3 [0,1,0,0,0,1|1,0,0]=3 658 B13R2.377 Fc1ccccc1N[C@H]2C[C@@H]2F ad1ebb4797e0891eeb6a4a1dc1bdafc0 [0,1,0,0,0,1|1,0,0]=3 659 B13R2.377 Fc1ccccc1N[C@H]2C[C@H]2F fde174b694e8f342d2787d8ec2ef1a5e [0,1,0,0,0,1|1,0,0]=3 660 B13R2.377 Fc1ccncc1N[C@@H]2C[C@H]2F a75ebffb2cc5dffa8f03547cbd9597fe [0,1,0,0,0,1|2,0,0]=4 661 B13R2.377 Fc1ccncc1N[C@H]2C[C@@H]2F 13152b2a4f6fafa489fb7fb4f8405477 [0,1,0,0,0,1|2,0,0]=4 662 B13R2.377 Fc1ccncc1N[C@H]2C[C@H]2F cb023a055f334ebca95afceb10e2478c [0,1,0,0,0,1|2,0,0]=4 663 B13R2.377 O=c1[nH]cccc1N[C@@H]2C[C@H]2F daff107b9bb162322310a8b1cfe8d4b0 [0,1,0,0,0,1|2,0,0]=4 664 B13R2.377 O=c1[nH]cccc1N[C@H]2C[C@@H]2F ca4c1727b813f70e8ccb27613c429c4b [0,1,0,0,0,1|2,0,0]=4 665 B13R2.377 O=c1[nH]cccc1N[C@H]2C[C@H]2F 0c516e911dc82165317b788750d875c4 [0,1,0,0,0,1|2,0,0]=4 666 B13R2.377 O=c1cc[nH]cc1N[C@@H]2C[C@H]2F 2b6bed0b2d79a7ec0c6edae896b75fa2 [0,1,0,0,0,1|2,0,0]=4 667 B13R2.377 O=c1cc[nH]cc1N[C@H]2C[C@@H]2F 6568d1a82cd6b0e64bb53f9d8b46bcf5 [0,1,0,0,0,1|2,0,0]=4 668 B13R2.377 O=c1cc[nH]cc1N[C@H]2C[C@H]2F c4489c21f84ba7d89a901f9cdb4d99b8 [0,1,0,0,0,1|2,0,0]=4 669 B13R2.377 [O-][n+]1ccccc1N[C@@H]2C[C@H]2F 8beedc58f1b1b40e3fa724cf8e731344 [0,1,0,0,0,1|2,0,0]=4 670 B13R2.377 [O-][n+]1ccccc1N[C@H]2C[C@@H]2F e669827ad7cbe97ca314ca2b9357489e [0,1,0,0,0,1|2,0,0]=4 671 B13R2.377 [O-][n+]1ccccc1N[C@H]2C[C@H]2F e43d108b50d054eb685c9670b77f3c60 [0,1,0,0,0,1|2,0,0]=4 672 B13R2.525 CC1CC1Nc2ccc(cc2)S 7a17d2e48c75aeb35f0bf11ac5361263 [0,1,0,0,0,1|1,0,0]=3 673 B13R2.525 F[C@@H]1C[C@@H]1Nc2ccc(cc2)S 886d0f061bc5c4662932abd04d60b102 [0,1,0,0,0,1|1,0,0]=3 674 B13R2.525 F[C@@H]1C[C@H]1Nc2ccc(cc2)S e0a4745def0a9476219989c759933099 [0,1,0,0,0,1|1,0,0]=3 675 B13R2.525 F[C@H]1C[C@@H]1Nc2ccc(cc2)S 823ea18e441a5ba4ccdf4009fef7ddd2 [0,1,0,0,0,1|1,0,0]=3 676 B13R2.52 CCN1CC(C1)c2ccccc2 69d4cc457ae2e1f78728361f56079908 [0,1,0,0,0,1|2,0,0]=4 677 B13R2.52 FCN1CC(C1)c2ccccc2 2f123790cc63657dd270bace14c92804 [0,1,0,0,0,1|2,0,0]=4 678 B13R2.52 O=CN1CC(C1)c2ccccc2 60ae2110ec584e869c28cd5ab53f6793 [0,1,0,0,0,1|2,0,0]=4 679 B13R2.52 OCN1CC(C1)c2ccccc2 5a51a2f1f7462df2c3c0a04f740b1f18 [0,1,0,0,0,1|2,0,0]=4 680 B13R2.56 CCN1CCC1c2ccccc2 fda778d48a622a61b172677bfd132183 [0,1,0,0,0,1|2,0,0]=4 681 B13R2.56 FCN1CCC1c2ccccc2 4ce5ae5906307e3dc3e6487366f62d5e [0,1,0,0,0,1|2,0,0]=4 682 B13R2.56 OCN1CCC1c2ccccc2 6b97806116c5cdb4eb5c9b9a91151abc [0,1,0,0,0,1|2,0,0]=4 683 B13R2.25 C#CCN1CC1c2ccccc2 0348a2c268b591bd7a6dcbe84cade241 [0,2,0,0,0,0|2,0,0]=4 684 B13R2.25 C#CCN1C[C@@H]1c2ccccc2 cd1a08dd2e853215ca741027895d62dc [0,2,0,0,0,0|2,0,0]=4 685 B13R2.25 C=CCN1CC1c2ccccc2 b8d342d7868a7f5aa81bc920eed580e0 [0,2,0,0,0,0|2,0,0]=4 686 B13R2.25 C=CCN1C[C@@H]1c2ccccc2 c8c93ebd4d109dfb32458422550ad79d [0,2,0,0,0,0|2,0,0]=4 687 B13R2.25 CCCN1CC1c2ccccc2 e270c901fde378e5c915d14628fd0592 [0,2,0,0,0,0|2,0,0]=4 688 B13R2.25 CCCN1C[C@@H]1c2ccccc2 9063dd0d8d5190fbb4159a798af783d6 [0,2,0,0,0,0|2,0,0]=4 689 B13R2.25 CCNC1CC1c2ccccc2 d4c0b06f7450b284b9a7403736176252 [0,2,0,0,0,0|0,0,0]=2 690 B13R2.25 CCN[C@@H]1C[C@H]1c2ccccc2 e5e150ca9d8c1f3071b75d9a3112d3e7 [0,2,0,0,0,0|0,0,0]=2 691 B13R2.25 CCN[C@H]1C[C@@H]1c2ccccc2 500dcfaf5beb79adb729e93357fd805b [0,2,0,0,0,0|0,0,0]=2 692 B13R2.25 CCOC1CC1c2ccccc2 27734cfca7e9b5581e39f47784ac1674 [0,2,0,0,0,0|1,0,0]=3 693 B13R2.25 CCO[C@@H]1C[C@H]1c2ccccc2 4bfcc480eb954bc51df37bb5978ec5ba [0,2,0,0,0,0|1,0,0]=3 694 B13R2.25 COCN1CC1c2ccccc2 431f8486aa49cd1c4a953713e2221890 [0,2,0,0,0,0|2,0,0]=4 695 B13R2.25 COCN1C[C@@H]1c2ccccc2 65cecb59e8ef1a2feba2e96da5e7ec6f [0,2,0,0,0,0|2,0,0]=4 696 B13R2.25 CSCN1CC1c2ccccc2 b084f1b742cc0850b8c734d871a597d6 [0,2,0,0,0,0|2,0,0]=4 697 B13R2.25 CSCN1C[C@@H]1c2ccccc2 ccb8bad0149379dcc63e42f28ccb0b75 [0,2,0,0,0,0|2,0,0]=4 698 B13R2.25 FCCN1CC1c2ccccc2 fe6ff9bcb111b1af199eec00ffb7b4da [0,2,0,0,0,0|2,0,0]=4 699 B13R2.25 FCCN1C[C@@H]1c2ccccc2 c90ebf3969a871515e3d752c1cc92941 [0,2,0,0,0,0|2,0,0]=4 700 B13R2.25 FCNC1CC1c2ccccc2 df1f2c956aad9bb6b47647de18089992 [0,2,0,0,0,0|0,0,0]=2 701 B13R2.25 FCN[C@@H]1C[C@H]1c2ccccc2 7e92f870d48663b5f792a27a6901dbf9 [0,2,0,0,0,0|0,0,0]=2 702 B13R2.25 FCN[C@H]1C[C@@H]1c2ccccc2 a2b525eac511a8cd931fcbf8cf861f81 [0,2,0,0,0,0|0,0,0]=2 703 B13R2.25 FCOC1CC1c2ccccc2 