0 B10R1.17 BrCCNc1ccccc1 08c39138e90dcc3ad4c25fdba0569b67 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.17 C#CCNc1ccccc1 61f0baab40ac49dd5c7bdcf3c0e69fb4 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.17 C=CCNc1ccccc1 47db636c74d7e6cdd4488df2cb146b26 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.17 CCCNc1ccccc1 b539dcf8361adb43cc5ffbb8617222f9 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.17 CCNCc1ccccc1 b1285c6596ffdf0473a3780bf23df272 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.17 CCNCc1ccccn1 18cfef8413e038075fdfe85720c8bb60 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.17 CCNCc1cccnc1 ef83bfb13d2744bc293d6f1d68f67b86 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.17 CCNCc1ccncc1 2e26d8de78e71e06bcd28df387653244 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.17 CCOCc1ccccc1 551a24ad73c54bc42b4e27015fdb411f [0,0,0,0,0,0|3,0,0]=3 9 B10R1.17 CCOCc1ccccn1 0c63694580ac3136b3801886d248907b [0,0,0,0,0,0|4,0,0]=4 10 B10R1.17 CCOCc1cccnc1 5f09f824e7a9d5177841898d80553992 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.17 CCOCc1ccncc1 1d1afe04b02325a5cf955e686c22ba10 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.17 COCNc1ccccc1 6c62c6b48b6ce69fe29d4b52e03d5674 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.17 CSCNc1ccccc1 7a27a5c68b132b0ae36908396631930e [0,0,0,0,0,0|3,0,1]=4 14 B10R1.17 FCCNc1ccccc1 f275d2eb426a2818882d3c7dcacca572 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.17 FCNCc1ccccc1 0dcd541b35f2d813e3bd4529f13aa61b [0,0,0,0,0,0|3,0,0]=3 16 B10R1.17 FCNCc1ccccn1 14327276004818c05fc55a3ce987673c [0,0,0,0,0,0|4,0,0]=4 17 B10R1.17 FCNCc1cccnc1 303a68c3e72902076a5285aac654492a [0,0,0,0,0,0|4,0,0]=4 18 B10R1.17 FCNCc1ccncc1 f86a74e0d1d92929ce958fb624476f4c [0,0,0,0,0,0|4,0,0]=4 19 B10R1.17 FCOCc1ccccc1 602c85a0828834d1798ab6d91c5aa92b [0,0,0,0,0,0|3,0,0]=3 20 B10R1.17 FCOCc1ccccn1 52de5aacdb8cde16edb0cbea31183c40 [0,0,0,0,0,0|4,0,0]=4 21 B10R1.17 FCOCc1cccnc1 d58467b55ec7fcb175961d4ef6210edb [0,0,0,0,0,0|4,0,0]=4 22 B10R1.17 FCOCc1ccncc1 90104d817a6745d762aa8ebc5bd6efa2 [0,0,0,0,0,0|4,0,0]=4 23 B10R1.17 ICCNc1ccccc1 2e8d29f41a7952c3a309dd8ce57744b3 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.17 N#CCNc1ccccc1 fb8b42e8ff84ada914e54c1d3d6bf55b [0,0,0,0,0,0|3,0,1]=4 25 B10R1.17 N#CNCc1ccccc1 a34d70ab939a88101ebb668f17250d10 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.17 N#CNCc1ccccn1 73d970ffa881cb91d14134c59642f4f6 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.17 N#CNCc1cccnc1 b7cd89e5cd4646b42c64988159c94b48 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.17 O=CCNc1ccccc1 c4995b86d7297371e551e9130c388474 [0,0,0,0,0,0|2,0,2]=4 29 B10R1.17 O=CNCc1ccccc1 8c79f42269c527e7ed1741ce8019791f [0,0,0,0,0,0|2,0,1]=3 30 B10R1.17 O=CNCc1ccccn1 2a4bd7c465ac0ab8804867d1eeb7fd18 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.17 O=CNCc1cccnc1 86ebf2990a9293a0c4bc35942f9e4571 [0,0,0,0,0,0|3,0,1]=4 32 B10R1.17 O=CNCc1ccncc1 1f2ebcdeb77286cfab7ddcdf6ac042b2 [0,0,0,0,0,0|3,0,1]=4 33 B10R1.17 OCCNc1ccccc1 39a30f826fab6ed2b66a9ec4a9dddbdb [0,0,0,0,0,0|2,0,1]=3 34 B10R1.17 OCCNc1ccccn1 14d1f9671b0391e7cf5b318b74673aa8 [0,0,0,0,0,0|3,0,1]=4 35 B10R1.17 OCCNc1cccnc1 528072d5adbbf320415662e70c05db36 [0,0,0,0,0,0|3,0,1]=4 36 B10R1.17 OCCNc1ccncc1 2d153fc0224e0960cc8e262d108ccf9f [0,0,0,0,0,0|3,0,1]=4 37 B10R1.17 OCNCc1ccccc1 c4aaeb48f32c090af3c65531a6e27cd4 [0,0,0,0,0,0|2,0,0]=2 38 B10R1.17 OCNCc1ccccn1 9488b9a65408dc593594baac432012ff [0,0,0,0,0,0|3,0,0]=3 39 B10R1.17 OCNCc1cccnc1 86bd6343ace558a3752eaa3d1a554844 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.17 OCNCc1cccnn1 ab22a6b6bf709ff19959feb80ebef395 [0,0,0,0,0,0|4,0,0]=4 41 B10R1.17 OCNCc1ccncc1 31d693e5cbaa1006fa13d8924b3493eb [0,0,0,0,0,0|3,0,0]=3 42 B10R1.17 OCNCc1ccncn1 e1601b835614d257d03e1a317c6e849b [0,0,0,0,0,0|4,0,0]=4 43 B10R1.17 OCNCc1ccnnc1 b085a3150d717e399252729324dde4be [0,0,0,0,0,0|4,0,0]=4 44 B10R1.17 OCNCc1cnccn1 2e97e3c7cc39869beec41193ed233122 [0,0,0,0,0,0|4,0,0]=4 45 B10R1.17 OCNCc1cncnc1 c9fd3f017cac60092425968f0623c6bf [0,0,0,0,0,0|4,0,0]=4 46 B10R1.17 OCNCc1ncccn1 c2a1de97786ff8120b7277138f237b3a [0,0,0,0,0,0|4,0,0]=4 47 B10R1.17 SCCNc1ccccc1 9bbad99372906cf90d9dd5df1e41681f [0,0,0,0,0,0|2,1,1]=4 48 B9R1.8 CCNc1ccccc1 33257e4a9e1d882742dfd4cfddb78cda [1,0,0,0,0,0|2,0,1]=4 49 B9R1.8 FCNc1ccccc1 c8185de2a7206057ede93409452a493c [1,0,0,0,0,0|2,0,1]=4 50 B9R1.8 O=CNc1ccccn1 881aba1a1d89f4a286d5001a309ad574 [1,0,0,0,0,0|2,0,1]=4 51 B9R1.8 O=CNc1cccnc1 355201612949cfa8d6342c6af1c523a5 [1,0,0,0,0,0|2,0,1]=4 52 B9R1.8 O=CNc1ccncc1 e7930a19a74453c18ec50a777f694607 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.8 OCNc1ccccc1 6a26daba1a11b7282126aadb7f7b8f97 [1,0,0,0,0,0|1,0,1]=3 54 B9R1.8 OCNc1ccccn1 d59bc8d9974c705420d0aeed6cce1b06 [1,0,0,0,0,0|2,0,1]=4 55 B9R1.8 OCNc1cccnc1 68add967e09ec2eee2b71061a3bb94f5 [1,0,0,0,0,0|2,0,1]=4 56 B9R1.8 OCNc1ccncc1 25e64b963b18028da179c82ed337c929 [1,0,0,0,0,0|2,0,1]=4 57 B11R1.1 CCNCc1ccc(cc1)Br 2cd51938999c20d02733c25a0b5c4804 [0,1,0,0,0,0|3,0,0]=4 58 B11R1.1 CCNCc1ccc(cc1)C 587aa1ee1f45a7f7f3762adcf6ab1e89 [0,1,0,0,0,0|3,0,0]=4 59 B11R1.1 CCNCc1ccc(cc1)Cl 521dc09ab663236062b599824b274153 [0,1,0,0,0,0|3,0,0]=4 60 B11R1.1 CCNCc1ccc(cc1)F 507a49f5c428a46a95718b00a3fd1bd9 [0,1,0,0,0,0|3,0,0]=4 61 B11R1.1 CCNCc1ccc(cc1)I cb00fc5924e1405950f010ec806d6a94 [0,1,0,0,0,0|3,0,0]=4 62 B11R1.1 CCOCc1ccc(cc1)Br 55e365425e5287f17bedcdf9c6cf8797 [0,1,0,0,0,0|3,0,0]=4 63 B11R1.1 CCOCc1ccc(cc1)C 4d215a4a9529a309b910ed7006942890 [0,1,0,0,0,0|3,0,0]=4 64 B11R1.1 CCOCc1ccc(cc1)Cl 162fb8a5396843344a75f2243153a2a9 [0,1,0,0,0,0|3,0,0]=4 65 B11R1.1 CCOCc1ccc(cc1)F 67e386059816bee45125127b16cfcbee [0,1,0,0,0,0|3,0,0]=4 66 B11R1.1 CCOCc1ccc(cc1)I 25d977d51d9f47d9f153070d57dca8b8 [0,1,0,0,0,0|3,0,0]=4 67 B11R1.1 CCOCc1ccc(cc1)S 51de74da01a41ad35713330690173be6 [0,1,0,0,0,0|3,0,0]=4 68 B11R1.1 Cc1ccc(cc1)CNC#N 71ef650b7559551102b125c1e29d68e5 [0,1,0,0,0,0|3,0,0]=4 69 B11R1.1 Cc1ccc(cc1)CNC=O f28e952319097b22b95735c4699de02f [0,1,0,0,0,0|2,0,1]=4 70 B11R1.1 Cc1ccc(cc1)CNCF 3d235376bf58ba37ce4fc4687e7358b9 [0,1,0,0,0,0|3,0,0]=4 71 B11R1.1 Cc1ccc(cc1)CNCO a64a75f18e5667093ebf917d1b07eefc [0,1,0,0,0,0|2,0,0]=3 72 B11R1.1 Cc1ccc(cc1)COCF be23a3cdf78a8f91f485a087d32e2751 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.1 Cc1ccc(cc1)NCCO c023022501f62f6373bdd984b07a8e61 [0,1,0,0,0,0|2,0,1]=4 74 B11R1.1 Cc1ccc(cn1)CNCO dee3af3568e11618521f283cbcaf609a [0,1,0,0,0,0|3,0,0]=4 75 B11R1.1 Cc1ccc(nc1)CNCO 8b5ed39717274fd8ed92909f510b435c [0,1,0,0,0,0|3,0,0]=4 76 B11R1.1 FCNCc1ccc(cc1)Br b716c1dcd41bf6fd6d535897c1b8ce0c [0,1,0,0,0,0|3,0,0]=4 77 B11R1.1 FCNCc1ccc(cc1)Cl 699409f205c611587d6f375bf5f31fce [0,1,0,0,0,0|3,0,0]=4 78 B11R1.1 FCNCc1ccc(cc1)F 25a744931aeb914e659c9f9632eb93fc [0,1,0,0,0,0|3,0,0]=4 79 B11R1.1 FCNCc1ccc(cc1)I d9e1151471912873877eda8a2b6050e5 [0,1,0,0,0,0|3,0,0]=4 80 B11R1.1 FCOCc1ccc(cc1)Br 5272f40abeb8f9788218e0855efe7f99 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.1 FCOCc1ccc(cc1)Cl a424b465d05ec98f468ea1690dfb41e3 [0,1,0,0,0,0|3,0,0]=4 82 B11R1.1 FCOCc1ccc(cc1)F 40afdc034cb36d38932d0008a2d4420f [0,1,0,0,0,0|3,0,0]=4 83 B11R1.1 FCOCc1ccc(cc1)I 614cbd3d7d1898e18b49cf57a3be3c96 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.1 FCOCc1ccc(cc1)S caeca7060fe6aa9edb0562b9e232c2bd [0,1,0,0,0,0|3,0,0]=4 85 B11R1.1 N#CNCc1ccc(cc1)Br 993e0e7882cdada4212fab51ab99fd4a [0,1,0,0,0,0|3,0,0]=4 86 B11R1.1 N#CNCc1ccc(cc1)Cl 861b33c898d9d0c01d6886a209a9f6fd [0,1,0,0,0,0|3,0,0]=4 87 B11R1.1 N#CNCc1ccc(cc1)F 35391210e85115eb408aff1e93261827 [0,1,0,0,0,0|3,0,0]=4 88 B11R1.1 N#CNCc1ccc(cc1)I df16ce3684587d85b581fd53fe8f98ff [0,1,0,0,0,0|3,0,0]=4 89 B11R1.1 O=CNCc1ccc(cc1)Br 7fdb86c6f5b6081ac41b52a92cf2f5e3 [0,1,0,0,0,0|2,0,1]=4 90 B11R1.1 O=CNCc1ccc(cc1)Cl 8ffb7078771c32a3c5bc07dbadbb86a6 [0,1,0,0,0,0|2,0,1]=4 91 B11R1.1 O=CNCc1ccc(cc1)F 3e4ad2d82aa5aa82d165556940f63f30 [0,1,0,0,0,0|2,0,1]=4 92 B11R1.1 O=CNCc1ccc(cc1)I d9e15a2b5847e4b3042d0429177d8bdb [0,1,0,0,0,0|2,0,1]=4 93 B11R1.1 O=CNCc1ccc(cc1)O b53af60aaa3757bc79f5fc548fffc7cb [0,1,0,0,0,0|2,0,1]=4 94 B11R1.1 O=c1ccc(c[nH]1)CNCO bb83acf187d7f19d584f105f6810294f [0,1,0,0,0,0|3,0,0]=4 95 B11R1.1 OCCNc1ccc(cc1)Br 535465584ac9d4ff57889448ec1b0af0 [0,1,0,0,0,0|2,0,1]=4 96 B11R1.1 OCCNc1ccc(cc1)Cl 4d55580a2576d97655667590feb9394c [0,1,0,0,0,0|2,0,1]=4 97 B11R1.1 OCCNc1ccc(cc1)F f0dccf24099a23c54c8c24ea89525ac0 [0,1,0,0,0,0|2,0,1]=4 98 B11R1.1 OCCNc1ccc(cc1)I 9010f3f5111bb57e7ee5fcc7037cafde [0,1,0,0,0,0|2,0,1]=4 99 B11R1.1 OCCNc1ccc(cc1)S 4de960e6b8963c27bc320732a003972b [0,1,0,0,0,0|2,0,1]=4 100 B11R1.1 OCNCc1ccc(cc1)Br 29941d371c032fabf1b94e49679e2b91 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.1 OCNCc1ccc(cc1)Cl 66d7e1612c59e389035460da5f165c29 [0,1,0,0,0,0|2,0,0]=3 102 B11R1.1 OCNCc1ccc(cc1)F e82a245e5fea20cb06713ef60eb282ff [0,1,0,0,0,0|2,0,0]=3 103 B11R1.1 OCNCc1ccc(cc1)I bba7fc5edf7c0932c8de644faad89e3d [0,1,0,0,0,0|2,0,0]=3 104 B11R1.1 OCNCc1ccc(cn1)Br 7f3d19f9771c479964bba22b4616ef61 [0,1,0,0,0,0|3,0,0]=4 105 B11R1.1 OCNCc1ccc(cn1)Cl ad113e6a1148f2e84481c6ee13c725cd [0,1,0,0,0,0|3,0,0]=4 106 B11R1.1 OCNCc1ccc(cn1)F 2e534136875f673e3baed66e480ece0d [0,1,0,0,0,0|3,0,0]=4 107 B11R1.1 OCNCc1ccc(nc1)Br 6cc1a4aa1eb5f5b5bbe925f3bb7a418b [0,1,0,0,0,0|3,0,0]=4 108 B11R1.1 OCNCc1ccc(nc1)Cl d558b4ed5167005d1f26f4617ff5147d [0,1,0,0,0,0|3,0,0]=4 109 B11R1.1 OCNCc1ccc(nc1)F 5789e6b9ee5afb311be62d111026ef87 [0,1,0,0,0,0|3,0,0]=4 110 B11R1.16 CC(NC=O)c1ccccc1 912f825ae8ec09ad8cb929f90e443d73 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.16 CC(NCO)c1ccccn1 92e2d7a3e5eb4a0cf656a3abd8120ca1 [0,1,0,0,0,0|3,0,0]=4 112 B11R1.16 CC(NCO)c1cccnc1 862c30acc11398ef9d9eed839c208db8 [0,1,0,0,0,0|3,0,0]=4 113 B11R1.16 CC(NCO)c1ccncc1 c1d5cc5db08b36fc1a8cd8b573f9e139 [0,1,0,0,0,0|3,0,0]=4 114 B11R1.16 CC(OCF)c1ccccc1 a5a4510633c1500ac034b294490d7f65 [0,1,0,0,0,0|3,0,0]=4 115 B11R1.16 CCNC(C)c1ccccc1 af03e39d181c5fd668bda5d6f7d06e14 [0,1,0,0,0,0|3,0,0]=4 116 B11R1.16 CCN[C@@H](C)c1ccccc1 994b5b0b50363ecab1efd5b7f9e6d7cd [0,1,0,0,0,0|3,0,0]=4 117 B11R1.16 CCN[C@H](C)c1ccccc1 af432512ad94856da6ef9d44592c3502 [0,1,0,0,0,0|3,0,0]=4 118 B11R1.16 