df578caa84775d30b7731c342f937f99 [0,2,0,0,0,0|1,0,0]=3 704 B13R2.25 FCO[C@@H]1C[C@H]1c2ccccc2 70b99da946eb8f14a0e24ecf5c3ed6a4 [0,2,0,0,0,0|1,0,0]=3 705 B13R2.25 N#CCN1CC1c2ccccc2 0aa882e3d7683d758adbaeb4607bc56b [0,2,0,0,0,0|1,0,1]=4 706 B13R2.25 N#CCN1C[C@@H]1c2ccccc2 5ecc9d43467a4f87c286a1be42da2895 [0,2,0,0,0,0|1,0,1]=4 707 B13R2.25 O=CCN1CC1c2ccccc2 4d75e8246f8aaed7e75b1192548cb881 [0,2,0,0,0,0|2,0,0]=4 708 B13R2.25 O=CCN1C[C@@H]1c2ccccc2 b6a9e0a35b50d430e0de5c47026806d1 [0,2,0,0,0,0|2,0,0]=4 709 B13R2.25 OCCN1CC1c2ccccc2 a2e55cfd2ae2d5c63a1176b9d5b1bba1 [0,2,0,0,0,0|2,0,0]=4 710 B13R2.25 OCCN1C[C@@H]1c2ccccc2 d0d6379ddd9940df05f315bcccdea522 [0,2,0,0,0,0|2,0,0]=4 711 B13R2.25 OCNC1CC1c2ccccc2 a178b23b256a874c1d88b7e7e9b5abdd [0,2,0,0,0,0|0,0,0]=2 712 B13R2.25 OCN[C@@H]1C[C@H]1c2ccccc2 56311dbbc739aab2ee186949a6f03cb1 [0,2,0,0,0,0|0,0,0]=2 713 B13R2.25 OCN[C@H]1C[C@@H]1c2ccccc2 922d45dbd69ecb4851227d9260c32937 [0,2,0,0,0,0|0,0,0]=2 714 B13R2.25 SCCN1CC1c2ccccc2 23c13de2a7fb3799c14f3d011346fcb5 [0,2,0,0,0,0|2,0,0]=4 715 B13R2.25 SCCN1C[C@@H]1c2ccccc2 87c9805fc8a52a1837a6537c1a2d5403 [0,2,0,0,0,0|2,0,0]=4 716 B13R2.42 CCN1CC1c2ccc(cc2)Cl ec70e786c5cacc20d6c2a69040215b56 [0,2,0,0,0,0|2,0,0]=4 717 B13R2.42 FCN1CC1c2ccc(cc2)Cl b400395159a8127fb9fe49c804c0f1e8 [0,2,0,0,0,0|2,0,0]=4 718 B13R2.42 O=CN1CC1c2ccc(cc2)Cl eef4cff1ed82a7d1223cc5564d5a6585 [0,2,0,0,0,0|2,0,0]=4 719 B13R2.42 OCN1CC1c2ccc(cc2)Cl 2639a0d88addc94d8e83a9e4ee72f854 [0,2,0,0,0,0|2,0,0]=4 720 B13R2.138 CC1C(N1C=O)c2ccccc2 6bb296f9ab876c2e3544e957c36bf4f6 [0,2,0,0,0,0|2,0,0]=4 721 B13R2.138 CC1C(N1CF)c2ccccc2 86dc64f240535a929c47c06c5e02509a [0,2,0,0,0,0|2,0,0]=4 722 B13R2.138 CC1C(N1CO)c2ccccc2 e62854f080361ec64180910a027a8ffd [0,2,0,0,0,0|2,0,0]=4 723 B13R2.138 CCN1C(C1c2ccccc2)C 7347c18968ce51387f036d0fe33e59d8 [0,2,0,0,0,0|2,0,0]=4 724 B13R2.138 CCN1[C@@H]([C@@H]1c2ccccc2)C 722e7bc8d7ea97c003f1ca9ceeeec978 [0,2,0,0,0,0|2,0,0]=4 725 B13R2.138 C[C@@H]1[C@@H](N1C=O)c2ccccc2 891cf643b1f320871fa8e665073b90ac [0,2,0,0,0,0|2,0,0]=4 726 B13R2.138 C[C@@H]1[C@@H](N1CF)c2ccccc2 