CCOC(C)c1ccccc1 37108e833ff536d25c550cb5b37c873d [0,1,0,0,0,0|3,0,0]=4 119 B11R1.16 CCO[C@@H](C)c1ccccc1 e4f11a13dd3f609e6f25ac3a3b969fe2 [0,1,0,0,0,0|3,0,0]=4 120 B11R1.16 CCO[C@H](C)c1ccccc1 54694971b3853f962e687b61e7c698c1 [0,1,0,0,0,0|3,0,0]=4 121 B11R1.16 CN(CCO)c1ccccc1 4b734b8d391d02ddf47f0308fb1d22c8 [0,1,0,0,0,0|2,0,1]=4 122 B11R1.16 C[C@@H](NC=O)c1ccccc1 ed3cbc790dab943801487e30e3a37c11 [0,1,0,0,0,0|2,0,1]=4 123 B11R1.16 C[C@@H](NCO)c1ccccn1 06a1df171fb3e867c231d94d30fe4c59 [0,1,0,0,0,0|3,0,0]=4 124 B11R1.16 C[C@@H](NCO)c1cccnc1 cf5dbaaa37b8cb4e2f16350a55683027 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.16 C[C@@H](NCO)c1ccncc1 7d10d857a4fd7fe5ca5ccba46504091e [0,1,0,0,0,0|3,0,0]=4 126 B11R1.16 C[C@@H](OCF)c1ccccc1 f6dc1405e5744871891f84657f997fd4 [0,1,0,0,0,0|3,0,0]=4 127 B11R1.16 C[C@H](NC=O)c1ccccc1 0ca5dec48ba28ecff3cefea41bc874f0 [0,1,0,0,0,0|2,0,1]=4 128 B11R1.16 C[C@H](NCO)c1ccccn1 d98746896574333cf45787ddae8ffaa8 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.16 C[C@H](NCO)c1cccnc1 476af247167559627f6aa699dfa54495 [0,1,0,0,0,0|3,0,0]=4 130 B11R1.16 C[C@H](NCO)c1ccncc1 6f6a1ba3773069295a22e913e615ab17 [0,1,0,0,0,0|3,0,0]=4 131 B11R1.16 C[C@H](OCF)c1ccccc1 0bdd092ad3daed19f52c193b52481cfc [0,1,0,0,0,0|3,0,0]=4 132 B11R1.17 CCNCc1ccccc1Br 8f6bd2781373b66afc29396cae666f02 [0,1,0,0,0,0|3,0,0]=4 133 B11R1.17 CCNCc1ccccc1C 284345fa1eb882542c433fcb95919ca4 [0,1,0,0,0,0|3,0,0]=4 134 B11R1.17 CCNCc1ccccc1Cl db65b4e8d8ccf115e617990e552ab4c8 [0,1,0,0,0,0|3,0,0]=4 135 B11R1.17 CCNCc1ccccc1F 9048c9b0864184d75154ea96f3fe50b8 [0,1,0,0,0,0|3,0,0]=4 136 B11R1.17 CCNCc1ccccc1I d0f5abf080424e879ba8e6dfea920ca7 [0,1,0,0,0,0|3,0,0]=4 137 B11R1.17 CCOCc1ccccc1C 939ca93b69bfa487d1d8ecb62c2d84e3 [0,1,0,0,0,0|3,0,0]=4 138 B11R1.17 CCOCc1ccccc1Cl e7556758f6c778f3c386ca652094b5cc [0,1,0,0,0,0|3,0,0]=4 139 B11R1.17 CCOCc1ccccc1F 5a297cb41f57dfedbabc975eceaf6126 [0,1,0,0,0,0|3,0,0]=4 140 B11R1.17 CCOCc1ccccc1I 7a255f979ee626f845777c39e07b9738 [0,1,0,0,0,0|3,0,0]=4 141 B11R1.17 Cc1ccccc1CNC#N 7d6a9c5d41e74b80e4ae41ce8842d9ae [0,1,0,0,0,0|3,0,0]=4 142 B11R1.17 Cc1ccccc1CNC=O a0b11915ba3bdfe6d1bbea580cf346f5 [0,1,0,0,0,0|2,0,1]=4 143 B11R1.17 Cc1ccccc1CNCF 15e4bda543c50e3e0f080863eb75d61e [0,1,0,0,0,0|3,0,0]=4 144 B11R1.17 Cc1ccccc1CNCO f33352c0e02ea4b4ea9a0720598f200e [0,1,0,0,0,0|2,0,0]=3 145 B11R1.17 Cc1ccccc1COCF 26a9ff4e1acee4455bed5578adee3d1b [0,1,0,0,0,0|3,0,0]=4 146 B11R1.17 Cc1ccccc1NCCO 5035e646db6f3a444835335ac8083c14 [0,1,0,0,0,0|2,0,1]=4 147 B11R1.17 Cc1cccnc1CNCO 30441c00bc8726da80cd698c0c87c74c [0,1,0,0,0,0|3,0,0]=4 148 B11R1.17 Cc1ccncc1CNCO 8820a85b37c3e4693661ff6b2f5470a7 [0,1,0,0,0,0|3,0,0]=4 149 B11R1.17 Cc1cnccc1CNCO f46edf824f8d525036629a5904a74512 [0,1,0,0,0,0|3,0,0]=4 150 B11R1.17 Cc1ncccc1CNCO ebac33228c10df30635cfd2541d72802 [0,1,0,0,0,0|3,0,0]=4 151 B11R1.17 FCNCc1ccccc1Br dc60c3e5196679a6ad7a9fd07289336a [0,1,0,0,0,0|3,0,0]=4 152 B11R1.17 FCNCc1ccccc1Cl b2a7e5b738ab7ee1b7f97a02c137519e [0,1,0,0,0,0|3,0,0]=4 153 B11R1.17 FCNCc1ccccc1F c6a27c7f8e1ab840ee4f8b21e6ebec91 [0,1,0,0,0,0|3,0,0]=4 154 B11R1.17 FCNCc1ccccc1I 072ca4290b9a717a2a3ef28ccf6dc79f [0,1,0,0,0,0|3,0,0]=4 155 B11R1.17 FCOCc1ccccc1Br 1e405168174e3e5a39762fd8efcb0e02 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.17 FCOCc1ccccc1Cl 1bf9ea1561018dfe59c2c98ef1a6a3e2 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.17 FCOCc1ccccc1F 3daad749644938528762801a7655c80c [0,1,0,0,0,0|3,0,0]=4 158 B11R1.17 FCOCc1ccccc1I 31f2d72b4794f19953f85fef60c6eb00 [0,1,0,0,0,0|3,0,0]=4 159 B11R1.17 FCOCc1ccccc1S ccd959bb9897533e9284e6c6e657b910 [0,1,0,0,0,0|3,0,0]=4 160 B11R1.17 N#CNCc1ccccc1Br 9586b8358695530ab1a8b16bca763c94 [0,1,0,0,0,0|3,0,0]=4 161 B11R1.17 N#CNCc1ccccc1Cl ca6a7d4fb906418e57086ce29c3af989 [0,1,0,0,0,0|3,0,0]=4 162 B11R1.17 N#CNCc1ccccc1F 3ab5c1d3e43aa31ffa497e310ad8d782 [0,1,0,0,0,0|3,0,0]=4 163 B11R1.17 N#CNCc1ccccc1I bc9e2b7a404940936a1217ee9648d628 [0,1,0,0,0,0|3,0,0]=4 164 B11R1.17 O=CNCc1ccccc1Br 58e03ef5e72544e0b081657f9f5b4838 [0,1,0,0,0,0|2,0,1]=4 165 B11R1.17 O=CNCc1ccccc1Cl b418b86897393ad70bf26f88a77ebf6f [0,1,0,0,0,0|2,0,1]=4 166 B11R1.17 O=CNCc1ccccc1F 6cd79aefd318241a028748c181ad0758 [0,1,0,0,0,0|2,0,1]=4 167 B11R1.17 O=CNCc1ccccc1I 893983c2cac8ee59f1addbe45883c265 [0,1,0,0,0,0|2,0,1]=4 168 B11R1.17 O=CNCc1ccccc1O df0afa8c91afdac1d44912107063bd10 [0,1,0,0,0,0|2,0,1]=4 169 B11R1.17 OCCNc1ccccc1Cl 7e00c321a95d99f226af9355a5b8fd97 [0,1,0,0,0,0|2,0,1]=4 170 B11R1.17 OCCNc1ccccc1F 4c6208b79575fb1b4efb9bc595ec7419 [0,1,0,0,0,0|2,0,1]=4 171 B11R1.17 OCCNc1ccccc1I 7422a69e1fe9722f423454637884bff2 [0,1,0,0,0,0|2,0,1]=4 172 B11R1.17 OCCNc1ccccc1S 987e6c2de89f4ccfc6bc2df488fb2f56 [0,1,0,0,0,0|2,0,1]=4 173 B11R1.17 OCNCc1ccccc1Br 0209dca586483b54ccb56f7ccd9012ce [0,1,0,0,0,0|2,0,0]=3 174 B11R1.17 OCNCc1ccccc1Cl 5475d2d62064a77dd3e8f040ca795a73 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.17 OCNCc1ccccc1F a78f02dd794e5b9637da439e4010cc0a [0,1,0,0,0,0|2,0,0]=3 176 B11R1.17 OCNCc1ccccc1I 6ad26aea5b9fc20136e87fd70971bc76 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.17 OCNCc1cccnc1Br fa04fbdfe2ab7ab585c87e8888997fde [0,1,0,0,0,0|3,0,0]=4 178 B11R1.17 OCNCc1cccnc1Cl e098226076d1bf05b07c0db61b1608b0 [0,1,0,0,0,0|3,0,0]=4 179 B11R1.17 OCNCc1cccnc1F becc02815a15c17406558b70fdb845a8 [0,1,0,0,0,0|3,0,0]=4 180 B11R1.17 OCNCc1ccncc1Br 217383617b17a78941bd521a0c40dae7 [0,1,0,0,0,0|3,0,0]=4 181 B11R1.17 OCNCc1ccncc1Cl 6d17554379bde9c33e92fb7fd7d0b9f9 [0,1,0,0,0,0|3,0,0]=4 182 B11R1.17 OCNCc1ccncc1F aa8afb20a67cbc48484f103b5e2b4346 [0,1,0,0,0,0|3,0,0]=4 183 B11R1.17 OCNCc1ncccc1Br b3063f47e1ec26ad2317599d840e6a3f [0,1,0,0,0,0|3,0,0]=4 184 B11R1.17 OCNCc1ncccc1Cl 00c0e4e1c0f5be5f03ce1610dfdfc900 [0,1,0,0,0,0|3,0,0]=4 185 B11R1.17 OCNCc1ncccc1F 3eb4781c927959737348d1749c1cc471 [0,1,0,0,0,0|3,0,0]=4 186 B11R1.17 [O-][n+]1ccccc1CNCO f44a10283482acb4e38bb9f793c09558 [0,1,0,0,0,0|3,0,0]=4 187 B11R1.24 CCNCc1cccc(c1)Br 7cc097aea1efe8376684166a5d7a74a3 [0,1,0,0,0,0|3,0,0]=4 188 B11R1.24 CCNCc1cccc(c1)C 8711965bd65b9b9cae0b5574aaf9df19 [0,1,0,0,0,0|3,0,0]=4 189 B11R1.24 CCNCc1cccc(c1)Cl 35f4a4fcd3415e84e248be1142a75e6e [0,1,0,0,0,0|3,0,0]=4 190 B11R1.24 CCNCc1cccc(c1)F a045945dd7664750cd4517426a30ddec [0,1,0,0,0,0|3,0,0]=4 191 B11R1.24 CCNCc1cccc(c1)I a0250fe998532bc25a8c10c3d959951b [0,1,0,0,0,0|3,0,0]=4 192 B11R1.24 CCOCc1cccc(c1)Br 68ab38873ddd37fd78370dbba526e703 [0,1,0,0,0,0|3,0,0]=4 193 B11R1.24 CCOCc1cccc(c1)C a074366dc5260a76a26e1b3a17ce68f7 [0,1,0,0,0,0|3,0,0]=4 194 B11R1.24 CCOCc1cccc(c1)Cl 8933445146c771b808a03b867c201e1e [0,1,0,0,0,0|3,0,0]=4 195 B11R1.24 CCOCc1cccc(c1)F 01b8eda252200f38637020bb494cc211 [0,1,0,0,0,0|3,0,0]=4 196 B11R1.24 CCOCc1cccc(c1)I ee21a715b45c835bc7170e7ff62f202c [0,1,0,0,0,0|3,0,0]=4 197 B11R1.24 Cc1cc(ccn1)CNCO 220fd9dc96cf7acc9670e8e8f858e714 [0,1,0,0,0,0|3,0,0]=4 198 B11R1.24 Cc1cccc(c1)CNC#N afb8590a54656766c7fa3e8613412263 [0,1,0,0,0,0|3,0,0]=4 199 B11R1.24 Cc1cccc(c1)CNC=O f999de901cc8b568a96ef98318b0e85f [0,1,0,0,0,0|2,0,1]=4 200 B11R1.24 Cc1cccc(c1)CNCF 26331ce248fc61a15345fc123ac841ae [0,1,0,0,0,0|3,0,0]=4 201 B11R1.24 Cc1cccc(c1)CNCO d0a6ec7f4afcd99e7d28be3d4dacede0 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.24 Cc1cccc(c1)COCF 11267dea5d808124a105735821eaa460 [0,1,0,0,0,0|3,0,0]=4 203 B11R1.24 Cc1cccc(c1)NCCO 788520a7b5122ba23efd60ec7af11b62 [0,1,0,0,0,0|2,0,1]=4 204 B11R1.24 Cc1cccc(n1)CNCO fe42a0006039c5b282c8b0832528d029 [0,1,0,0,0,0|3,0,0]=4 205 B11R1.24 Cc1ccnc(c1)CNCO 5f13cb4049c3b8923e25988be44c27eb [0,1,0,0,0,0|3,0,0]=4 206 B11R1.24 Cc1cncc(c1)CNCO 7a4427168da0170ab18b195344f9dc2f [0,1,0,0,0,0|3,0,0]=4 207 B11R1.24 FCNCc1cccc(c1)Br 7d04e2339b42e8f2d0122b4fdbb3009d [0,1,0,0,0,0|3,0,0]=4 208 B11R1.24 FCNCc1cccc(c1)Cl e145b682fefd1d3baa7ebff04addc07b [0,1,0,0,0,0|3,0,0]=4 209 B11R1.24 FCNCc1cccc(c1)F 6e9400ce8cf9ff79d0c0062ec100268a [0,1,0,0,0,0|3,0,0]=4 210 B11R1.24 FCNCc1cccc(c1)I 3974009fe99bec9ffdffbaebd85438b2 [0,1,0,0,0,0|3,0,0]=4 211 B11R1.24 FCOCc1cccc(c1)Br 06fd5492a825faa19dd2b0a6ce53ff70 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.24 FCOCc1cccc(c1)Cl bc6f623318574bc18fb6d005c3b19654 [0,1,0,0,0,0|3,0,0]=4 213 B11R1.24 FCOCc1cccc(c1)F 54b20c54954574867369722c4db6da9a [0,1,0,0,0,0|3,0,0]=4 214 B11R1.24 FCOCc1cccc(c1)I 20971ddf8a9eb4748299b05e02229bbd [0,1,0,0,0,0|3,0,0]=4 215 B11R1.24 N#CNCc1cccc(c1)Br 40947e3a7b47e2be9d0f96d385ea1cab [0,1,0,0,0,0|3,0,0]=4 216 B11R1.24 N#CNCc1cccc(c1)Cl 999e9fb7fa6a6663d2a527e282871e10 [0,1,0,0,0,0|3,0,0]=4 217 B11R1.24 N#CNCc1cccc(c1)F 62d3238376d897dcb10c1c919ec65fde [0,1,0,0,0,0|3,0,0]=4 218 B11R1.24 N#CNCc1cccc(c1)I 602c3d6d94c8e2962c7676d14076aa55 [0,1,0,0,0,0|3,0,0]=4 219 B11R1.24 O=CNCc1cccc(c1)Br 81a6d67e7c0081d831790a4f60fdd665 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.24 O=CNCc1cccc(c1)Cl 65b698943b3a92d1bd4a0e6dffd59e66 [0,1,0,0,0,0|2,0,1]=4 221 B11R1.24 O=CNCc1cccc(c1)F 27dcacf4bc23db553cf8adde50a08a8b [0,1,0,0,0,0|2,0,1]=4 222 B11R1.24 O=CNCc1cccc(c1)I ac2116931a566ab6ed04886c2660a5c2 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.24 O=CNCc1cccc(c1)O 5064b7b78a71b73f549eda5bd0de9ccc [0,1,0,0,0,0|2,0,1]=4 224 B11R1.24 O=c1cc(cc[nH]1)CNCO c4aad1d382df6023dbb9bfc71918fa08 [0,1,0,0,0,0|3,0,0]=4 225 B11R1.24 OCCNc1cccc(c1)Br 72567362870bfac93c93e7b10c66dbef [0,1,0,0,0,0|2,0,1]=4 226 B11R1.24 OCCNc1cccc(c1)Cl e17e7e92e4c4d52ba070bc2481182aec [0,1,0,0,0,0|2,0,1]=4 227 B11R1.24 OCCNc1cccc(c1)F efdd551ee0f00745ebb911089af2cb0e [0,1,0,0,0,0|2,0,1]=4 228 B11R1.24 OCCNc1cccc(c1)I f3c298b6e86d76fb00282800b71da201 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.24 OCCNc1cccc(c1)S bc3a43ad2a55514906329a47347a3147 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.24 OCNCc1cc(ccn1)Br 06cb0b6f11d2df317f076a34cca73254 [0,1,0,0,0,0|3,0,0]=4 231 B11R1.24 OCNCc1cc(ccn1)Cl 5646effac8639f8535d15a6b99ad056c [0,1,0,0,0,0|3,0,0]=4 232 B11R1.24 OCNCc1cccc(c1)Br 9ae94d6fc4c7aac28899119fef51b5ec [0,1,0,0,0,0|2,0,0]=3 233 B11R1.24 OCNCc1cccc(c1)Cl 713c7b0184423731a15a73fa223201b6 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.24 OCNCc1cccc(c1)F a12edc0401d7c1be2d7abc20d4ca38fc [0,1,0,0,0,0|2,0,0]=3 235 B11R1.24 OCNCc1cccc(c1)I f7370a634a3488ab18a27f63d6247824 [0,1,0,0,0,0|2,0,0]=3 