d1e80bebaa86c5ca16d302aa33f044bf [0,2,0,0,0,0|2,0,0]=4 727 B13R2.138 C[C@@H]1[C@@H](N1CO)c2ccccc2 25d96fee91379e6364e32294ccc4664f [0,2,0,0,0,0|2,0,0]=4 728 B13R2.423 CC(=O)N1CC1c2ccccc2 bdc9a9f283b4c1f3b1a56bf7092820e7 [0,2,0,0,0,0|2,0,0]=4 729 B13R2.423 CC(=O)N1C[C@@H]1c2ccccc2 580257c50481dcd5a619adce6e734789 [0,2,0,0,0,0|2,0,0]=4 730 B13R2.423 CC(C)N1CC1c2ccccc2 18f4891ac6aabb6616be1fee9081b7fc [0,2,0,0,0,0|2,0,0]=4 731 B13R2.423 CC(C)N1C[C@@H]1c2ccccc2 3bf2363aada52a88447fe37132928179 [0,2,0,0,0,0|2,0,0]=4 732 B11R2.238 c1ccc(cc1)NC2CC2 0cca6617983212a2989086e88698db73 [0,0,1,1,0,0|2,0,0]=4 733 B13R2.17 CC1CC1NCc2ccccc2 4cfdb83dc2f71acc5d554cb409a717c1 [0,0,0,0,0,2|1,0,0]=3 734 B13R2.17 CC1CC1NCc2ccccn2 121876e18a2f119328db7859e4087861 [0,0,0,0,0,2|2,0,0]=4 735 B13R2.17 CC1CC1NCc2cccnc2 0e773e8c8aceca3868b86af9296f500e [0,0,0,0,0,2|2,0,0]=4 736 B13R2.17 F[C@@H]1C[C@@H]1NCc2ccccc2 9057fb3773bb37e850e9042278f52f9f [0,0,0,0,0,2|1,0,0]=3 737 B13R2.17 F[C@@H]1C[C@@H]1NCc2ccccn2 2a46537095f0affef1459093ef1ed854 [0,0,0,0,0,2|2,0,0]=4 738 B13R2.17 F[C@@H]1C[C@@H]1NCc2cccnc2 cb6d6849ee7d7329017cef178064cec6 [0,0,0,0,0,2|2,0,0]=4 739 B13R2.17 F[C@@H]1C[C@H]1NCc2ccccc2 a39cd5d5b0b9ea9be80edae1c65369c8 [0,0,0,0,0,2|1,0,0]=3 740 B13R2.17 F[C@@H]1C[C@H]1NCc2ccccn2 2353d23ac98d9dd2788e0836b34f270e [0,0,0,0,0,2|2,0,0]=4 741 B13R2.17 F[C@@H]1C[C@H]1NCc2cccnc2 a40c01cb915e2dca43fe416a4ce2c624 [0,0,0,0,0,2|2,0,0]=4 742 B13R2.17 F[C@H]1C[C@@H]1NCc2ccccc2 9d64da63517ba661c4fcc8089982ed2a [0,0,0,0,0,2|1,0,0]=3 743 B13R2.17 F[C@H]1C[C@@H]1NCc2ccccn2 141df897a4117d1653092f78023d1a94 [0,0,0,0,0,2|2,0,0]=4 744 B13R2.17 F[C@H]1C[C@@H]1NCc2cccnc2 aeea1a25e202a5867292722af564b37d [0,0,0,0,0,2|2,0,0]=4 745 B13R2.27 CC1OCC1Nc2ccccc2 b128ac395a9059b65dba0d9ea3bb54f0 [0,0,0,0,0,2|1,0,0]=3 746 B13R2.27 CC1OCC1Nc2cccnc2 a2815f5d1bde65b1f48c020a9355877b [0,0,0,0,0,2|2,0,0]=4 747 B13R2.27 CC1OCC1Nc2ccncc2 c4d37837bb1c77578b5172106235fccc [0,0,0,0,0,2|2,0,0]=4 748 B13R2.27 C[C@@H]1CC[C@@H]1Nc2ccccc2 684c63eb5cb578cf14151b91d0b0133b [0,0,0,0,0,2|1,0,0]=3 749 B13R2.27 C[C@@H]1CC[C@@H]1Nc2cccnc2 