236 B11R1.24 OCNCc1cccc(n1)Br 23296dee875c9669a422613f06aeef06 [0,1,0,0,0,0|3,0,0]=4 237 B11R1.24 OCNCc1cccc(n1)Cl faf46ab43f1e9a23a22115d506a7017c [0,1,0,0,0,0|3,0,0]=4 238 B11R1.24 OCNCc1cccc(n1)F c5b650412f060761f1cc75a8aca4b5dd [0,1,0,0,0,0|3,0,0]=4 239 B11R1.24 OCNCc1ccnc(c1)Br 3a0e55a9ff73d236d99460783912071e [0,1,0,0,0,0|3,0,0]=4 240 B11R1.24 OCNCc1ccnc(c1)Cl e808e8311876b6a3d48faefd4bc8115e [0,1,0,0,0,0|3,0,0]=4 241 B11R1.24 OCNCc1ccnc(c1)F 5c6920251d116376c180ff91e7c1250a [0,1,0,0,0,0|3,0,0]=4 242 B11R1.24 OCNCc1cncc(c1)Br ffec339e7a0fc11ba77bb4ac904f8f20 [0,1,0,0,0,0|3,0,0]=4 243 B11R1.24 OCNCc1cncc(c1)Cl 8574d223ab5ee8845117148de06cee06 [0,1,0,0,0,0|3,0,0]=4 244 B11R1.24 OCNCc1cncc(c1)F b3a6ffb96c10c52c53c936dac726e05c [0,1,0,0,0,0|3,0,0]=4 245 B11R1.24 [O-][n+]1cccc(c1)CNCO aa03904d5dcf4d8ab04ff277c5e28dc8 [0,1,0,0,0,0|3,0,0]=4 246 B11R1.28 BrCCNCc1ccccc1 ac057fc43e8d6ea85181427003cd8239 [0,1,0,0,0,0|2,0,1]=4 247 B11R1.28 C#CCCNc1ccccc1 a50e6468b9593b4ac45e12d5e3b3638a [0,1,0,0,0,0|2,0,1]=4 248 B11R1.28 C#CCNCc1ccccc1 5ab7d08152aaaf12430a9163e509ecd1 [0,1,0,0,0,0|2,0,1]=4 249 B11R1.28 C#CCOCc1ccccc1 4aff10236737b564a9b29132113db7f4 [0,1,0,0,0,0|2,0,1]=4 250 B11R1.28 C/C=C/CNc1ccccc1 e02cbeaffef0ff2c4795b558e93457ed [0,1,0,0,0,0|2,0,0]=3 251 B11R1.28 C/C=C/CNc1ccccn1 5a61b9aee47fe046ef4ac884866e0a57 [0,1,0,0,0,0|3,0,0]=4 252 B11R1.28 C/C=C/CNc1cccnc1 016f8674f0de62bc0968120f36183bbf [0,1,0,0,0,0|3,0,0]=4 253 B11R1.28 C/C=C/CNc1ccncc1 fa31f47fa5bc1ec1ccb1bf7f45f30dc4 [0,1,0,0,0,0|3,0,0]=4 254 B11R1.28 C/C=C/COc1ccccn1 ed755d9f4a3a906e4d287cc92f6a9256 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.28 C/C=C/COc1cccnc1 182aabd1e115f20a2221ff63f4609b70 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.28 C/C=C/COc1ccncc1 626a36d815056b548624718762e7a1fe [0,1,0,0,0,0|3,0,0]=4 257 B11R1.28 C/C=C\CNc1ccccc1 f25f4c9ee5d52b5a340bd4a7fd720817 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.28 C/C=C\CNc1ccccn1 c173af20e99f83d9a5c456a592ef1e15 [0,1,0,0,0,0|3,0,0]=4 259 B11R1.28 C/C=C\CNc1cccnc1 be373d2993e9bf82390bd09b9626574e [0,1,0,0,0,0|3,0,0]=4 260 B11R1.28 C/C=C\CNc1ccncc1 a87b6e6c7832e2cb33ea74aa8e2c65c1 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.28 C/C=C\COc1ccccn1 69073974b597ab405a0094b540a97f81 [0,1,0,0,0,0|3,0,0]=4 262 B11R1.28 C/C=C\COc1cccnc1 d486f9f7e5b795e5a8aedabfa7f6ce63 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.28 C/C=C\COc1ccncc1 111e76a9a567d470a95d2cac0ae301d3 [0,1,0,0,0,0|3,0,0]=4 264 B11R1.28 C=CCCNc1ccccc1 41e5ae44107c117783190eb282a3dc50 [0,1,0,0,0,0|2,0,1]=4 265 B11R1.28 C=CCNCc1ccccc1 c3088ea78b0f7fe35bdb5a0a79f4eb2a [0,1,0,0,0,0|2,0,1]=4 266 B11R1.28 C=CCOCc1ccccc1 38f1b42f9627b73302287ed7d9c08f3f [0,1,0,0,0,0|2,0,1]=4 267 B11R1.28 CC=CCNc1ccccc1 c43b41b8b675349badfe26c48e3f7c5f [0,1,0,0,0,0|2,0,0]=3 268 B11R1.28 CC=CCNc1ccccn1 dff63d253924f7dd0d25e5ccec37e70c [0,1,0,0,0,0|3,0,0]=4 269 B11R1.28 CC=CCNc1cccnc1 712a10215e7a39b6e923461fbfb9f854 [0,1,0,0,0,0|3,0,0]=4 270 B11R1.28 CC=CCNc1ccncc1 0b02037bf9ae4c647d4431b3d00b040e [0,1,0,0,0,0|3,0,0]=4 271 B11R1.28 CCCCNc1ccccc1 178647391839dfbe95aed182d7dc43ba [0,1,0,0,0,0|2,0,1]=4 272 B11R1.28 CCCNCc1ccccc1 6e74fa6187fccbc3617e9cc264b3e7aa [0,1,0,0,0,0|2,0,1]=4 273 B11R1.28 CCCOCc1ccccc1 112c1e14e862b8fbffa225764759b8ec [0,1,0,0,0,0|2,0,1]=4 274 B11R1.28 CCNCCc1ccccc1 a4bcdd097e726e04ab2794cdb42f5f71 [0,1,0,0,0,0|1,0,2]=4 275 B11R1.28 CCOCCc1ccccc1 4c8fc52cc53157c0b0cd10959d18f86a [0,1,0,0,0,0|2,0,1]=4 276 B11R1.28 CCOCNc1ccccc1 00b4118c5fbc36d206f093517b5cafbb [0,1,0,0,0,0|3,0,0]=4 277 B11R1.28 COCCNc1ccccc1 5ef0d3255ad59be77d905fd9c0e71e6d [0,1,0,0,0,0|2,0,1]=4 278 B11R1.28 COCNCc1ccccc1 658bb4bb78d053244c07843f6f02f062 [0,1,0,0,0,0|2,0,0]=3 279 B11R1.28 COCNCc1ccccn1 cb969ddff5a45a0c4df4b7717e547f81 [0,1,0,0,0,0|3,0,0]=4 280 B11R1.28 COCNCc1cccnc1 35b8b6083a32f9db8795c63f618b2f12 [0,1,0,0,0,0|3,0,0]=4 281 B11R1.28 COCNCc1ccncc1 3fb6af955e4c1e6a3044742c559cc5ae [0,1,0,0,0,0|3,0,0]=4 282 B11R1.28 COCOCc1ccccc1 33758b3ae4df68a136cb96076fbeb2ee [0,1,0,0,0,0|2,0,0]=3 283 B11R1.28 COCOCc1ccccn1 c7e2d466f64f2796a0fb099c19cb65e2 [0,1,0,0,0,0|3,0,0]=4 284 B11R1.28 COCOCc1cccnc1 f4d73442b3dd40c1495fadfe4fccda61 [0,1,0,0,0,0|3,0,0]=4 285 B11R1.28 COCOCc1ccncc1 99c1a2805ee24504fc8830c71e80abe6 [0,1,0,0,0,0|3,0,0]=4 286 B11R1.28 CSCCNc1ccccc1 f8eb965b60d0615781c928cdcd30bc15 [0,1,0,0,0,0|2,0,1]=4 287 B11R1.28 CSCNCc1ccccc1 5b3aef5f0ecdedc4b2903ec980e5dc72 [0,1,0,0,0,0|2,0,1]=4 288 B11R1.28 CSCOCc1ccccc1 5941de554d8996d7d45b8f8eee2daf73 [0,1,0,0,0,0|2,0,1]=4 289 B11R1.28 Cl/C=C/CNc1ccccc1 2c44d12ba68cdacdd9e9917c4f75a2d7 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.28 Cl/C=C/CNc1ccccn1 893fcb433253dfa6af2c640facebd871 [0,1,0,0,0,0|3,0,0]=4 291 B11R1.28 Cl/C=C/CNc1cccnc1 4c880db362d0bb5599ebb3569229cd20 [0,1,0,0,0,0|3,0,0]=4 292 B11R1.28 Cl/C=C/CNc1ccncc1 1babbae78311b583750e654a536413df [0,1,0,0,0,0|3,0,0]=4 293 B11R1.28 Cl/C=C/COc1ccccn1 fc8e32ffcd696aa21b384695882dbb82 [0,1,0,0,0,0|3,0,0]=4 294 B11R1.28 Cl/C=C/COc1cccnc1 958f62ca3222776039624c998ece50d6 [0,1,0,0,0,0|3,0,0]=4 295 B11R1.28 Cl/C=C/COc1ccncc1 2dcda1746e959a694ba3b5c7e904d8b1 [0,1,0,0,0,0|3,0,0]=4 296 B11R1.28 Cl/C=C\CNc1ccccc1 99831c517c8f2e8a372e55388ab37fa9 [0,1,0,0,0,0|2,0,0]=3 297 B11R1.28 Cl/C=C\CNc1ccccn1 0eaed82ec617ba6b064e05e462ba0ed3 [0,1,0,0,0,0|3,0,0]=4 298 B11R1.28 Cl/C=C\CNc1cccnc1 5928728b468f916ad207769df539dde6 [0,1,0,0,0,0|3,0,0]=4 299 B11R1.28 Cl/C=C\CNc1ccncc1 4cfb701a606067bc35064d236b9ba030 [0,1,0,0,0,0|3,0,0]=4 300 B11R1.28 Cl/C=C\COc1ccccn1 57e73453ad210a0d931cd71403fa56b4 [0,1,0,0,0,0|3,0,0]=4 301 B11R1.28 Cl/C=C\COc1cccnc1 9e789e51d37bdaa0eeeaf628165830d4 [0,1,0,0,0,0|3,0,0]=4 302 B11R1.28 Cl/C=C\COc1ccncc1 f7e95385e1a18482424491246f802c9c [0,1,0,0,0,0|3,0,0]=4 303 B11R1.28 ClCCCNc1ccccc1 b7f587f82b83ca90917a5139ff536b22 [0,1,0,0,0,0|2,0,1]=4 304 B11R1.28 FCCCNc1ccccc1 b3f41abfb84c10f658d04a58ad820f46 [0,1,0,0,0,0|2,0,1]=4 305 B11R1.28 FCCNCc1ccccc1 562ef8707f4288c2162274968d966312 [0,1,0,0,0,0|2,0,1]=4 306 B11R1.28 FCCOCc1ccccc1 d9b83bdc5263ec616987dc5988d5ee5b [0,1,0,0,0,0|2,0,1]=4 307 B11R1.28 FCNCCc1ccccc1 0081f6dcce701ffe77378524f92f490b [0,1,0,0,0,0|1,0,2]=4 308 B11R1.28 FCOCCc1ccccc1 f68582be9a805c98452f747e5a13d902 [0,1,0,0,0,0|2,0,1]=4 309 B11R1.28 ICCNCc1ccccc1 697ca1617b546014ae02b06ad2981d8a [0,1,0,0,0,0|2,0,1]=4 310 B11R1.28 N#CCCNc1ccccc1 11cc2433e70294ae10477f88fd0e31d0 [0,1,0,0,0,0|2,0,1]=4 311 B11R1.28 N#CCNCc1ccccc1 f23a3b4a1088925db39a0117b8e4d4c1 [0,1,0,0,0,0|2,0,1]=4 312 B11R1.28 N#CCOCc1ccccc1 c6fb0c0fa9f97c70e5fbc997cccd1b4f [0,1,0,0,0,0|2,0,1]=4 313 B11R1.28 N#CNCCc1ccccc1 cc0f6fa18b1c1eb0550ef90401294e13 [0,1,0,0,0,0|1,0,2]=4 314 B11R1.28 NOCCNc1ccccc1 6c5b7062e9d75a57daf03317347aff96 [0,1,0,0,0,0|2,0,1]=4 315 B11R1.28 O/C=C\CNc1ccccc1 8e43d75b756e053c042884ec195cf7a7 [0,1,0,0,0,0|1,0,0]=2 316 B11R1.28 O/C=C\CNc1ccccn1 8552c5b8053856ab2aa5ee1e23f07468 [0,1,0,0,0,0|2,0,0]=3 317 B11R1.28 O/C=C\CNc1cccnc1 de9757e1e7a0fdccd35f1dc1824af66e [0,1,0,0,0,0|2,0,0]=3 318 B11R1.28 O/C=C\CNc1cccnn1 e52ad279909108c36bfaee0ce998c614 [0,1,0,0,0,0|3,0,0]=4 319 B11R1.28 O/C=C\CNc1ccncc1 9460f02521a31c56dbc0ee24015cbd53 [0,1,0,0,0,0|2,0,0]=3 320 B11R1.28 O/C=C\CNc1ccncn1 6deb4bcf02cde896ebd628f8b68cb75f [0,1,0,0,0,0|3,0,0]=4 321 B11R1.28 O/C=C\CNc1ccnnc1 045c548fd4be5bb2d635592edd2bdf04 [0,1,0,0,0,0|3,0,0]=4 322 B11R1.28 O/C=C\CNc1cnccn1 42856907adf1463c572cd4925a22f64f [0,1,0,0,0,0|3,0,0]=4 323 B11R1.28 O/C=C\CNc1cncnc1 ce604438bd7dfd42b91ad2a4591afafc [0,1,0,0,0,0|3,0,0]=4 324 B11R1.28 O/C=C\CNc1ncccn1 f0c0aa4f88b6b475d2d8969e17e2c6b6 [0,1,0,0,0,0|3,0,0]=4 325 B11R1.28 O=CCCNc1ccccc1 5adfd28b693cf17e4441c0e8b873a1f0 [0,1,0,0,0,0|1,0,2]=4 326 B11R1.28 O=CCNCc1ccccc1 2b4b8121ff6ad050b40b87d13d8f5a1a [0,1,0,0,0,0|1,0,2]=4 327 B11R1.28 O=CCOCc1ccccc1 7bd4c1ac5902422e7c3cafad9115c4f2 [0,1,0,0,0,0|1,0,2]=4 328 B11R1.28 O=CNCCc1ccccc1 d1fab3f35b45ae0bc45cf7bf9f19384c [0,1,0,0,0,0|0,0,3]=4 329 B11R1.28 OCCCNc1ccccc1 6f65c15387fc952c20110ea29ef53956 [0,1,0,0,0,0|1,0,1]=3 330 B11R1.28 OCCCNc1ccccn1 587693fe3960ae4ed00c51618661aeab [0,1,0,0,0,0|2,0,1]=4 331 B11R1.28 OCCCNc1cccnc1 90b07b63ba2da4339e6031d93f7df208 [0,1,0,0,0,0|2,0,1]=4 332 B11R1.28 OCCCNc1ccncc1 7676a46d9ab85382fda372d12f0ec436 [0,1,0,0,0,0|2,0,1]=4 333 B11R1.28 OCCNCc1ccccc1 6075728aab81556d5096d2980e4afa2d [0,1,0,0,0,0|1,0,1]=3 334 B11R1.28 OCCNCc1ccccn1 aee8d8851b64ae441b47dd7c19255c9b [0,1,0,0,0,0|2,0,1]=4 335 B11R1.28 OCCNCc1cccnc1 882a81680203d781920d7144e525a6cd [0,1,0,0,0,0|2,0,1]=4 336 B11R1.28 OCCNCc1ccncc1 9ecc8a72acff6784c82756ff768b065d [0,1,0,0,0,0|2,0,1]=4 337 B11R1.28 OCNCCc1ccccc1 dba1af705064b03a49f56a10af922b9a [0,1,0,0,0,0|0,0,2]=3 338 B11R1.28 OCNCCc1ccccn1 870a6b93d6f817d2b7b76ee4a753e49e [0,1,0,0,0,0|1,0,2]=4 339 B11R1.28 OCNCCc1cccnc1 5a238842d821729331c809bafe95118a [0,1,0,0,0,0|1,0,2]=4 340 B11R1.28 OCNCCc1ccncc1 d4fdef2a16a1c89c93b39a7d349558eb [0,1,0,0,0,0|1,0,2]=4 341 B11R1.28 SCCCNc1ccccc1 0ed9842b503e3cd70fca4624b001f5d8 [0,1,0,0,0,0|1,1,1]=4 342 B11R1.28 SCCNCc1ccccc1 842b711568e585283783756ca8279842 [0,1,0,0,0,0|1,1,1]=4 343 B11R1.28 SCCOCc1ccccc1 ef1d3bfcf77b316513e3e84b7d85c143 [0,1,0,0,0,0|1,1,1]=4 344 B11R1.40 C=CC(=O)Nc1ccccc1 5f69a60f76bf8d4845a783c3048b2563 [0,1,0,0,0,0|3,0,0]=4 345 B11R1.40 CC(CO)Nc1ccccc1 28944821b2a2502f940043c73e5bee97 [0,1,0,0,0,0|2,0,1]=4 346 B11R1.40 CCN(C)Cc1ccccc1 c214a7b7c23665abe56278baaf98348b [0,1,0,0,0,0|3,0,0]=4 347 B11R1.40 CN(C=O)Cc1ccccc1 701ed8237afa851586621908f176512f [0,1,0,0,0,0|2,0,1]=4 348 B11R1.40 CN(CF)Cc1ccccc1 5e57d186c6f316353ffa6c809cb61d75 [0,1,0,0,0,0|3,0,0]=4 349 B11R1.40 CN(CO)Cc1ccccc1 c1d08d2d2c7de731954ebcb428d333e2 [0,1,0,0,0,0|2,0,0]=3 350 B11R1.40 CN(CO)Cc1ccccn1 a4ef6b4247ef0972f7871752389806bb [0,1,0,0,0,0|3,0,0]=4 351 B11R1.40 CN(CO)Cc1cccnc1 bdae5dd3c0107b4a15ddef98331c4b4c [0,1,0,0,0,0|3,0,0]=4 352 B11R1.40 CN(CO)Cc1ccncc1 82d474736717cd4ad3b664282e77f89c [0,1,0,0,0,0|3,0,0]=4 353 B11R1.40 C[C@@H](CO)Nc1ccccc1 d1a979ebd31c8c47073ae387eaa9c5f8 [0,1,0,0,0,0|2,0,1]=4 354 B11R1.40 C[C@H](CO)Nc1ccccc1 b7592eed2c2b10dda06f47547223c567 [0,1,0,0,0,0|2,0,1]=4 355 B11R1.40 O=C(CO)Nc1ccccn1 ac93149c4969ed513b19c3eba5f007d7 [0,1,0,0,0,0|3,0,0]=4 356 B11R1.40 O=C(CO)Nc1cccnc1 c1618f12da4bc6c07033d2147d5e05a1 [0,1,0,0,0,0|3,0,0]=4 357 B11R1.40 O=CC(=O)Nc1ccccc1 d69489ae088f523aa236921a313e92a5 [0,1,0,0,0,0|2,0,1]=4 358 B11R1.91 CC(=O)NCc1ccccc1 29a87354e4243d3817f046f8152f971d [0,1,0,0,0,0|2,0,1]=4 359 B11R1.91 CC(C)NCc1ccccc1 60272e3c9303882f29d21331dcab1491 [0,1,0,0,0,0|3,0,0]=4 360 B11R1.91 CC(C)OCc1ccccc1 7aa508df1117d05227b589ad5630d192 [0,1,0,0,0,0|3,0,0]=4 361 B11R1.91 CC(O)CNc1ccccc1 bad1b8ce4c3d0d43f36328d30e7f1e89 [0,1,0,0,0,0|2,0,1]=4 362 B11R1.91 C[C@@H](O)CNc1ccccc1 3364bd989574177eabc4c47575206f02 [0,1,0,0,0,0|2,0,1]=4 363 B11R1.91 C[C@H](O)CNc1ccccc1 72a253baaf381f6699a10e01b0f0ab34 [0,1,0,0,0,0|2,0,1]=4 364 B11R1.91 O=C(O)CNc1ccccc1 aa02152e084051d6acb84b2b7ca3be40 [0,1,0,0,0,0|2,0,1]=4 365 B9R1.12 OCNCc1cc[nH]c1 f5a137e18f15de138541ca934254f440 [0,0,0,0,1,0|3,0,0]=4 366 B9R1.12 OCNCc1ccc[nH]1 b011ce93b48fe889bae376897837b402 [0,0,0,0,1,0|3,0,0]=4 367 B9R1.12 OCNCc1ccco1 65cac21f3029c35a0c20d324fb578c01 [0,0,0,0,1,0|3,0,0]=4 368 B9R1.12 OCNCc1cccs1 2d672a9efcaba2b89f20e3b8a4fffaa8 [0,0,0,0,1,0|3,0,0]=4 369 B9R1.12 OCNCc1ccoc1 9c7027d5d74585d7a26015dc4962abeb [0,0,0,0,1,0|3,0,0]=4 370 B9R1.12 OCNCc1ccsc1 e98282527dce2dcf482e445dc6ab3297 [0,0,0,0,1,0|3,0,0]=4 371 B10R1.1 Cc1ccc(cc1)NC=O 744bdaf803f21c7628c38778fb4c30d0 [1,1,0,0,0,0|1,0,1]=4 372 B10R1.1 Cc1ccc(cc1)NCO 626a801ae48c57fa3fcbb53e76d595f1 [1,1,0,0,0,0|1,0,1]=4 373 B10R1.1 O=CNc1ccc(cc1)Br d7ce2fc8367b9f0ab0f2e59514baf831 [1,1,0,0,0,0|1,0,1]=4 374 B10R1.1 O=CNc1ccc(cc1)Cl 6958240b257559c57e66b733208a1fd9 [1,1,0,0,0,0|1,0,1]=4 375 B10R1.1 O=CNc1ccc(cc1)F bd58d24daf145acc5a6089d95f60a456 [1,1,0,0,0,0|1,0,1]=4 376 B10R1.1 O=CNc1ccc(cc1)I 477097145ec69bf5f94c911c47fa12c8 [1,1,0,0,0,0|1,0,1]=4 377 B10R1.1 O=CNc1ccc(cc1)S 4a89cce61b79984a4f73e03ba9acee66 [1,1,0,0,0,0|1,0,1]=4 378 B10R1.1 OCNc1ccc(cc1)Br 8a6f77c6bbe9ea4e056c3d8d66d7853d [1,1,0,0,0,0|1,0,1]=4 379 B10R1.1 OCNc1ccc(cc1)Cl 86437eba67664b7a79a0b9f1be727594 [1,1,0,0,0,0|1,0,1]=4 380 B10R1.1 OCNc1ccc(cc1)F 713130e1345d066522caa5c40a69b374 [1,1,0,0,0,0|1,0,1]=4 381 B10R1.1 OCNc1ccc(cc1)I b3ec7df4f137e654c56c2616ca2d7a8a [1,1,0,0,0,0|1,0,1]=4 382 B10R1.1 OCNc1ccc(cc1)S a2d81e6a6f1ccdc29f69d5fbee093f77 [1,1,0,0,0,0|1,0,1]=4 383 B10R1.4 Cc1ccccc1NC=O 93463d97863750f67f3c00d910f09802 [1,1,0,0,0,0|1,0,1]=4 384 B10R1.4 O=CNc1ccccc1Cl f50c00cfcaa880ebbb89407e81f8f8d5 [1,1,0,0,0,0|1,0,1]=4 385 B10R1.4 O=CNc1ccccc1F f3282ec2c1421e860906e44973b8a687 [1,1,0,0,0,0|1,0,1]=4 386 B10R1.4 O=CNc1ccccc1I 892dff9976fcab110017d24c58532fbf [1,1,0,0,0,0|1,0,1]=4 387 B10R1.4 O=CNc1ccccc1O a5803dbb8fd09b48d1dac5606f2634e9 [1,1,0,0,0,0|1,0,1]=4 388 B10R1.4 O=CNc1ccccc1S adbd377728039742a9715a2c254499e8 [1,1,0,0,0,0|1,0,1]=4 389 B10R1.4 OCNc1ccccc1I 10ade089d4f881d90e5208c43f98902f [1,1,0,0,0,0|1,0,1]=4 390 B10R1.10 Cc1cccc(c1)NC=O 05038cbe055575047c41b1e8757f2545 [1,1,0,0,0,0|1,0,1]=4 391 B10R1.10 Cc1cccc(c1)NCO eb61e002278030a37368dc2bd095ceec [1,1,0,0,0,0|1,0,1]=4 392 B10R1.10 O=CNc1cccc(c1)Br 5eb9518e9956f7a348d0a646a73a1e32 [1,1,0,0,0,0|1,0,1]=4 393 B10R1.10 O=CNc1cccc(c1)Cl 7fe4ac55882b67bb145106257f99a127 [1,1,0,0,0,0|1,0,1]=4 394 B10R1.10 O=CNc1cccc(c1)F 078b99782fd4caa299ab4bc2089ca8ec [1,1,0,0,0,0|1,0,1]=4 395 B10R1.10 O=CNc1cccc(c1)I 0ca8a7d6d3dcba43e51377ba593dcc41 [1,1,0,0,0,0|1,0,1]=4 396 B10R1.10 O=CNc1cccc(c1)O b7034720bcdfb6e36ba15c0a5abf2a37 [1,1,0,0,0,0|1,0,1]=4 397 B10R1.10 O=CNc1cccc(c1)S 605dde1db165209334662244eb37bfa5 [1,1,0,0,0,0|1,0,1]=4 398 B10R1.10 OCNc1cccc(c1)Br 87332989ccf0a06305ed11c761d0693f [1,1,0,0,0,0|1,0,1]=4 399 B10R1.10 OCNc1cccc(c1)Cl 68445f3d0584c980a0fba61df5ca8efe [1,1,0,0,0,0|1,0,1]=4 400 B10R1.10 OCNc1cccc(c1)F 24a19ac850850294d97609fe4487e656 [1,1,0,0,0,0|1,0,1]=4 401 B10R1.10 OCNc1cccc(c1)I ac2d74171e11e079d9ebd4692866b125 [1,1,0,0,0,0|1,0,1]=4 402 B10R1.10 OCNc1cccc(c1)S 0a81563d3a78719492df94f2bfff9ef9 [1,1,0,0,0,0|1,0,1]=4 403 B10R1.21 O/C=C\CNc1cccs1 4950d52a683e52fb0875f17a49eb0e8d [0,1,0,0,1,0|2,0,0]=4 404 B10R1.21 O/C=C\CNc1ccsc1 8b89f424c9eb444de8b2483d7dce5c98 [0,1,0,0,1,0|2,0,0]=4 405 B12R1.1 C/C=C/CNc1ccc(cc1)Br e9d79593c873a13ad8a6bafcc81e85e6 [0,2,0,0,0,0|2,0,0]=4 406 B12R1.1 C/C=C/CNc1ccc(cc1)C 117fb35c32f4fcd90d489486214b8fdf [0,2,0,0,0,0|2,0,0]=4 407 B12R1.1 C/C=C/CNc1ccc(cc1)Cl 467057be232b55430c088b3b08c0a906 [0,2,0,0,0,0|2,0,0]=4 408 B12R1.1 C/C=C/CNc1ccc(cc1)F 5c4bd221a3da9a4f95f1eacac352b50c [0,2,0,0,0,0|2,0,0]=4 409 B12R1.1 C/C=C/CNc1ccc(cc1)I e1b61c378e7295bca2584f113cd07198 [0,2,0,0,0,0|2,0,0]=4 410 B12R1.1 C/C=C/CNc1ccc(cc1)S b21df545969e011054ac00e4feebe28e [0,2,0,0,0,0|2,0,0]=4 411 B12R1.1 C/C=C/COc1ccc(cc1)Br 26ecc795fd1981af41457d9e3ad18ced [0,2,0,0,0,0|2,0,0]=4 412 B12R1.1 C/C=C/COc1ccc(cc1)C f8d69d24da03e61b44e653ec4867d71f [0,2,0,0,0,0|2,0,0]=4 413 B12R1.1 C/C=C/COc1ccc(cc1)Cl 3ce58a05b75f6368eff8d88fe226452e [0,2,0,0,0,0|2,0,0]=4 414 B12R1.1 C/C=C/COc1ccc(cc1)F 91730cc9eb30130ee9e655cedd7da81e [0,2,0,0,0,0|2,0,0]=4 415 B12R1.1 C/C=C/COc1ccc(cc1)I b881dc53dafdfb1bf15165b68942a173 [0,2,0,0,0,0|2,0,0]=4 416 B12R1.1 C/C=C/COc1ccc(cc1)S fa0d4e800768238c75ac4b429285c91b [0,2,0,0,0,0|2,0,0]=4 417 B12R1.1 C/C=C\CNc1ccc(cc1)Br 96e01a5586b993be8cb1adece25a7ac4 [0,2,0,0,0,0|2,0,0]=4 418 B12R1.1 C/C=C\CNc1ccc(cc1)C e4135b47a2c2aba20230ba272853902b [0,2,0,0,0,0|2,0,0]=4 419 B12R1.1 C/C=C\CNc1ccc(cc1)Cl 176adb130153a94d2957d935a9efceb3 [0,2,0,0,0,0|2,0,0]=4 420 B12R1.1 C/C=C\CNc1ccc(cc1)F 05f4bf8e58a65d666328222853478aee [0,2,0,0,0,0|2,0,0]=4 421 B12R1.1 C/C=C\CNc1ccc(cc1)I a16e71f2932f3bd8c40d37c9a12ea2cb [0,2,0,0,0,0|2,0,0]=4 422 B12R1.1 C/C=C\CNc1ccc(cc1)S babf17c94680dd70befc5ec2c0d17a5a [0,2,0,0,0,0|2,0,0]=4 423 B12R1.1 C/C=C\COc1ccc(cc1)Br 932a92de9934dbed970c282c28c7e041 [0,2,0,0,0,0|2,0,0]=4 424 B12R1.1 C/C=C\COc1ccc(cc1)C 3a708db0a3ff03fe131be8835427e3d6 [0,2,0,0,0,0|2,0,0]=4 425 B12R1.1 C/C=C\COc1ccc(cc1)Cl 4d1f69e87809aa08d9775150a61530ec [0,2,0,0,0,0|2,0,0]=4 426 B12R1.1 C/C=C\COc1ccc(cc1)F 5cb2bf3d08583ea0caef753401664318 [0,2,0,0,0,0|2,0,0]=4 427 B12R1.1 C/C=C\COc1ccc(cc1)I eb94fd237cb188efafef86a4d82db7c0 [0,2,0,0,0,0|2,0,0]=4 428 B12R1.1 C/C=C\COc1ccc(cc1)S 52b354367f01642f2d2a23fc34cbacd8 [0,2,0,0,0,0|2,0,0]=4 429 B12R1.1 CC=CCNc1ccc(cc1)C d117377d9afde8cadbf219f6c96c4cdd [0,2,0,0,0,0|2,0,0]=4 430 B12R1.1 CC=CCNc1ccc(cc1)F 04e3464eea2c1dda13c70e8427cd77b2 [0,2,0,0,0,0|2,0,0]=4 431 B12R1.1 CC=CCNc1ccc(cc1)O e6664ac98f0809d499103c3ffca72e3d [0,2,0,0,0,0|2,0,0]=4 432 B12R1.1 CC=CCNc1ccc(cc1)S c6abfc26577d70ee04f2466186b1b7af [0,2,0,0,0,0|2,0,0]=4 433 B12R1.1 COCNCc1ccc(cc1)Br 2101c8ffb2742f9e20614ebc2902f4e9 [0,2,0,0,0,0|2,0,0]=4 434 B12R1.1 COCNCc1ccc(cc1)C 1ddbf711bb1fd8e5bb368c453428b7c3 [0,2,0,0,0,0|2,0,0]=4 435 B12R1.1 COCNCc1ccc(cc1)Cl 2d350432a72c42f08586f91f64cfeb55 [0,2,0,0,0,0|2,0,0]=4 436 B12R1.1 COCNCc1ccc(cc1)F 1c3d2fa163bb11a20df738f7c1f91179 [0,2,0,0,0,0|2,0,0]=4 437 B12R1.1 COCNCc1ccc(cc1)I 37d68c073753166fb2f5673ea356dd9f [0,2,0,0,0,0|2,0,0]=4 438 B12R1.1 COCOCc1ccc(cc1)Br 428c0675138106422df59babd0a4742f [0,2,0,0,0,0|2,0,0]=4 439 B12R1.1 COCOCc1ccc(cc1)C 193aa9ab931a6a24231e20923141b26a [0,2,0,0,0,0|2,0,0]=4 440 B12R1.1 COCOCc1ccc(cc1)Cl 8d1220ebec17a1d5ad87d7ecbe17ddba [0,2,0,0,0,0|2,0,0]=4 441 B12R1.1 COCOCc1ccc(cc1)F 837a7f154b9d2ab539edcef32fc8cbf5 [0,2,0,0,0,0|2,0,0]=4 442 B12R1.1 COCOCc1ccc(cc1)I d3b117bbf06fbd5bf254ea112ff039c6 [0,2,0,0,0,0|2,0,0]=4 443 B12R1.1 COCOCc1ccc(cc1)S fff07ccf7efce07c78db73dc16d32001 [0,2,0,0,0,0|2,0,0]=4 444 B12R1.1 Cc1ccc(cc1)CCNCO 8265feb14c5c78ac0b9f16d74e5916ae [0,2,0,0,0,0|0,0,2]=4 445 B12R1.1 Cc1ccc(cc1)CNCCO 47cbe1348c331b475579d0d8d51b73f3 [0,2,0,0,0,0|1,0,1]=4 446 B12R1.1 Cc1ccc(cc1)NC/C=C/Cl afb376b6fcca007582e2f75a71d22b36 [0,2,0,0,0,0|2,0,0]=4 447 B12R1.1 Cc1ccc(cc1)NC/C=C\Cl 25fe5a91c311e0d76e06f15c85278395 [0,2,0,0,0,0|2,0,0]=4 448 B12R1.1 Cc1ccc(cc1)NC/C=C\O b899b4dbc1bf6a01cf4b63732b94b852 [0,2,0,0,0,0|1,0,0]=3 449 B12R1.1 Cc1ccc(cc1)NCCCO 46aa73ad3705fe83d5925f133ae7c772 [0,2,0,0,0,0|1,0,1]=4 450 B12R1.1 Cc1ccc(cc1)OC/C=C/Cl 087556e799e83847f861726031724b08 [0,2,0,0,0,0|2,0,0]=4 451 B12R1.1 Cc1ccc(cc1)OC/C=C\Cl 9a7f9de452c3358fe6687a51ed8d8aad [0,2,0,0,0,0|2,0,0]=4 452 B12R1.1 Cc1ccc(cn1)NC/C=C\O a414f932e420961e10f3ca7af887f57f [0,2,0,0,0,0|2,0,0]=4 453 B12R1.1 Cc1ccc(nc1)NC/C=C\O ec4342552b322ed7cf939e59b381a592 [0,2,0,0,0,0|2,0,0]=4 454 B12R1.1 Cl/C=C/CNc1ccc(cc1)Br e6a0df7e7f9c574a2385d85bc1fb65ea [0,2,0,0,0,0|2,0,0]=4 455 B12R1.1 Cl/C=C/CNc1ccc(cc1)Cl 609d6df7bb384ef29e75982e1de54ecf [0,2,0,0,0,0|2,0,0]=4 456 B12R1.1 Cl/C=C/CNc1ccc(cc1)I c7b7c899a4de07d6b043bab453d4326b [0,2,0,0,0,0|2,0,0]=4 457 B12R1.1 Cl/C=C/COc1ccc(cc1)Br d77259a5cc31ff77abda975928c0dd57 [0,2,0,0,0,0|2,0,0]=4 458 B12R1.1 Cl/C=C/COc1ccc(cc1)Cl 8789bcdddfaff525566f69b3a50b63e2 [0,2,0,0,0,0|2,0,0]=4 459 B12R1.1 Cl/C=C/COc1ccc(cc1)I fd925200912d36b3748d0970766f4a7c [0,2,0,0,0,0|2,0,0]=4 460 B12R1.1 Cl/C=C\CNc1ccc(cc1)Br 3a265a675e58ce6298fcdb4e8c51d05e [0,2,0,0,0,0|2,0,0]=4 461 B12R1.1 Cl/C=C\CNc1ccc(cc1)Cl 1602ac9ca96ae4de13d7bde45b92bd1c [0,2,0,0,0,0|2,0,0]=4 462 B12R1.1 Cl/C=C\CNc1ccc(cc1)I e8d813e2a195f74e30681720c9b50fee [0,2,0,0,0,0|2,0,0]=4 463 B12R1.1 Cl/C=C\COc1ccc(cc1)Br af5e7e10210ec943a85f46f8f38ef231 [0,2,0,0,0,0|2,0,0]=4 464 B12R1.1 Cl/C=C\COc1ccc(cc1)Cl d485ba09875e46995aa6bf1f9e1f3bb3 [0,2,0,0,0,0|2,0,0]=4 465 B12R1.1 Cl/C=C\COc1ccc(cc1)I ab5a51a9349ce4186f35447ad495a56f [0,2,0,0,0,0|2,0,0]=4 466 B12R1.1 Fc1ccc(cc1)NC/C=C/Cl 6039b0803745bd6127e2b108063660b6 [0,2,0,0,0,0|2,0,0]=4 467 B12R1.1 Fc1ccc(cc1)NC/C=C\Cl 036f41855be3a5fed5bd084d3bc26df9 [0,2,0,0,0,0|2,0,0]=4 468 B12R1.1 Fc1ccc(cc1)OC/C=C/Cl ec281a3060c67337660334102c045822 [0,2,0,0,0,0|2,0,0]=4 469 B12R1.1 Fc1ccc(cc1)OC/C=C\Cl 2feaea46ecfe7f8fbf991e35c2d1cdab [0,2,0,0,0,0|2,0,0]=4 470 B12R1.1 O/C=C\CNc1ccc(cc1)Br e101c01b8430bd381e849d06609c1f2c [0,2,0,0,0,0|1,0,0]=3 471 B12R1.1 O/C=C\CNc1ccc(cc1)Cl bce7d45e1a96025dbbae33afabf21e11 [0,2,0,0,0,0|1,0,0]=3 472 B12R1.1 O/C=C\CNc1ccc(cc1)F cf1906e364dc7d332ac52bb1bc065e8e [0,2,0,0,0,0|1,0,0]=3 473 B12R1.1 O/C=C\CNc1ccc(cc1)I 75ff0fd4a636fe93c33b815f0d4de1d4 [0,2,0,0,0,0|1,0,0]=3 474 B12R1.1 O/C=C\CNc1ccc(cc1)S ece71f8e7d8f38db85a2b5018d71825f [0,2,0,0,0,0|1,0,0]=3 475 B12R1.1 O/C=C\CNc1ccc(cn1)Br 45c3144112afea98db4bbf6df2bd41b0 [0,2,0,0,0,0|2,0,0]=4 476 B12R1.1 O/C=C\CNc1ccc(cn1)Cl 880740ad0cbd3807877203cb814a94d9 [0,2,0,0,0,0|2,0,0]=4 477 B12R1.1 O/C=C\CNc1ccc(cn1)F a8da02be58b454ea530caf09155e0206 [0,2,0,0,0,0|2,0,0]=4 478 B12R1.1 O/C=C\CNc1ccc(cn1)I 4401d5dfa43de9cddcc9f64cbedfe1f2 [0,2,0,0,0,0|2,0,0]=4 479 B12R1.1 O/C=C\CNc1ccc(nc1)Br e2d1c41440a1f2f772266194dfd3b6c8 [0,2,0,0,0,0|2,0,0]=4 480 B12R1.1 O/C=C\CNc1ccc(nc1)Cl 55cd1a2a62d87236deb094aa90949876 [0,2,0,0,0,0|2,0,0]=4 481 B12R1.1 O/C=C\CNc1ccc(nc1)F 00caf03fa4a6df82c9edd9b110f56f01 [0,2,0,0,0,0|2,0,0]=4 482 B12R1.1 O/C=C\CNc1ccc(nc1)I 92fcd63da6cff50433c5491e5b38e7cd [0,2,0,0,0,0|2,0,0]=4 483 B12R1.1 O=c1ccc(c[nH]1)NC/C=C\O 7953a29bc9867786705511c186c4931d [0,2,0,0,0,0|2,0,0]=4 484 B12R1.1 OCCCNc1ccc(cc1)Br c7951d3f685379f9502fe06476a8a338 [0,2,0,0,0,0|1,0,1]=4 485 B12R1.1 OCCCNc1ccc(cc1)Cl daf88a5c918ec152659114da1e30ab3c [0,2,0,0,0,0|1,0,1]=4 486 B12R1.1 OCCCNc1ccc(cc1)F f5c38cbd68e54fb5a6696dcdebb82fdd [0,2,0,0,0,0|1,0,1]=4 487 B12R1.1 OCCCNc1ccc(cc1)I 4f547e26d083aba907ed147824b03f37 [0,2,0,0,0,0|1,0,1]=4 488 B12R1.1 OCCCNc1ccc(cc1)S ed2c306a27bfa097af4b417d17f2c1d8 [0,2,0,0,0,0|1,0,1]=4 489 B12R1.1 OCCNCc1ccc(cc1)Br ef6e3fa863da8b0ba7364e1e488bf0ff [0,2,0,0,0,0|1,0,1]=4 490 B12R1.1 OCCNCc1ccc(cc1)Cl 6c37f4b1fbba8d005a13e10baf3e7b47 [0,2,0,0,0,0|1,0,1]=4 491 B12R1.1 OCCNCc1ccc(cc1)F 50a3277b116202ff95f82e2866b4ac22 [0,2,0,0,0,0|1,0,1]=4 492 B12R1.1 OCCNCc1ccc(cc1)I 458e55b24e97288bd9d15144f3597933 [0,2,0,0,0,0|1,0,1]=4 493 B12R1.1 OCNCCc1ccc(cc1)Br 5002fae370904c851fcde267599347c5 [0,2,0,0,0,0|0,0,2]=4 494 B12R1.1 OCNCCc1ccc(cc1)Cl b2f32d28efbf4a7328eb35278d7709ed [0,2,0,0,0,0|0,0,2]=4 495 B12R1.1 OCNCCc1ccc(cc1)F acbd4fb4b98e7917bf59751c1a5767da [0,2,0,0,0,0|0,0,2]=4 496 B12R1.1 OCNCCc1ccc(cc1)I 5ed81d2dff56905aa39a602a1ea05bf7 [0,2,0,0,0,0|0,0,2]=4 497 B12R1.1 Sc1ccc(cc1)NC/C=C/Cl a616421c902c73b03692205647d7efbf [0,2,0,0,0,0|2,0,0]=4 498 B12R1.1 Sc1ccc(cc1)NC/C=C\Cl ccb4cc3225e08a662ac48aacb4c7179e [0,2,0,0,0,0|2,0,0]=4 499 B12R1.1 Sc1ccc(cc1)OC/C=C/Cl d2676386183ec706a4bd020be5a601c1 [0,2,0,0,0,0|2,0,0]=4 500 B12R1.1 Sc1ccc(cc1)OC/C=C\Cl a43c3154597561cf8c3a8c816b669750 [0,2,0,0,0,0|2,0,0]=4 501 B12R1.16 CC(NCO)c1ccc(cc1)Br e264284758536dfc8fd891f61c9a75cc [0,2,0,0,0,0|2,0,0]=4 502 B12R1.16 CC(NCO)c1ccc(cc1)Cl 50ceb9a6f3e8c24248339e2481d8c9af [0,2,0,0,0,0|2,0,0]=4 503 B12R1.16 CC(NCO)c1ccc(cc1)F 23a029e032bb878119d4a3308cec3264 [0,2,0,0,0,0|2,0,0]=4 504 B12R1.16 CC(NCO)c1ccc(cc1)I 5b775b5cd3bc6f45567774a49e261411 [0,2,0,0,0,0|2,0,0]=4 505 B12R1.16 C[C@@H](NCO)c1ccc(cc1)Br c6b6a70a9b2dd44f9426c662be2d9c9c [0,2,0,0,0,0|2,0,0]=4 506 B12R1.16 C[C@@H](NCO)c1ccc(cc1)Cl 277abe0b1b70407116a774272f8f041f [0,2,0,0,0,0|2,0,0]=4 507 B12R1.16 C[C@@H](NCO)c1ccc(cc1)F 3ccc055b9e8bf808e9a760cdb1260a44 [0,2,0,0,0,0|2,0,0]=4 508 B12R1.16 C[C@@H](NCO)c1ccc(cc1)I 2ef404df7004faa0f0c6fdd986814320 [0,2,0,0,0,0|2,0,0]=4 509 B12R1.16 C[C@H](NCO)c1ccc(cc1)Br c112b1ab773d0ee6c20418ed7c378e51 [0,2,0,0,0,0|2,0,0]=4 510 B12R1.16 C[C@H](NCO)c1ccc(cc1)Cl 8aca1f606b786514917b510d66c1fab5 [0,2,0,0,0,0|2,0,0]=4 511 B12R1.16 C[C@H](NCO)c1ccc(cc1)F 223505081048da9ae4e8d6a9b94d01a9 [0,2,0,0,0,0|2,0,0]=4 512 B12R1.16 C[C@H](NCO)c1ccc(cc1)I a08bb1bb1f3e3d6214e12b19fda00f9d [0,2,0,0,0,0|2,0,0]=4 513 B12R1.16 Cc1ccc(cc1)C(C)NCO 6e45f6689dbe224a21e83db0dd19e6de [0,2,0,0,0,0|2,0,0]=4 514 B12R1.16 Cc1ccc(cc1)[C@@H](C)NCO 6ad3623e107a53b7c7c6d36133d94314 [0,2,0,0,0,0|2,0,0]=4 515 B12R1.16 Cc1ccc(cc1)[C@H](C)NCO 3620253068391a97254572594e674572 [0,2,0,0,0,0|2,0,0]=4 516 B12R1.49 CN(CO)Cc1ccc(cc1)Br 5e55a925cd3dce7e6241436ae8c54919 [0,2,0,0,0,0|2,0,0]=4 517 B12R1.49 CN(CO)Cc1ccc(cc1)Cl dab1af0d42fcee1a60d38378d8e8efce [0,2,0,0,0,0|2,0,0]=4 518 B12R1.49 CN(CO)Cc1ccc(cc1)F 7fd3b80fbdb09310d5fe39719fff8ba6 [0,2,0,0,0,0|2,0,0]=4 519 B12R1.49 CN(CO)Cc1ccc(cc1)I 586b1a870616a315f891e0fa55e04ab9 [0,2,0,0,0,0|2,0,0]=4 520 B12R1.49 Cc1ccc(cc1)CN(C)CO ed474c07bd59a560c88e17955d9c9bb2 [0,2,0,0,0,0|2,0,0]=4 521 B12R1.49 O=C(CO)Nc1ccc(cc1)S 1f7438a0d638af8df2912f2825545a62 [0,2,0,0,0,0|2,0,0]=4 522 B12R1.69 Cc1cc(ccc1CNCO)Br b5262abb3bb448acc7cd64a2bd5394b6 [0,2,0,0,0,0|2,0,0]=4 523 B12R1.69 Cc1cc(ccc1CNCO)Cl 9d7944c8f6c0778a3eec81e7a8de213b [0,2,0,0,0,0|2,0,0]=4 524 B12R1.69 Cc1cc(ccc1CNCO)F 71af0c73670348ee21e3da3ace730281 [0,2,0,0,0,0|2,0,0]=4 525 B12R1.69 Cc1ccc(c(c1)C)CNCO 6568206546064b08bc9b0c347bda6279 [0,2,0,0,0,0|2,0,0]=4 526 B12R1.69 Cc1ccc(c(c1)Cl)CNCO 04ecaf9cc9a5d84a1ea48d1c4d6e12a6 [0,2,0,0,0,0|2,0,0]=4 527 B12R1.69 Cc1ccc(c(c1)F)CNCO 9d706a2cd13c6c67ae28447836e6c180 [0,2,0,0,0,0|2,0,0]=4 528 B12R1.69 OCNCc1ccc(cc1Br)Cl 815c9a70e286cde88295a55c9f805913 [0,2,0,0,0,0|2,0,0]=4 529 B12R1.69 OCNCc1ccc(cc1Br)F 9267ce581868318934da537d19738847 [0,2,0,0,0,0|2,0,0]=4 530 B12R1.69 OCNCc1ccc(cc1Cl)Br 69a1c66dc3fc6cbee4f7f1ca279db716 [0,2,0,0,0,0|2,0,0]=4 531 B12R1.69 OCNCc1ccc(cc1Cl)Cl 4a1069f2b52cf5e3f1817f20965e1903 [0,2,0,0,0,0|2,0,0]=4 532 B12R1.69 OCNCc1ccc(cc1Cl)F b5982956c4c70e23546c88ab9fd70851 [0,2,0,0,0,0|2,0,0]=4 533 B12R1.69 OCNCc1ccc(cc1F)Br 386ffe38e08cad461a1f56970b5add82 [0,2,0,0,0,0|2,0,0]=4 534 B12R1.69 OCNCc1ccc(cc1F)Cl 114861e1ea1d42ed13738664faec901a [0,2,0,0,0,0|2,0,0]=4 535 B12R1.69 OCNCc1ccc(cc1F)F c55cc56b5ff1e4e6279d18f968748b4d [0,2,0,0,0,0|2,0,0]=4 536 B12R1.69 OCNCc1ccc(cc1F)I 7d2377794a0c7e5ffa504941e9d9e161 [0,2,0,0,0,0|2,0,0]=4 537 B12R1.69 OCNCc1ccc(cc1I)Br 464a81a2d0274b9ca3bec8a1b3904757 [0,2,0,0,0,0|2,0,0]=4 538 B12R1.71 C#Cc1ccc(cc1)CNCO f9bad6c2828b67eb2a94c7c04d7afe72 [0,2,0,0,0,0|2,0,0]=4 539 B12R1.71 C=Cc1ccc(cc1)CNCO 326767c21a5bb3b7de832c31b7eb1a60 [0,2,0,0,0,0|2,0,0]=4 540 B12R1.71 CCc1ccc(cc1)CNCO d6ef08e38bce48d4f302ca698d60897e [0,2,0,0,0,0|2,0,0]=4 541 B12R1.71 COc1ccc(cc1)CNCO 020083af321719f38499e8685d6c62a9 [0,2,0,0,0,0|2,0,0]=4 542 B12R1.71 CSc1ccc(cc1)CNCO 21c910e00e59dfce91d7cb8102e1f3e3 [0,2,0,0,0,0|2,0,0]=4 543 B12R1.71 N#Cc1ccc(cc1)CNCO f733af124537525092c09e9c21692920 [0,2,0,0,0,0|2,0,0]=4 544 B12R1.71 OCNCc1ccc(cc1)CBr 775c3a84add9f73bdaed8c36ad56a2fa [0,2,0,0,0,0|2,0,0]=4 545 B12R1.71 OCNCc1ccc(cc1)CO ab7772b5724a111aac3e4bb689bb54af [0,2,0,0,0,0|2,0,0]=4 546 B12R1.385 Cc1cc(ccc1Br)CNCO c56ce5a1fc1ceb5be6240230211068ad [0,2,0,0,0,0|2,0,0]=4 547 B12R1.385 Cc1cc(ccc1F)CNCO de991edbed35f8ed90030174fe8accb5 [0,2,0,0,0,0|2,0,0]=4 548 B12R1.385 Cc1cc(ccc1I)CNCO 7c7822f088bfb532fcae0cd452c703a6 [0,2,0,0,0,0|2,0,0]=4 549 B12R1.385 Cc1ccc(cc1Br)CNCO 19fc36a91b6d0f20f820cf8832794fdc [0,2,0,0,0,0|2,0,0]=4 550 B12R1.385 Cc1ccc(cc1C)CNCO 9706adcb8ba7471baf48c88ab34a91d3 [0,2,0,0,0,0|2,0,0]=4 551 B12R1.385 Cc1ccc(cc1Cl)CNCO ccd03226186b0581c80ef6a372052a96 [0,2,0,0,0,0|2,0,0]=4 552 B12R1.385 Cc1ccc(cc1F)CNCO 5a7a5c25d3650b601fee5c9400688dd9 [0,2,0,0,0,0|2,0,0]=4 553 B12R1.385 OCNCc1ccc(c(c1)Br)Br 3b0f29fe4167a4a0c943bf45dc356521 [0,2,0,0,0,0|2,0,0]=4 554 B12R1.385 OCNCc1ccc(c(c1)Br)Cl 055ae5fe8b1cf787263e8129b7bfffee [0,2,0,0,0,0|2,0,0]=4 555 B12R1.385 OCNCc1ccc(c(c1)Br)F 7dd7f858a38241b5829dea12ea5cdf80 [0,2,0,0,0,0|2,0,0]=4 556 B12R1.385 OCNCc1ccc(c(c1)Cl)Br 6093e25c7f44bdd79751c57b91eb93ad [0,2,0,0,0,0|2,0,0]=4 557 B12R1.385 OCNCc1ccc(c(c1)Cl)Cl 39eb0f8d7e0ab581139ac1c53ac09a85 [0,2,0,0,0,0|2,0,0]=4 558 B12R1.385 OCNCc1ccc(c(c1)Cl)F 573730d1aa1ec5c9e0a8536c62259ffb [0,2,0,0,0,0|2,0,0]=4 559 B12R1.385 OCNCc1ccc(c(c1)F)Br b75804bdfe0c25e0d3f6eb6172eb3c84 [0,2,0,0,0,0|2,0,0]=4 560 B12R1.385 OCNCc1ccc(c(c1)F)Cl 467342303de6bbfcdb783093159423a5 [0,2,0,0,0,0|2,0,0]=4 561 B12R1.385 OCNCc1ccc(c(c1)F)F 01c0919e47354f73a697d72aa0887700 [0,2,0,0,0,0|2,0,0]=4 562 B12R1.385 OCNCc1ccc(c(c1)F)I 93a19fef3188c59b8d32548de6e8554a [0,2,0,0,0,0|2,0,0]=4 563 B12R1.3 C=CC(NCO)c1ccccc1 059bf4cd23c9defe529348afd9ac29e4 [0,2,0,0,0,0|2,0,0]=4 564 B12R1.3 C=C[C@@H](NCO)c1ccccc1 0443a692877053ff1e1a5a26e535fa7f [0,2,0,0,0,0|2,0,0]=4 565 B12R1.3 C=C[C@H](NCO)c1ccccc1 971121604f82db695e04bc0173604a06 [0,2,0,0,0,0|2,0,0]=4 566 B12R1.3 CCC(NCO)c1ccccc1 162ffd02e2794d38a2def38bde94ce3c [0,2,0,0,0,0|2,0,0]=4 567 B12R1.3 CC[C@@H](NCO)c1ccccc1 5d84ee4f86f004e922a53c121ca41963 [0,2,0,0,0,0|2,0,0]=4 568 B12R1.3 CC[C@H](NCO)c1ccccc1 d12bfbd0d9ffd6d724b18eeafaa4d3ef [0,2,0,0,0,0|2,0,0]=4 569 B12R1.3 N#CC(NCO)c1ccccc1 3a25592688f62e9e2e1c0aa1965a0e6e [0,2,0,0,0,0|2,0,0]=4 570 B12R1.3 OCNC(CO)c1ccccc1 a3cd377c07e89cc8008c00850413e2fa [0,2,0,0,0,0|2,0,0]=4 571 B12R1.3 OCN[C@@H](CF)c1ccccc1 c48dbb78e8705925b437f732da4df883 [0,2,0,0,0,0|2,0,0]=4 572 B12R1.3 OCN[C@@H](CO)c1ccccc1 47e5ec93da6df8b6056499be137dbc47 [0,2,0,0,0,0|2,0,0]=4 573 B12R1.3 OCN[C@H](CO)c1ccccc1 a68f9bf02ebd1849a27bc4bc05035ca2 [0,2,0,0,0,0|2,0,0]=4 574 B12R1.17 CC(NCO)c1cccc(c1)Br 922e64f914a2d632d7487974626feb20 [0,2,0,0,0,0|2,0,0]=4 575 B12R1.17 CC(NCO)c1cccc(c1)Cl 73fe839960baaaa01e59634dd685dbb1 [0,2,0,0,0,0|2,0,0]=4 576 B12R1.17 CC(NCO)c1cccc(c1)F f0652a3f82e27702014e62d0566a1de9 [0,2,0,0,0,0|2,0,0]=4 577 B12R1.17 C[C@@H](NCO)c1cccc(c1)Br f4e23e99bc0af39389f5e820105091c6 [0,2,0,0,0,0|2,0,0]=4 578 B12R1.17 C[C@@H](NCO)c1cccc(c1)Cl 66919fef6442a963feb11c547bf0f444 [0,2,0,0,0,0|2,0,0]=4 579 B12R1.17 C[C@@H](NCO)c1cccc(c1)F af0a186842d46dc3d160d1d73b074e17 [0,2,0,0,0,0|2,0,0]=4 580 B12R1.17 C[C@H](NCO)c1cccc(c1)Br 7ca4ed875cb62977d0b3495961086da4 [0,2,0,0,0,0|2,0,0]=4 581 B12R1.17 C[C@H](NCO)c1cccc(c1)Cl 4a94abc52fcba40074ffa13791de35e2 [0,2,0,0,0,0|2,0,0]=4 582 B12R1.17 C[C@H](NCO)c1cccc(c1)F 26286d84a69bcd3442b2384f5cacf4e4 [0,2,0,0,0,0|2,0,0]=4 583 B12R1.17 C[C@H](NCO)c1cccc(c1)I 427d824bfdf0564f5453d07d6cb7fc73 [0,2,0,0,0,0|2,0,0]=4 584 B12R1.17 Cc1cccc(c1)C(C)NCO 484ffc2c296fe00c0d77539815bedf5c [0,2,0,0,0,0|2,0,0]=4 585 B12R1.17 Cc1cccc(c1)[C@@H](C)NCO 63ebfbb9109d04da9ae1a8c4632dbbee [0,2,0,0,0,0|2,0,0]=4 586 B12R1.17 Cc1cccc(c1)[C@H](C)NCO 815974376dfce3e8219bd556a1e15106 [0,2,0,0,0,0|2,0,0]=4 587 B12R1.30 C/C=C/CN(C)c1ccccc1 6aca716f56cd50a3277e1a725da6237c [0,2,0,0,0,0|2,0,0]=4 588 B12R1.30 C/C=C\CN(C)c1ccccc1 bf0cb6abe4ab1c9a8756fb864f282d12 [0,2,0,0,0,0|2,0,0]=4 589 B12R1.30 CC(CNCO)c1ccccc1 462ae9832b5de19cce882c0427ce8c7b [0,2,0,0,0,0|0,0,2]=4 590 B12R1.30 CC(NCCO)c1ccccc1 15ebe2893003a0c55ecacb3da2e2c5b8 [0,2,0,0,0,0|1,0,1]=4 591 B12R1.30 CN(C/C=C/Cl)c1ccccc1 