ccb4b0e94de8006b91916ff36babaf8d [0,0,0,0,0,2|2,0,0]=4 750 B13R2.27 C[C@@H]1CC[C@H]1Nc2ccccc2 a6e394c4737b64f13f3ac1a417405627 [0,0,0,0,0,2|1,0,0]=3 751 B13R2.27 C[C@@H]1CC[C@H]1Nc2cccnc2 a7de7e49934474a4772bd165861cb2e5 [0,0,0,0,0,2|2,0,0]=4 752 B13R2.27 FC1CCC1Nc2ccccc2 8228dbbb5f10c6f0996225edf3d6da10 [0,0,0,0,0,2|1,0,0]=3 753 B13R2.27 FC1CCC1Nc2ccccn2 0e5b6c237e032befe465b01c8e5ea3af [0,0,0,0,0,2|2,0,0]=4 754 B13R2.27 FC1CCC1Nc2cccnc2 335307671e651fa4ab8b6c8db0c38d33 [0,0,0,0,0,2|2,0,0]=4 755 B13R2.27 O=C1CCC1Nc2ccccc2 19af677ce18a39a689c42bbc9ddc96eb [0,0,0,0,0,2|1,0,1]=4 756 B13R2.27 O=C1NC[C@@H]1Nc2ccccc2 b1d717f30caacc646efb68d3b058edf1 [0,0,0,0,0,2|1,0,1]=4 757 B13R2.27 OC1CCC1Nc2ccccc2 22ccf36632920e2347d87311840cec60 [0,0,0,0,0,2|1,0,0]=3 758 B13R2.27 OC1CCC1Nc2ccccn2 275af09b7e9d2edd2d30c2a5b4be22de [0,0,0,0,0,2|2,0,0]=4 759 B13R2.27 OC1CCC1Nc2cccnc2 67d194dc39b7a2d96352aba38e4ab411 [0,0,0,0,0,2|2,0,0]=4 760 B13R2.27 O[C@@H]1CC[C@@H]1Nc2ccccc2 24c8c18bf092a8f81f52a0ac3b04502e [0,0,0,0,0,2|1,0,0]=3 761 B13R2.27 O[C@@H]1CC[C@@H]1Nc2ccccn2 b1a3e96f0c60ac131df5aeec9ee3c3aa [0,0,0,0,0,2|2,0,0]=4 762 B13R2.27 O[C@@H]1CC[C@@H]1Nc2cccnc2 fc314e15002919d23e0d2601d5a1549d [0,0,0,0,0,2|2,0,0]=4 763 B13R2.27 O[C@@H]1CC[C@H]1Nc2ccccc2 9e1f3d8791b3f567d82f5ab87fc30aa0 [0,0,0,0,0,2|1,0,0]=3 764 B13R2.27 O[C@@H]1CC[C@H]1Nc2ccccn2 2abc7a25bd7e6c91dcac518aa81b1ba9 [0,0,0,0,0,2|2,0,0]=4 765 B13R2.27 O[C@@H]1CC[C@H]1Nc2cccnc2 41aed7190bb0acfe49ccc80092315b8d [0,0,0,0,0,2|2,0,0]=4 766 B13R2.27 O[C@H]1CC[C@@H]1Nc2ccccc2 1b260cec7536bcd5d480a3538bb0afac [0,0,0,0,0,2|1,0,0]=3 767 B13R2.27 O[C@H]1CC[C@@H]1Nc2ccccn2 4385b1b759b0182c0bc107ed52b000e8 [0,0,0,0,0,2|2,0,0]=4 768 B13R2.27 O[C@H]1CC[C@@H]1Nc2cccnc2 85fb158708ddce3bf5387719f1662170 [0,0,0,0,0,2|2,0,0]=4 769 B13R2.27 O[C@H]1CC[C@H]1Nc2ccccc2 904496f66b00f360c1e9937cd611b9b4 [0,0,0,0,0,2|1,0,0]=3 770 B13R2.27 O[C@H]1CC[C@H]1Nc2ccccn2 1104f332f50fb1372fe1337b016863eb [0,0,0,0,0,2|2,0,0]=4 771 B13R2.27 O[C@H]1CC[C@H]1Nc2cccnc2 411ddf49669d2300916c999e255cdd00 [0,0,0,0,0,2|2,0,0]=4 772 B13R2.31 FC1CC(C1)Nc2ccccc2 