a5c5c9e7990707ebd7d1846363494855 [0,2,0,0,0,0|2,0,0]=4 592 B12R1.30 CN(C/C=C\Cl)c1ccccc1 cb8ec4d5dcd9d90c0da8eb81b2b93b42 [0,2,0,0,0,0|2,0,0]=4 593 B12R1.30 CN(C/C=C\O)c1ccccc1 5869f46023496a4fc7e5076d759ace60 [0,2,0,0,0,0|1,0,0]=3 594 B12R1.30 CN(C/C=C\O)c1ccccn1 5d288e54e31671453a0cfe8667ff28ea [0,2,0,0,0,0|2,0,0]=4 595 B12R1.30 CN(C/C=C\O)c1cccnc1 e16ec59fa2f1633a17cad22b91500e7a [0,2,0,0,0,0|2,0,0]=4 596 B12R1.30 CN(C/C=C\O)c1ccncc1 914360440eebc2d37e350fbbd75f544e [0,2,0,0,0,0|2,0,0]=4 597 B12R1.30 CN(CCCO)c1ccccc1 99b9f18cd67ae7ad12fedc7e34599859 [0,2,0,0,0,0|1,0,1]=4 598 B12R1.30 COCNC(C)c1ccccc1 da3a97833b329d52bf380d21525de137 [0,2,0,0,0,0|2,0,0]=4 599 B12R1.30 COCN[C@@H](C)c1ccccc1 b0afc671726e2aa3bbf25811f588d87b [0,2,0,0,0,0|2,0,0]=4 600 B12R1.30 COCN[C@H](C)c1ccccc1 9e08f5d5391d04ef9dca8846d7c418b1 [0,2,0,0,0,0|2,0,0]=4 601 B12R1.30 COCOC(C)c1ccccc1 0b1f9c9cdb2cc63a37919c47ba14afe7 [0,2,0,0,0,0|2,0,0]=4 602 B12R1.30 COCO[C@@H](C)c1ccccc1 4f223b91f36fa3bfe971e90568b0e3b0 [0,2,0,0,0,0|2,0,0]=4 603 B12R1.30 COCO[C@H](C)c1ccccc1 ba83963d37e25f49896a3a9bad50ab4f [0,2,0,0,0,0|2,0,0]=4 604 B12R1.30 C[C@@H](CNCO)c1ccccc1 742ee8e739f2ff7dbfa020bf6612568d [0,2,0,0,0,0|0,0,2]=4 605 B12R1.30 C[C@@H](NCCO)c1ccccc1 4d75c0848045c856d6629664b5c37bb2 [0,2,0,0,0,0|1,0,1]=4 606 B12R1.30 C[C@H](CNCO)c1ccccc1 348e8a14ee3f664d50cb7fb06a3ca693 [0,2,0,0,0,0|0,0,2]=4 607 B12R1.30 C[C@H](NCCO)c1ccccc1 1afbfcd53073af538ea2805bff509aa6 [0,2,0,0,0,0|1,0,1]=4 608 B12R1.30 O=C(CNCO)c1ccccc1 1f6ea0716cbea011ade59a66de8cfc95 [0,2,0,0,0,0|2,0,0]=4 609 B12R1.30 OCNCC(O)c1ccccc1 a1873e0f542e845030155bc61f7ab033 [0,2,0,0,0,0|0,0,2]=4 610 B12R1.30 OCNC[C@@H](O)c1ccccc1 6b625a35862ee45205a70adf222a9a23 [0,2,0,0,0,0|0,0,2]=4 611 B12R1.30 OCNC[C@H](O)c1ccccc1 a19c64470da13d711a93a5da873610b8 [0,2,0,0,0,0|0,0,2]=4 612 B12R1.34 CN(C(=O)CO)c1ccccc1 92a87ead36fd016ea91f9e7ab45bfb02 [0,2,0,0,0,0|2,0,0]=4 613 B12R1.39 CC(C)(NCO)c1ccccc1 fb4c7e5860e9a5887317ede564ff1468 [0,2,0,0,0,0|2,0,0]=4 614 B12R1.308 CC(NCO)c1ccccc1Cl 1f0c401b4ac09588d0873e8556a15d9b [0,2,0,0,0,0|2,0,0]=4 615 B12R1.308 CC(NCO)c1ccccc1F f8af624e28cef3667af96d9d540bf774 [0,2,0,0,0,0|2,0,0]=4 616 B12R1.308 CC(NCO)c1ccccc1I 38352b05097a6498f9c6f5e041497e5f [0,2,0,0,0,0|2,0,0]=4 617 B12R1.308 C[C@@H](NCO)c1ccccc1Cl 68a5f9299e56d3cba8de039d6c35a0ca [0,2,0,0,0,0|2,0,0]=4 618 B12R1.308 C[C@@H](NCO)c1ccccc1F b0e26e577d860ef89a5b9152b45e88a6 [0,2,0,0,0,0|2,0,0]=4 619 B12R1.308 C[C@H](NCO)c1ccccc1Cl 6721150152565c45045c8d7226931c07 [0,2,0,0,0,0|2,0,0]=4 620 B12R1.308 C[C@H](NCO)c1ccccc1F 843364a70a090624fe16305422e066fd [0,2,0,0,0,0|2,0,0]=4 621 B12R1.308 Cc1ccccc1C(C)NCO 6c3894b72e4dae93ee5dc306d60ad36c [0,2,0,0,0,0|2,0,0]=4 622 B12R1.308 Cc1ccccc1[C@@H](C)NCO b8dd4b9d69a2c456fde4fd3e7fd35a7b [0,2,0,0,0,0|2,0,0]=4 623 B12R1.308 Cc1ccccc1[C@H](C)NCO 7e8be47cb87e472d5897ef53423fefc4 [0,2,0,0,0,0|2,0,0]=4 624 B12R1.25 Cc1c(cccc1CNCO)Br 8b3eeee87f6d90a8f5dee362867713cd [0,2,0,0,0,0|2,0,0]=4 625 B12R1.25 Cc1c(cccc1CNCO)Cl cc29faf4fe02a330e768864a08f80dd1 [0,2,0,0,0,0|2,0,0]=4 626 B12R1.25 Cc1c(cccc1CNCO)F 37135411cbfa8c201ade6464c814e270 [0,2,0,0,0,0|2,0,0]=4 627 B12R1.25 Cc1cccc(c1Br)CNCO ab5ae6d1916ac950aa556baf9bd1db5b [0,2,0,0,0,0|2,0,0]=4 628 B12R1.25 Cc1cccc(c1C)CNCO 27ef957211ecd93964ecefd27153a30d [0,2,0,0,0,0|2,0,0]=4 629 B12R1.25 Cc1cccc(c1Cl)CNCO 4245d4de51ecda82132bd4a58ecb332c [0,2,0,0,0,0|2,0,0]=4 630 B12R1.25 Cc1cccc(c1F)CNCO f6e7268a482c8db9e674e0604c622c06 [0,2,0,0,0,0|2,0,0]=4 631 B12R1.25 OCNCc1cccc(c1Br)F 18500f15f5edbfa4f40f0604a087ad79 [0,2,0,0,0,0|2,0,0]=4 632 B12R1.25 OCNCc1cccc(c1Br)I 254f0cd95b3b4caea75e79b9bb3d4a16 [0,2,0,0,0,0|2,0,0]=4 633 B12R1.25 OCNCc1cccc(c1Cl)Br dfdaba88837890d4cbad8954c41ec397 [0,2,0,0,0,0|2,0,0]=4 634 B12R1.25 OCNCc1cccc(c1Cl)Cl d23ec505b55d77a62ce04da535a71f0a [0,2,0,0,0,0|2,0,0]=4 635 B12R1.25 OCNCc1cccc(c1Cl)F 00a41169f8100f65f51236c596892caf [0,2,0,0,0,0|2,0,0]=4 636 B12R1.25 OCNCc1cccc(c1Cl)I f7b79799a7dee59c30e14ce02e86c4d8 [0,2,0,0,0,0|2,0,0]=4 637 B12R1.25 OCNCc1cccc(c1F)Br 2d64ad1714e7c1281e37c932a489f7d9 [0,2,0,0,0,0|2,0,0]=4 638 B12R1.25 OCNCc1cccc(c1F)Cl b822b23b6fef2702268319527cf8b7a0 [0,2,0,0,0,0|2,0,0]=4 639 B12R1.25 OCNCc1cccc(c1F)F 6d45dd48a848800bf500795c981701bc [0,2,0,0,0,0|2,0,0]=4 640 B12R1.121 CCc1ccccc1CNCO d0a12f6c4e39d47ce3a43aa1421b95b2 [0,2,0,0,0,0|2,0,0]=4 641 B12R1.121 COc1ccccc1CNCO 34f4426dd7db36c67f879aa2b90e6c86 [0,2,0,0,0,0|2,0,0]=4 642 B12R1.121 CSc1ccccc1CNCO 265d8f61796628c305a25e58298249d1 [0,2,0,0,0,0|2,0,0]=4 643 B12R1.121 N#Cc1ccccc1CNCO 2ba845e1c563afb656d173f76d1c2781 [0,2,0,0,0,0|2,0,0]=4 644 B12R1.121 OCNCc1ccccc1CO f82d4a101aa24955fdf8220b83258447 [0,2,0,0,0,0|2,0,0]=4 645 B12R1.267 C/C=C/CNc1ccccc1Br 1b1907df2d5024aed3e5fa69aedb3399 [0,2,0,0,0,0|2,0,0]=4 646 B12R1.267 C/C=C/CNc1ccccc1C 99bc8a92ed1ace18679e2408606f3364 [0,2,0,0,0,0|2,0,0]=4 647 B12R1.267 C/C=C/CNc1ccccc1Cl 6b5a5b022e1d490dd80391bad8af9890 [0,2,0,0,0,0|2,0,0]=4 648 B12R1.267 C/C=C/CNc1ccccc1F 6722666f90dcd08cc17b2edda7c201e3 [0,2,0,0,0,0|2,0,0]=4 649 B12R1.267 C/C=C/CNc1ccccc1I 49dad7c25cffd7a1fc830aed30c417c9 [0,2,0,0,0,0|2,0,0]=4 650 B12R1.267 C/C=C/CNc1ccccc1S 2374179c00abf478a6f20c040c57b480 [0,2,0,0,0,0|2,0,0]=4 651 B12R1.267 C/C=C/COc1ccccc1C dce1e2cf7549461e4472af0213bfe590 [0,2,0,0,0,0|2,0,0]=4 652 B12R1.267 C/C=C/COc1ccccc1Cl d7378b9e9abba0a516538c31d2b8033d [0,2,0,0,0,0|2,0,0]=4 653 B12R1.267 C/C=C/COc1ccccc1F 3adf23b88e5fc6bf280a6f9579e77e44 [0,2,0,0,0,0|2,0,0]=4 654 B12R1.267 C/C=C/COc1ccccc1I 3368be493448c94e00511e02f941b571 [0,2,0,0,0,0|2,0,0]=4 655 B12R1.267 C/C=C/COc1ccccc1S b9a37410f6aada9716682d52f755badd [0,2,0,0,0,0|2,0,0]=4 656 B12R1.267 C/C=C\CNc1ccccc1Br 66999467e4d202b0e15ddedfc78c2c39 [0,2,0,0,0,0|2,0,0]=4 657 B12R1.267 C/C=C\CNc1ccccc1C 68ea7ffbacfbcab8c5090428fecdfc68 [0,2,0,0,0,0|2,0,0]=4 658 B12R1.267 C/C=C\CNc1ccccc1Cl efe45a207a9960139db5dd6e97826898 [0,2,0,0,0,0|2,0,0]=4 659 B12R1.267 C/C=C\CNc1ccccc1F ff86ec72e49dcd55ae6b06c76cc6d890 [0,2,0,0,0,0|2,0,0]=4 660 B12R1.267 C/C=C\CNc1ccccc1I a7e533e5c4109b914c88f4a015f80ae5 [0,2,0,0,0,0|2,0,0]=4 661 B12R1.267 C/C=C\CNc1ccccc1S 9e74280189a63b197c9248a0ace6ec62 [0,2,0,0,0,0|2,0,0]=4 662 B12R1.267 C/C=C\COc1ccccc1C ce1881f33dc4a07b3ef4b747164c5783 [0,2,0,0,0,0|2,0,0]=4 663 B12R1.267 C/C=C\COc1ccccc1Cl 10e650f8590a3ac746945d840030f3ed [0,2,0,0,0,0|2,0,0]=4 664 B12R1.267 C/C=C\COc1ccccc1F 41a2eda3fc726edc1e07bdca36b547c4 [0,2,0,0,0,0|2,0,0]=4 665 B12R1.267 C/C=C\COc1ccccc1I 7e2bb55094599bb6417c21b0ceb863ff [0,2,0,0,0,0|2,0,0]=4 666 B12R1.267 C/C=C\COc1ccccc1S dc45afdce48633a6e4e7fef97f503194 [0,2,0,0,0,0|2,0,0]=4 667 B12R1.267 CC=CCNc1ccccc1C 6c625ce9f8fd51bea675332d8ecee0b4 [0,2,0,0,0,0|2,0,0]=4 668 B12R1.267 CC=CCNc1ccccc1F e8f3a2326d77bcea4cf09a84df5021da [0,2,0,0,0,0|2,0,0]=4 669 B12R1.267 CC=CCNc1ccccc1S a4a486a387cb1ddad9a45b70356617a7 [0,2,0,0,0,0|2,0,0]=4 670 B12R1.267 COCNCc1ccccc1Br b237780edc7e0e7084c58a3782b8f3d4 [0,2,0,0,0,0|2,0,0]=4 671 B12R1.267 COCNCc1ccccc1C 0cee05accc446e8ea1175470ca772094 [0,2,0,0,0,0|2,0,0]=4 672 B12R1.267 COCNCc1ccccc1Cl 462467d30ed83a7699177d39d3791eb2 [0,2,0,0,0,0|2,0,0]=4 673 B12R1.267 COCNCc1ccccc1F ccf1619ef238a69fb648cb5390ba9858 [0,2,0,0,0,0|2,0,0]=4 674 B12R1.267 COCNCc1ccccc1I cbb778473389aa3adf4240ac9b0e4733 [0,2,0,0,0,0|2,0,0]=4 675 B12R1.267 COCOCc1ccccc1Br bfa4b5bd5970ee9c9b7435f6cb7658a4 [0,2,0,0,0,0|2,0,0]=4 676 B12R1.267 COCOCc1ccccc1C 72d2b2b099b7f2ec40fa5e1d9474c39e [0,2,0,0,0,0|2,0,0]=4 677 B12R1.267 COCOCc1ccccc1Cl 69343f28b8b2c88962ef03b7c8399d31 [0,2,0,0,0,0|2,0,0]=4 678 B12R1.267 COCOCc1ccccc1F eebdc39702ad7fc25bd356221ffea205 [0,2,0,0,0,0|2,0,0]=4 679 B12R1.267 COCOCc1ccccc1I 0eda0999da600bcd5be24d5bcde342f9 [0,2,0,0,0,0|2,0,0]=4 680 B12R1.267 COCOCc1ccccc1S ac5a2c9358d2dfcc9af283f6bdd670ac [0,2,0,0,0,0|2,0,0]=4 681 B12R1.267 Cc1ccccc1CNCCO 91e2522e5fd17c1e59cb7a4547ef3a2a [0,2,0,0,0,0|1,0,1]=4 682 B12R1.267 Cc1ccccc1NC/C=C/Cl 76b6e6caa9d31ea263ed285f901eb563 [0,2,0,0,0,0|2,0,0]=4 683 B12R1.267 Cc1ccccc1NC/C=C\Cl af5a7fdc2ac8bfd15810a141bdf29d09 [0,2,0,0,0,0|2,0,0]=4 684 B12R1.267 Cc1ccccc1NC/C=C\O e209ed49eeb2421b7d0894c2af288847 [0,2,0,0,0,0|1,0,0]=3 685 B12R1.267 Cc1ccccc1NCCCO 5cbc6801488d8693795187d1801221e4 [0,2,0,0,0,0|1,0,1]=4 686 B12R1.267 Cc1ccccc1OC/C=C/Cl 6d75ead4efabd09d208cb4b128a66ac1 [0,2,0,0,0,0|2,0,0]=4 687 B12R1.267 Cc1ccccc1OC/C=C\Cl 3bddba132224f29245a95416191a087a [0,2,0,0,0,0|2,0,0]=4 688 B12R1.267 Cc1cccnc1NC/C=C\O 060e086f8d98b139995a3f8497e7df9e [0,2,0,0,0,0|2,0,0]=4 689 B12R1.267 Cc1ccncc1NC/C=C\O 672eb1d8dfdac0b2a8aa23da305d48b1 [0,2,0,0,0,0|2,0,0]=4 690 B12R1.267 Cc1cnccc1NC/C=C\O 0324a7a5eccf5595a3560b8d5b072b79 [0,2,0,0,0,0|2,0,0]=4 691 B12R1.267 Cc1ncccc1NC/C=C\O 3ebb1e2acb1383fce327db99acb4ae32 [0,2,0,0,0,0|2,0,0]=4 692 B12R1.267 Cl/C=C/CNc1ccccc1Br 12e1feadf773adb725a368b6089f1241 [0,2,0,0,0,0|2,0,0]=4 693 B12R1.267 Cl/C=C/CNc1ccccc1Cl 42d619b43639270ce8cbbd97885a5cb3 [0,2,0,0,0,0|2,0,0]=4 694 B12R1.267 Cl/C=C/CNc1ccccc1I 8e4862db41510430f8e10715db71d64e [0,2,0,0,0,0|2,0,0]=4 695 B12R1.267 Cl/C=C/COc1ccccc1Cl b9d41e4e2f4792a9f40f3a2107f1dcae [0,2,0,0,0,0|2,0,0]=4 696 B12R1.267 Cl/C=C/COc1ccccc1I 5210725dde99ffe54854a5a93cd1c278 [0,2,0,0,0,0|2,0,0]=4 697 B12R1.267 Cl/C=C\CNc1ccccc1Br ced5b974e1910e9bd8eb6fe0ee893397 [0,2,0,0,0,0|2,0,0]=4 698 B12R1.267 Cl/C=C\CNc1ccccc1Cl 15f00c3e98b9a77f3044e3316a571f56 [0,2,0,0,0,0|2,0,0]=4 699 B12R1.267 Cl/C=C\CNc1ccccc1I e55bc0f6d32e048ad015dc858584d9ac [0,2,0,0,0,0|2,0,0]=4 700 B12R1.267 Cl/C=C\COc1ccccc1Cl bbfbb73882463a25ba9d21410f027dc3 [0,2,0,0,0,0|2,0,0]=4 701 B12R1.267 Cl/C=C\COc1ccccc1I 8d57d5ebe697f0df340336f620e7ae7f [0,2,0,0,0,0|2,0,0]=4 702 B12R1.267 Fc1ccccc1NC/C=C/Cl e99759bf818e74ef09275c7a9b53dc36 [0,2,0,0,0,0|2,0,0]=4 703 B12R1.267 Fc1ccccc1NC/C=C\Cl 5a574e7c191e83b92b66844622e8447b [0,2,0,0,0,0|2,0,0]=4 704 B12R1.267 Fc1ccccc1OC/C=C/Cl 70c0b161578acfc895ade5c84e0c01e7 [0,2,0,0,0,0|2,0,0]=4 705 B12R1.267 Fc1ccccc1OC/C=C\Cl db655e67673f8530658ae8420516129f [0,2,0,0,0,0|2,0,0]=4 706 B12R1.267 O/C=C\CNc1ccc[nH]c1=S b66273cdda2e15600bfce80d84a1bf6e [0,2,0,0,0,0|2,0,0]=4 707 B12R1.267 O/C=C\CNc1ccccc1Br 151d48ca077c17d99da1018ba6a9ff04 [0,2,0,0,0,0|1,0,0]=3 708 B12R1.267 O/C=C\CNc1ccccc1Cl 3c04860e1fa1e2ac351e9eae2bb8da83 [0,2,0,0,0,0|1,0,0]=3 709 B12R1.267 O/C=C\CNc1ccccc1F 7a7a251cc027eed63884331e6e270d29 [0,2,0,0,0,0|1,0,0]=3 710 B12R1.267 O/C=C\CNc1ccccc1I eac9f7894b75a8eb226955e2488dea22 [0,2,0,0,0,0|1,0,0]=3 711 B12R1.267 O/C=C\CNc1ccccc1S 10563d129e1a011b72cd9ce72d6ca07d [0,2,0,0,0,0|1,0,0]=3 712 B12R1.267 O/C=C\CNc1cccnc1Br cece5a1b124f85a3fc23d90c26900bcd [0,2,0,0,0,0|2,0,0]=4 713 B12R1.267 O/C=C\CNc1cccnc1Cl 63b30e2b4a10cf05b083c5cd00ca2d28 [0,2,0,0,0,0|2,0,0]=4 714 B12R1.267 O/C=C\CNc1cccnc1F 614899d14126db8e4d60a45369a15c9a [0,2,0,0,0,0|2,0,0]=4 715 B12R1.267 O/C=C\CNc1cccnc1I b6d84ca19e4b3ce664657730665bdfd6 [0,2,0,0,0,0|2,0,0]=4 716 B12R1.267 O/C=C\CNc1ccncc1Br 7d33e304c5ba9269b8446155011bd76f [0,2,0,0,0,0|2,0,0]=4 717 B12R1.267 O/C=C\CNc1ccncc1Cl 456766d00b1af6480e6d3fd0d56be813 [0,2,0,0,0,0|2,0,0]=4 718 B12R1.267 O/C=C\CNc1ccncc1F 39b22c7f50e3e7d9bb7fd57c7b6e766e [0,2,0,0,0,0|2,0,0]=4 719 B12R1.267 O/C=C\CNc1ccncc1I a8e03ebae85de5cfe9badf7c3946e845 [0,2,0,0,0,0|2,0,0]=4 720 B12R1.267 O/C=C\CNc1cnccc1Br 0f54d3054844dad3708811cb9f6c2cdd [0,2,0,0,0,0|2,0,0]=4 721 B12R1.267 O/C=C\CNc1cnccc1Cl 92893bb8dede35d93746ccdbad49f58f [0,2,0,0,0,0|2,0,0]=4 722 B12R1.267 O/C=C\CNc1cnccc1F 98312df201bb3bceff409b9de70ecb5e [0,2,0,0,0,0|2,0,0]=4 723 B12R1.267 O/C=C\CNc1cnccc1I 01fd7fdaf6b4242aae275fb9e3300608 [0,2,0,0,0,0|2,0,0]=4 724 B12R1.267 O/C=C\CNc1cnccc1S 1c1101383dbcee877d6117f7d86543c4 [0,2,0,0,0,0|2,0,0]=4 725 B12R1.267 O/C=C\CNc1ncccc1Br 3574b72f34cf5a33ff185584073f9d88 [0,2,0,0,0,0|2,0,0]=4 726 B12R1.267 O/C=C\CNc1ncccc1Cl 6a23b8d8a6dc2236bbeeed8aab231ec4 [0,2,0,0,0,0|2,0,0]=4 727 B12R1.267 O/C=C\CNc1ncccc1F 9d0854d2239e2fcb5196dbba66e34a72 [0,2,0,0,0,0|2,0,0]=4 728 B12R1.267 O/C=C\CNc1ncccc1I f0425ecce226149606cc1c38a20ddae2 [0,2,0,0,0,0|2,0,0]=4 729 B12R1.267 OCCCNc1ccccc1Cl 784289199eb1f667fd138e273b3055b8 [0,2,0,0,0,0|1,0,1]=4 730 B12R1.267 OCCCNc1ccccc1F dfcb9423e658f0892e1b586f7749e7a5 [0,2,0,0,0,0|1,0,1]=4 731 B12R1.267 OCCCNc1ccccc1I 9885e0c34ab73fc7eab6f3f5b8cd97c3 [0,2,0,0,0,0|1,0,1]=4 732 B12R1.267 OCCCNc1ccccc1S 4466a2e5214efe662657c1ef38d6a56d [0,2,0,0,0,0|1,0,1]=4 733 B12R1.267 OCCNCc1ccccc1Br df94d6734ac0f560fb360e39dd4b947e [0,2,0,0,0,0|1,0,1]=4 734 B12R1.267 OCCNCc1ccccc1Cl 3a5befb779e389def207bf8ccccf3eb8 [0,2,0,0,0,0|1,0,1]=4 735 B12R1.267 OCCNCc1ccccc1F ed939a7a48266a2f41cc5e4f1e741af5 [0,2,0,0,0,0|1,0,1]=4 736 B12R1.267 OCCNCc1ccccc1I ae82480090df47b9736b4a586b9e66c7 [0,2,0,0,0,0|1,0,1]=4 737 B12R1.267 OCNCCc1ccccc1Cl 1b84a7a1568849a05b57068c3918906a [0,2,0,0,0,0|0,0,2]=4 738 B12R1.267 OCNCCc1ccccc1F eb3b5d5f729061dd7d0426963bb11f7c [0,2,0,0,0,0|0,0,2]=4 739 B12R1.267 Sc1ccccc1NC/C=C/Cl 022c2d3c42d6980837cc935e49f88ced [0,2,0,0,0,0|2,0,0]=4 740 B12R1.267 Sc1ccccc1NC/C=C\Cl 5bf70705b33075687f1f8f3651f05673 [0,2,0,0,0,0|2,0,0]=4 741 B12R1.267 Sc1ccccc1OC/C=C/Cl f691735f61d0d8f74427839ee977f4c2 [0,2,0,0,0,0|2,0,0]=4 742 B12R1.267 Sc1ccccc1OC/C=C\Cl ad21be07d517592bcd2b60fb68c8b29f [0,2,0,0,0,0|2,0,0]=4 743 B12R1.267 [O-][n+]1ccccc1NC/C=C\O 0c33777842c46bec4c388a9af8ac9313 [0,2,0,0,0,0|2,0,0]=4 744 B12R1.371 CN(CO)Cc1ccccc1Br 9ac13c39fec83267043e3355bc9d3c6e [0,2,0,0,0,0|2,0,0]=4 745 B12R1.371 CN(CO)Cc1ccccc1Cl 2fb26837977d5eacf5cb47738766ffa1 [0,2,0,0,0,0|2,0,0]=4 746 B12R1.371 CN(CO)Cc1ccccc1F 661f3a9dbe61fe63a175ae38e8094802 [0,2,0,0,0,0|2,0,0]=4 747 B12R1.371 CN(CO)Cc1ccccc1I fd2e6b3f5dd3915c1a3ff85b0c15f004 [0,2,0,0,0,0|2,0,0]=4 748 B12R1.371 Cc1ccccc1CN(C)CO 63199def7303a7d9eb3beb52a0338d30 [0,2,0,0,0,0|2,0,0]=4 749 B12R1.371 Cc1ccccc1NC(=O)CO 8d990dc3b3796a0c64c8b86b8490eb78 [0,2,0,0,0,0|2,0,0]=4 750 B12R1.371 O=C(CO)Nc1ccccc1F d20a35cb403e68671e72a0dd460c0485 [0,2,0,0,0,0|2,0,0]=4 751 B12R1.371 O=C(CO)Nc1ccccc1I 209ecbfb2e84cc7bc62f1762ecc4331e [0,2,0,0,0,0|2,0,0]=4 752 B12R1.371 O=C(CO)Nc1ccccc1O e8a188e3771eae8a4a1eca1b4e42b466 [0,2,0,0,0,0|2,0,0]=4 753 B12R1.371 O=C(CO)Nc1ccccc1S e3384ae87fb80eb0958c847fa331a653 [0,2,0,0,0,0|2,0,0]=4 754 B12R1.374 Cc1ccc(c(c1)CNCO)C 008a7b2efdea6e4cc76eeb2aeaab7a7f [0,2,0,0,0,0|2,0,0]=4 755 B12R1.374 Cc1ccc(c(c1)CNCO)Cl 861628e5de0479b08ec69adc2f6283fb [0,2,0,0,0,0|2,0,0]=4 756 B12R1.374 Cc1ccc(c(c1)CNCO)F a7c332e3a3e71346652d84023ef1a553 [0,2,0,0,0,0|2,0,0]=4 757 B12R1.374 Cc1ccc(cc1CNCO)Cl 14dbe55f1c928c7f99a465e1d34b482e [0,2,0,0,0,0|2,0,0]=4 758 B12R1.374 Cc1ccc(cc1CNCO)F c2008200e2385445c0f2bc00601bb6bb [0,2,0,0,0,0|2,0,0]=4 759 B12R1.374 OCNCc1cc(ccc1Br)Br df263a9ff1d045ecb0c15b4edff88c66 [0,2,0,0,0,0|2,0,0]=4 760 B12R1.374 OCNCc1cc(ccc1Br)Cl 0876db151f1b5588157d76e2566e971f [0,2,0,0,0,0|2,0,0]=4 761 B12R1.374 OCNCc1cc(ccc1Br)F 09ba522e105fb030480e5dce6c1e63d6 [0,2,0,0,0,0|2,0,0]=4 762 B12R1.374 OCNCc1cc(ccc1Cl)Br 632042377294ccefe91de123b2384ee5 [0,2,0,0,0,0|2,0,0]=4 763 B12R1.374 OCNCc1cc(ccc1Cl)Cl eabe80a63b4916ca4fc5bdb9929e2ed1 [0,2,0,0,0,0|2,0,0]=4 764 B12R1.374 OCNCc1cc(ccc1Cl)F 15423cb3f88ece4e64a21c60507ef39b [0,2,0,0,0,0|2,0,0]=4 765 B12R1.374 OCNCc1cc(ccc1F)Br 1fc7800d0e5ee9beeb170085ed84742e [0,2,0,0,0,0|2,0,0]=4 766 B12R1.374 OCNCc1cc(ccc1F)Cl 9f7a4345df2828667897b449e0440222 [0,2,0,0,0,0|2,0,0]=4 767 B12R1.374 OCNCc1cc(ccc1F)F 741058fd3b44fc4427fccc61f39e95c9 [0,2,0,0,0,0|2,0,0]=4 768 B12R1.374 OCNCc1cc(ccc1I)Br 1e2b5c05357f93f6d88bec77ba266c67 [0,2,0,0,0,0|2,0,0]=4 769 B12R1.1631 Cc1cccc(c1CNCO)C f49a70f50a6d46b683d36e3e7b4a7664 [0,2,0,0,0,0|2,0,0]=4 770 B12R1.1631 Cc1cccc(c1CNCO)Cl fcc8efab5963a1b841c6d5034775f84a [0,2,0,0,0,0|2,0,0]=4 771 B12R1.1631 Cc1cccc(c1CNCO)F 780907256953da4bcb3a3bca63caa7f4 [0,2,0,0,0,0|2,0,0]=4 772 B12R1.1631 OCNCc1c(cccc1Br)Br 3e7bd8d126ccbafb47d0ff33bd75622c [0,2,0,0,0,0|2,0,0]=4 773 B12R1.1631 OCNCc1c(cccc1Br)Cl 11bf6d6dfac6d4b064beaaa8d86e4dc0 [0,2,0,0,0,0|2,0,0]=4 774 B12R1.1631 OCNCc1c(cccc1Br)F 5c6a7e2bc55299e648666fb491bc0c21 [0,2,0,0,0,0|2,0,0]=4 775 B12R1.1631 OCNCc1c(cccc1Cl)Cl d476790c78e5eba09160105e8ebd8741 [0,2,0,0,0,0|2,0,0]=4 776 B12R1.1631 OCNCc1c(cccc1Cl)F 106975239ea3ca0e435e2e57249fc33d [0,2,0,0,0,0|2,0,0]=4 777 B12R1.1631 OCNCc1c(cccc1F)F c07432774dd9207df65944cdbfd8a987 [0,2,0,0,0,0|2,0,0]=4 778 B12R1.28 C/C=C/CNc1cccc(c1)Br a2a4ffb13df66bc6f5fd65745354daf3 [0,2,0,0,0,0|2,0,0]=4 779 B12R1.28 C/C=C/CNc1cccc(c1)C 8da617065114d03b678a93cf249b27f7 [0,2,0,0,0,0|2,0,0]=4 780 B12R1.28 C/C=C/CNc1cccc(c1)Cl a321a64687bc7e589120f424933cd2d2 [0,2,0,0,0,0|2,0,0]=4 781 B12R1.28 C/C=C/CNc1cccc(c1)F 71cafafb1f1e8b6121b9b13096f0fc70 [0,2,0,0,0,0|2,0,0]=4 782 B12R1.28 C/C=C/CNc1cccc(c1)I d2f964ed520df8f3aeecd7f050c1985b [0,2,0,0,0,0|2,0,0]=4 783 B12R1.28 C/C=C/CNc1cccc(c1)S ec49e90993d9a78711d475148cac4c72 [0,2,0,0,0,0|2,0,0]=4 784 B12R1.28 C/C=C/COc1cccc(c1)Br 72e4bc852d44ba31a847e204d2da404e [0,2,0,0,0,0|2,0,0]=4 785 B12R1.28 C/C=C/COc1cccc(c1)C 3ba4d822cba50bbc6be0b4bb2f2ebb3d [0,2,0,0,0,0|2,0,0]=4 786 B12R1.28 C/C=C/COc1cccc(c1)Cl 8ca2bf180186d4e7bfe19d428dfe7811 [0,2,0,0,0,0|2,0,0]=4 787 B12R1.28 C/C=C/COc1cccc(c1)F 5074841a69b3ba42e5246b5f75cb4bda [0,2,0,0,0,0|2,0,0]=4 788 B12R1.28 C/C=C/COc1cccc(c1)I 7abbdb89bd64553f484003423d90fe9f [0,2,0,0,0,0|2,0,0]=4 789 B12R1.28 C/C=C/COc1cccc(c1)S 7080dba1b36872549a84c0750f8cb3ff [0,2,0,0,0,0|2,0,0]=4 790 B12R1.28 C/C=C\CNc1cccc(c1)Br 7070d8ae71f4af92f8b602236c10e93a [0,2,0,0,0,0|2,0,0]=4 791 B12R1.28 C/C=C\CNc1cccc(c1)C d9d5a3b664a5f0201836bd778c9a0849 [0,2,0,0,0,0|2,0,0]=4 792 B12R1.28 C/C=C\CNc1cccc(c1)Cl 04625aaaf5accf11670fca06cbf179cd [0,2,0,0,0,0|2,0,0]=4 793 B12R1.28 C/C=C\CNc1cccc(c1)F 0907f1c38a6392cdde953637934da498 [0,2,0,0,0,0|2,0,0]=4 794 B12R1.28 C/C=C\CNc1cccc(c1)I 3a9b75e66c5c614dcbb90951ba554cc0 [0,2,0,0,0,0|2,0,0]=4 795 B12R1.28 C/C=C\CNc1cccc(c1)S a0e54ccff2742c467e8fbea49b77ae88 [0,2,0,0,0,0|2,0,0]=4 796 B12R1.28 C/C=C\COc1cccc(c1)Br 15b9554195d237378876ca7d504f98c8 [0,2,0,0,0,0|2,0,0]=4 797 B12R1.28 C/C=C\COc1cccc(c1)C 8f36ad1133ab371e69bffa981477ceda [0,2,0,0,0,0|2,0,0]=4 798 B12R1.28 C/C=C\COc1cccc(c1)Cl d19230bedb310950f229d85746a83423 [0,2,0,0,0,0|2,0,0]=4 799 B12R1.28 C/C=C\COc1cccc(c1)F 2e8bc4bcc243d49ae976ed443382fb18 [0,2,0,0,0,0|2,0,0]=4 800 B12R1.28 C/C=C\COc1cccc(c1)I c8a336888e595e1b5ed81353e45b7a26 [0,2,0,0,0,0|2,0,0]=4 801 B12R1.28 C/C=C\COc1cccc(c1)S b203829723f78fca904ac9665341c217 [0,2,0,0,0,0|2,0,0]=4 802 B12R1.28 CC=CCNc1cccc(c1)C 30ec1285d9bc656faa9242a94847159d [0,2,0,0,0,0|2,0,0]=4 803 B12R1.28 CC=CCNc1cccc(c1)F 4305289cfcb4f5f2c78858c21518b03a [0,2,0,0,0,0|2,0,0]=4 804 B12R1.28 CC=CCNc1cccc(c1)O 0ec4450758cda2ae602b2e783d8c49bd [0,2,0,0,0,0|2,0,0]=4 805 B12R1.28 CC=CCNc1cccc(c1)S 8e7bc312fb945df2c9ee408d70f309a5 [0,2,0,0,0,0|2,0,0]=4 806 B12R1.28 COCNCc1cccc(c1)Br bb26088e9109faf63b2c5aab82a0bab2 [0,2,0,0,0,0|2,0,0]=4 807 B12R1.28 COCNCc1cccc(c1)C 2a616a68489893ac9fc4786c5bd224bd [0,2,0,0,0,0|2,0,0]=4 808 B12R1.28 COCNCc1cccc(c1)Cl ca1fb393701eed7a8728da9d87eb9356 [0,2,0,0,0,0|2,0,0]=4 809 B12R1.28 COCNCc1cccc(c1)F cb55f4e89d5e0d7efcab729f0b524b91 [0,2,0,0,0,0|2,0,0]=4 810 B12R1.28 COCNCc1cccc(c1)I 5bb13b291c47f5546b24577b4829b678 [0,2,0,0,0,0|2,0,0]=4 811 B12R1.28 COCOCc1cccc(c1)Br c6cf95c46ea4a77f05562ffd28f5ef20 [0,2,0,0,0,0|2,0,0]=4 812 B12R1.28 COCOCc1cccc(c1)C 1d01d33a1b21700c4557a3eb1da01433 [0,2,0,0,0,0|2,0,0]=4 813 B12R1.28 COCOCc1cccc(c1)Cl 725bbbfeda6dcaba43944749d2426b05 [0,2,0,0,0,0|2,0,0]=4 814 B12R1.28 COCOCc1cccc(c1)F dcd42a5011050a007fb2422fa7534624 [0,2,0,0,0,0|2,0,0]=4 815 B12R1.28 COCOCc1cccc(c1)I 4b864b485a6df11ced7a4a705c084d98 [0,2,0,0,0,0|2,0,0]=4 816 B12R1.28 Cc1cc(ccn1)NC/C=C\O 12d79d535130f2fbbabbe2011477559b [0,2,0,0,0,0|2,0,0]=4 817 B12R1.28 Cc1cccc(c1)CCNCO 93a28a38a3a795fa33735682cc180d19 [0,2,0,0,0,0|0,0,2]=4 818 B12R1.28 Cc1cccc(c1)CNCCO 8b0e4b8bd6a8c2f5f9d0a2d7f28d8116 [0,2,0,0,0,0|1,0,1]=4 819 B12R1.28 Cc1cccc(c1)NC/C=C/Cl 98ac79b3da1847d1dd1a78ffc7e5b093 [0,2,0,0,0,0|2,0,0]=4 820 B12R1.28 Cc1cccc(c1)NC/C=C\Cl cd348f4d584c5591d9b7bbe49b8f0697 [0,2,0,0,0,0|2,0,0]=4 821 B12R1.28 Cc1cccc(c1)NC/C=C\O c7010db5847beca6cb09d1b8488a6efc [0,2,0,0,0,0|1,0,0]=3 822 B12R1.28 Cc1cccc(c1)NCCCO 6331c0265cdcc1d7fe5e30a546d60d68 [0,2,0,0,0,0|1,0,1]=4 823 B12R1.28 Cc1cccc(c1)OC/C=C/Cl 9037dd5a990de15c270ec61c89c14278 [0,2,0,0,0,0|2,0,0]=4 824 B12R1.28 Cc1cccc(c1)OC/C=C\Cl d1571fcc028e84e3b10f8a86ba31f081 [0,2,0,0,0,0|2,0,0]=4 825 B12R1.28 Cc1cccc(n1)NC/C=C\O