0063bbac983356a468d92ce93db46f65 [0,0,0,0,0,2|1,0,0]=3 773 B13R2.31 FC1CC(C1)Nc2cccnc2 b85dd1e2771a97c35237c6eb1988ef7f [0,0,0,0,0,2|2,0,0]=4 774 B13R2.31 FC1CC(C1)Nc2ccncc2 5234f00060bc37773a4b9a068d553834 [0,0,0,0,0,2|2,0,0]=4 775 B13R2.31 FC1CN(C1)Cc2ccccc2 11bcd9d3b1770453c4c550c6eff15e2a [0,0,0,0,0,2|2,0,0]=4 776 B13R2.31 F[C@H]1C[C@@H](C1)Nc2ccccc2 3921582339f7025e25d54e17c3371c3b [0,0,0,0,0,2|1,0,0]=3 777 B13R2.31 F[C@H]1C[C@@H](C1)Nc2cccnc2 375949c9621ca528a692ed272970a9de [0,0,0,0,0,2|2,0,0]=4 778 B13R2.31 F[C@H]1C[C@@H](C1)Nc2ccncc2 d4fe856d8d8c518ed26527e69c54b054 [0,0,0,0,0,2|2,0,0]=4 779 B13R2.31 F[C@H]1C[C@H](C1)Nc2ccccc2 31f90c435e0d11c0b8f04dc213b35f83 [0,0,0,0,0,2|1,0,0]=3 780 B13R2.31 F[C@H]1C[C@H](C1)Nc2cccnc2 52869d3eaf944516d206b3e9e9cf57c9 [0,0,0,0,0,2|2,0,0]=4 781 B13R2.31 F[C@H]1C[C@H](C1)Nc2ccncc2 3d841fc9413ad31c57b61d96af38ce0a [0,0,0,0,0,2|2,0,0]=4 782 B13R2.31 OC1CC(C1)Nc2ccccc2 71a911754938dd37972ada3ece1543ca [0,0,0,0,0,2|1,0,0]=3 783 B13R2.31 OC1CC(C1)Nc2ccccn2 44691850885e2ad0ce72bcfecf24c83d [0,0,0,0,0,2|2,0,0]=4 784 B13R2.31 OC1CC(C1)Nc2cccnc2 5c74d72d14e07d0dc98adf8993221f81 [0,0,0,0,0,2|2,0,0]=4 785 B13R2.31 OC1CC(C1)Nc2ccncc2 81c5de2fc19ebfa91dc90670ec32df85 [0,0,0,0,0,2|2,0,0]=4 786 B13R2.31 OC1CN(C1)Cc2ccccc2 0f2d1ffeab9162a1a1611f924b72d074 [0,0,0,0,0,2|2,0,0]=4 787 B13R2.31 O[C@H]1C[C@@H](C1)Nc2ccccc2 641154e36386b330b5a15763bdae2c55 [0,0,0,0,0,2|1,0,0]=3 788 B13R2.31 O[C@H]1C[C@@H](C1)Nc2ccccn2 d7e00d0b1421f416418d31e93e11fbd4 [0,0,0,0,0,2|2,0,0]=4 789 B13R2.31 O[C@H]1C[C@@H](C1)Nc2cccnc2 c4af757615ba95ceafeb4f63ee78bbce [0,0,0,0,0,2|2,0,0]=4 790 B13R2.31 O[C@H]1C[C@@H](C1)Nc2ccncc2 76b1773f9f9fde213d45e1b38d8c29a2 [0,0,0,0,0,2|2,0,0]=4 791 B13R2.31 O[C@H]1C[C@H](C1)Nc2ccccc2 d2b195e256c89f17ba7eddc9ef42ea1b [0,0,0,0,0,2|1,0,0]=3 792 B13R2.31 O[C@H]1C[C@H](C1)Nc2ccccn2 47811582224b4533acdb77ff4e1924a7 [0,0,0,0,0,2|2,0,0]=4 793 B13R2.31 O[C@H]1C[C@H](C1)Nc2cccnc2 48c58c6e1418953af39efc42a0a77a3f [0,0,0,0,0,2|2,0,0]=4 794 B13R2.31 O[C@H]1C[C@H](C1)Nc2ccncc2 cd175cf568bb2b76283374aba740641b [0,0,0,0,0,2|2,0,0]=4