b63ee68101251cb01c7abf7b30b785d7 [0,2,0,0,0,0|2,0,0]=4 826 B12R1.28 Cc1ccnc(c1)NC/C=C\O 1941622e02d255077e5cd8702eeb421d [0,2,0,0,0,0|2,0,0]=4 827 B12R1.28 Cc1cncc(c1)NC/C=C\O 12d4750fa7aa9b0502208f1b8b7bbf0a [0,2,0,0,0,0|2,0,0]=4 828 B12R1.28 Cl/C=C/CNc1cccc(c1)Br 8416e8013a248d6bb1ca96e173949959 [0,2,0,0,0,0|2,0,0]=4 829 B12R1.28 Cl/C=C/CNc1cccc(c1)Cl 1a851f3c712b70f45da2ebff7d17bd31 [0,2,0,0,0,0|2,0,0]=4 830 B12R1.28 Cl/C=C/CNc1cccc(c1)I a009882d0b18a5ca6128e85216c27fe4 [0,2,0,0,0,0|2,0,0]=4 831 B12R1.28 Cl/C=C/COc1cccc(c1)Br aa80cec2a1946ec39da85c05d547ee35 [0,2,0,0,0,0|2,0,0]=4 832 B12R1.28 Cl/C=C/COc1cccc(c1)Cl 201625de8e15471834ea6e5730346d4f [0,2,0,0,0,0|2,0,0]=4 833 B12R1.28 Cl/C=C/COc1cccc(c1)I eae1447c60e8d9fbaca524f91c048c19 [0,2,0,0,0,0|2,0,0]=4 834 B12R1.28 Cl/C=C\CNc1cccc(c1)Br bfac8b8fe540ad0e9778d1173e57fe7c [0,2,0,0,0,0|2,0,0]=4 835 B12R1.28 Cl/C=C\CNc1cccc(c1)Cl 30144b60555892b2229e10b305d4673e [0,2,0,0,0,0|2,0,0]=4 836 B12R1.28 Cl/C=C\CNc1cccc(c1)I b2e748550268da7081f698887c915488 [0,2,0,0,0,0|2,0,0]=4 837 B12R1.28 Cl/C=C\COc1cccc(c1)Br cafe89e83d33ae8e5464c81314f349c8 [0,2,0,0,0,0|2,0,0]=4 838 B12R1.28 Cl/C=C\COc1cccc(c1)Cl 9fdf28c7b2407ba2d9f3505a1f0af75f [0,2,0,0,0,0|2,0,0]=4 839 B12R1.28 Cl/C=C\COc1cccc(c1)I ea5355c24eada8340bd2fd0bc8d213c0 [0,2,0,0,0,0|2,0,0]=4 840 B12R1.28 Fc1cccc(c1)NC/C=C/Cl 04953bd91e752d2c0c5ae2781b69ed0d [0,2,0,0,0,0|2,0,0]=4 841 B12R1.28 Fc1cccc(c1)NC/C=C\Cl 2e2d652df28899547c3a91c0bc003a25 [0,2,0,0,0,0|2,0,0]=4 842 B12R1.28 Fc1cccc(c1)OC/C=C/Cl cfe6ba9a568034c9274131b68e17b27f [0,2,0,0,0,0|2,0,0]=4 843 B12R1.28 Fc1cccc(c1)OC/C=C\Cl 72c2bba292946640105df8c351d91291 [0,2,0,0,0,0|2,0,0]=4 844 B12R1.28 O/C=C\CNc1cc(ccn1)Br 83006ddd77858954bfa70fc5e178edf1 [0,2,0,0,0,0|2,0,0]=4 845 B12R1.28 O/C=C\CNc1cc(ccn1)Cl 1ee464fc1d728c207d1c3b88296a3b9e [0,2,0,0,0,0|2,0,0]=4 846 B12R1.28 O/C=C\CNc1cc(ccn1)F 14a1899b02b1d1352543dc505123ab8e [0,2,0,0,0,0|2,0,0]=4 847 B12R1.28 O/C=C\CNc1cc(ccn1)I 142c41626de1c4483b8dbdeb5434fd9c [0,2,0,0,0,0|2,0,0]=4 848 B12R1.28 O/C=C\CNc1cc[nH]c(=S)c1 87eeb1e7740c33f38249fbdff71cbe57 [0,2,0,0,0,0|2,0,0]=4 849 B12R1.28 O/C=C\CNc1cccc(c1)Br 3ee34417ec78dab704e916487074f834 [0,2,0,0,0,0|1,0,0]=3 850 B12R1.28 O/C=C\CNc1cccc(c1)Cl f488a48064ae669b722bbf26d9c2b93b [0,2,0,0,0,0|1,0,0]=3 851 B12R1.28 O/C=C\CNc1cccc(c1)F 3257523b92b09d0fab6fa93a3930762e [0,2,0,0,0,0|1,0,0]=3 852 B12R1.28 O/C=C\CNc1cccc(c1)I 1401d28c4b63360689e65d1b62f29df0 [0,2,0,0,0,0|1,0,0]=3 853 B12R1.28 O/C=C\CNc1cccc(c1)S 769b6189eaf129133a621dee08420c31 [0,2,0,0,0,0|1,0,0]=3 854 B12R1.28 O/C=C\CNc1cccc(n1)Br bd3968c0648374d25a4808e4485cd5e4 [0,2,0,0,0,0|2,0,0]=4 855 B12R1.28 O/C=C\CNc1cccc(n1)Cl 0131256c9aa727ffd53347cb5f9e5895 [0,2,0,0,0,0|2,0,0]=4 856 B12R1.28 O/C=C\CNc1cccc(n1)F 8950b3b4588ff192514c7402da534985 [0,2,0,0,0,0|2,0,0]=4 857 B12R1.28 O/C=C\CNc1cccc(n1)I 631d6b0749e76a031b663e54e0de1c7f [0,2,0,0,0,0|2,0,0]=4 858 B12R1.28 O/C=C\CNc1ccnc(c1)Br a48a388176f641e93f4abdbaa7229002 [0,2,0,0,0,0|2,0,0]=4 859 B12R1.28 O/C=C\CNc1ccnc(c1)Cl 6fbd350627d7c590c5e24cb047419612 [0,2,0,0,0,0|2,0,0]=4 860 B12R1.28 O/C=C\CNc1ccnc(c1)F e464253a97e670324037db3f44a42846 [0,2,0,0,0,0|2,0,0]=4 861 B12R1.28 O/C=C\CNc1ccnc(c1)I bd90e50351295258fc453fb2bc768cc3 [0,2,0,0,0,0|2,0,0]=4 862 B12R1.28 O/C=C\CNc1cncc(c1)Br 1de13e1fc91c0fada447eeee23139da6 [0,2,0,0,0,0|2,0,0]=4 863 B12R1.28 O/C=C\CNc1cncc(c1)Cl f952182ea5f5914110eeeb47abcc5b3e [0,2,0,0,0,0|2,0,0]=4 864 B12R1.28 O/C=C\CNc1cncc(c1)F a363046a734a0cf5ca7ac2a621b0d33b [0,2,0,0,0,0|2,0,0]=4 865 B12R1.28 O/C=C\CNc1cncc(c1)I 724273180fa6cb57787d0d0f7bc5e44c [0,2,0,0,0,0|2,0,0]=4 866 B12R1.28 OCCCNc1cccc(c1)Br cf69fbba1731c7b7b182d73471a01be4 [0,2,0,0,0,0|1,0,1]=4 867 B12R1.28 OCCCNc1cccc(c1)Cl 88f10fbe375978effa6eebb8a9188619 [0,2,0,0,0,0|1,0,1]=4 868 B12R1.28 OCCCNc1cccc(c1)F b882697ea65ee7871f3124f2dd496ace [0,2,0,0,0,0|1,0,1]=4 869 B12R1.28 OCCCNc1cccc(c1)I 78c4085590617010aec0ba4d6ba6f2fe [0,2,0,0,0,0|1,0,1]=4 870 B12R1.28 OCCCNc1cccc(c1)O b8a1a453f36dea395f53aa0824bf7c84 [0,2,0,0,0,0|1,0,1]=4 871 B12R1.28 OCCCNc1cccc(c1)S 9ca3bc3286df08cfa7f628c8e1f2aead [0,2,0,0,0,0|1,0,1]=4 872 B12R1.28 OCCNCc1cccc(c1)Br 269adac2794c703a867a6cdfbdcc4b31 [0,2,0,0,0,0|1,0,1]=4 873 B12R1.28 OCCNCc1cccc(c1)Cl 12da828289841255f4989b01d4fb368f [0,2,0,0,0,0|1,0,1]=4 874 B12R1.28 OCCNCc1cccc(c1)F 4b3f9f0d35d39d22594c2266a910e961 [0,2,0,0,0,0|1,0,1]=4 875 B12R1.28 OCCNCc1cccc(c1)I dabfb0966332881d2eb3473e30b644ce [0,2,0,0,0,0|1,0,1]=4 876 B12R1.28 OCNCCc1cccc(c1)Br 3aa38b14d893ea561c6d7be0b882b46e [0,2,0,0,0,0|0,0,2]=4 877 B12R1.28 OCNCCc1cccc(c1)Cl 10611e4fe6f0ad3695177e63a8cf825e [0,2,0,0,0,0|0,0,2]=4 878 B12R1.28 OCNCCc1cccc(c1)F 88d3334a709a0b42373bc0c7574dca21 [0,2,0,0,0,0|0,0,2]=4 879 B12R1.28 OCNCCc1cccc(c1)I 5daf6c5becb322704670a9c1193bd5a3 [0,2,0,0,0,0|0,0,2]=4 880 B12R1.28 Sc1cccc(c1)NC/C=C/Cl ffb9f9c8fbdb8c84a233237603703afb [0,2,0,0,0,0|2,0,0]=4 881 B12R1.28 Sc1cccc(c1)NC/C=C\Cl d6a8adca6eff0f1d84da5fdd4f57426d [0,2,0,0,0,0|2,0,0]=4 882 B12R1.28 Sc1cccc(c1)OC/C=C/Cl 58ec47ad27da6c93794ec86d260425e3 [0,2,0,0,0,0|2,0,0]=4 883 B12R1.28 Sc1cccc(c1)OC/C=C\Cl 5f1eec17a74d66b2ae33b05599b21165 [0,2,0,0,0,0|2,0,0]=4 884 B12R1.50 CN(CO)Cc1cccc(c1)Br 598209607c72aa6d8108b132f4b46d7e [0,2,0,0,0,0|2,0,0]=4 885 B12R1.50 CN(CO)Cc1cccc(c1)Cl 2945da4e469cee97956e9210dfcdfe64 [0,2,0,0,0,0|2,0,0]=4 886 B12R1.50 CN(CO)Cc1cccc(c1)F 6a7f560609911b9b7b05731cdc2a168a [0,2,0,0,0,0|2,0,0]=4 887 B12R1.50 CN(CO)Cc1cccc(c1)I f120238df6abba66af1a68aaee18110e [0,2,0,0,0,0|2,0,0]=4 888 B12R1.50 Cc1cccc(c1)CN(C)CO 9ce835e7a7f8a76d68ac785fdcc22b43 [0,2,0,0,0,0|2,0,0]=4 889 B12R1.50 O=C(CO)Nc1cccc(c1)I b9f53ca927845b9cf845279d5be47e9f [0,2,0,0,0,0|2,0,0]=4 890 B12R1.100 Cc1cc(cc(c1)CNCO)Br 0be5c78f46c15109c3f1ba92a0463d14 [0,2,0,0,0,0|2,0,0]=4 891 B12R1.100 Cc1cc(cc(c1)CNCO)C c1c38cbfcd056789c6ba8ebf5e0de443 [0,2,0,0,0,0|2,0,0]=4 892 B12R1.100 Cc1cc(cc(c1)CNCO)Cl bce28101bf033dffc2c88fbe6cf248b7 [0,2,0,0,0,0|2,0,0]=4 893 B12R1.100 Cc1cc(cc(c1)CNCO)F 87a5d6f7916cdb2444cc9487c607b382 [0,2,0,0,0,0|2,0,0]=4 894 B12R1.100 OCNCc1cc(cc(c1)Br)Br fd32bba03b1e9276b840240f90590cac [0,2,0,0,0,0|2,0,0]=4 895 B12R1.100 OCNCc1cc(cc(c1)Br)Cl c822c65febbb8a1b0ece371f7b741462 [0,2,0,0,0,0|2,0,0]=4 896 B12R1.100 OCNCc1cc(cc(c1)Br)F 379ed17f1f5e6002c3a6d32be2bb7a98 [0,2,0,0,0,0|2,0,0]=4 897 B12R1.100 OCNCc1cc(cc(c1)Cl)Cl 772429971fe22f2b38a60aa1920fe91c [0,2,0,0,0,0|2,0,0]=4 898 B12R1.100 OCNCc1cc(cc(c1)Cl)F f9c01c04e891fa0015c663cac340f303 [0,2,0,0,0,0|2,0,0]=4 899 B12R1.100 OCNCc1cc(cc(c1)F)F 24c94ee22df899ea4df08b8a19f665ef [0,2,0,0,0,0|2,0,0]=4 900 B12R1.382 C#Cc1cccc(c1)CNCO 7ea42023f49dc7ade2f2d4847946d091 [0,2,0,0,0,0|2,0,0]=4 901 B12R1.382 CCc1cccc(c1)CNCO f24268b85b4fe188cbb97f6c6ef50caa [0,2,0,0,0,0|2,0,0]=4 902 B12R1.382 COc1cccc(c1)CNCO 0711493d98a6b00a36bcf9962ea7a16e [0,2,0,0,0,0|2,0,0]=4 903 B12R1.382 CSc1cccc(c1)CNCO 0e9f943f9f22145bb300e5e15cf6bbb8 [0,2,0,0,0,0|2,0,0]=4 904 B12R1.382 N#Cc1cccc(c1)CNCO bde0d21f17ff1b9adc31e46db3294340 [0,2,0,0,0,0|2,0,0]=4 905 B12R1.382 OCNCc1cccc(c1)CO 630ae6eba165db38f26a3e3eabeb16a9 [0,2,0,0,0,0|2,0,0]=4 906 B12R1.8 C/C=C/CNCc1ccccc1 696910dabaeed0573317ce9dc7d987f1 [0,2,0,0,0,0|2,0,0]=4 907 B12R1.8 C/C=C/COCc1ccccc1 bedaf623f7df2efe6975ff88cd723c7c [0,2,0,0,0,0|2,0,0]=4 908 B12R1.8 C/C=C\CNCc1ccccc1 fd8d6b82f6381d759806df05cfd6b008 [0,2,0,0,0,0|2,0,0]=4 909 B12R1.8 C/C=C\COCc1ccccc1 bb9ff25480a2f7ddd7050e8b042c0009 [0,2,0,0,0,0|2,0,0]=4 910 B12R1.8 CC/C=C/CNc1ccccc1 ae4615a47949f31d5764aa26c0be3c5c [0,2,0,0,0,0|2,0,0]=4 911 B12R1.8 CC=CCNCc1ccccc1 ccb966671e75f827f9356a0f248353fa [0,2,0,0,0,0|2,0,0]=4 912 B12R1.8 CC=CCOCc1ccccc1 dcaa6de30aada804690dc36fa942dd3d [0,2,0,0,0,0|2,0,0]=4 913 B12R1.8 CCOC/C=C/c1ccccc1 6f0f2808fd7750fbafef94eda36a57cc [0,2,0,0,0,0|1,0,1]=4 914 B12R1.8 CCOC/C=C\c1ccccc1 718b8db828f50aaf9df65554f6d18358 [0,2,0,0,0,0|1,0,1]=4 915 B12R1.8 CCOCC=Cc1ccccc1 ea6af70ca1c55ffae7ca4fca9bfef55c [0,2,0,0,0,0|1,0,1]=4 916 B12R1.8 CCOCCCc1ccccc1 95c4d5e38aabc377fa248d955f0dc679 [0,2,0,0,0,0|1,0,1]=4 917 B12R1.8 CCOCNCc1ccccc1 ad1ac49e8362d6c3a7ef7f4bc168f4ac [0,2,0,0,0,0|2,0,0]=4 918 B12R1.8 COCCCNc1ccccc1 3df3fc4fbaedb1dd760b4a37be035630 [0,2,0,0,0,0|1,0,1]=4 919 B12R1.8 COCCNCc1ccccc1 8a36d3044a8140246d8590cb65467526 [0,2,0,0,0,0|1,0,1]=4 920 B12R1.8 COCCOCc1ccccc1 b9f846e77ac1098b75510b938c502133 [0,2,0,0,0,0|1,0,1]=4 921 B12R1.8 COCNCCc1ccccc1 a912e7467b1cfbc21e322d32a6dcd9f6 [0,2,0,0,0,0|0,0,2]=4 922 B12R1.8 COCOCCc1ccccc1 770adb91b0343cd94d912838fb402d30 [0,2,0,0,0,0|1,0,1]=4 923 B12R1.8 Cl/C=C/CNCc1ccccc1 a8bbb089bed3b2a5f6790add18c02ea9 [0,2,0,0,0,0|2,0,0]=4 924 B12R1.8 Cl/C=C/COCc1ccccc1 39b96fd9c849369483b32d20bd300028 [0,2,0,0,0,0|2,0,0]=4 925 B12R1.8 Cl/C=C\CNCc1ccccc1 e1a2a29c75c0d3cbf63e02bd9dd9f68f [0,2,0,0,0,0|2,0,0]=4 926 B12R1.8 Cl/C=C\COCc1ccccc1 469db4a6443d937d123185062feb7af0 [0,2,0,0,0,0|2,0,0]=4 927 B12R1.8 ClC=CCOCc1ccccc1 c5abd2a914006a75903d903e7480679b [0,2,0,0,0,0|2,0,0]=4 928 B12R1.8 FCOC/C=C/c1ccccc1 a4ace31f3457e43155aba22e2e859991 [0,2,0,0,0,0|1,0,1]=4 929 B12R1.8 FCOC/C=C\c1ccccc1 a5a4d25cd2921992c3f2dc18a83060fd [0,2,0,0,0,0|1,0,1]=4 930 B12R1.8 FCOCC=Cc1ccccc1 bab31968052d6c59ffd956383ce13de4 [0,2,0,0,0,0|1,0,1]=4 931 B12R1.8 FCOCCCc1ccccc1 337af886dc35840fb3b320f6a2c82837 [0,2,0,0,0,0|1,0,1]=4 932 B12R1.8 N#CC=CCNc1ccccc1 0f075c3e6c72adf6f3e000ed643411c6 [0,2,0,0,0,0|2,0,0]=4 933 B12R1.8 NOCCNCc1ccccc1 c44b16f502caeb4e0911ea1065c9b2b0 [0,2,0,0,0,0|1,0,1]=4 934 B12R1.8 O/C=C\CNCc1ccccc1 cc7ffd2c4974e7fdfe8e66473dde0504 [0,2,0,0,0,0|1,0,0]=3 935 B12R1.8 O/C=C\CNCc1ccccn1 697d371fb7988146e4e661e4ba711945 [0,2,0,0,0,0|2,0,0]=4 936 B12R1.8 O/C=C\CNCc1cccnc1 1b127bcedabb68854c46a8dc71a531d8 [0,2,0,0,0,0|2,0,0]=4 937 B12R1.8 O/C=C\CNCc1ccncc1 e1733e2bf9fad3b01d3077b0d7192fe2 [0,2,0,0,0,0|2,0,0]=4 938 B12R1.8 OCC#CCNc1ccccc1 ad3ab414545e40c96a0f226567b3debc [0,2,0,0,0,0|1,0,1]=4 939 B12R1.8 OCCCCNc1ccccc1 2154e665ebfa9ee647e239d5a23b3bbd [0,2,0,0,0,0|1,0,1]=4 940 B12R1.8 OCCCNCc1ccccc1 1f43a365b69733d9fd54c3f1367679b4 [0,2,0,0,0,0|1,0,1]=4 941 B12R1.8 OCCNCCc1ccccc1 6832b0d8880be8700c4d8c29ed63036c [0,2,0,0,0,0|0,0,2]=4 942 B12R1.8 OCCNCSc1ccccc1 973e07915013e23c41bc74a1aa466e19 [0,2,0,0,0,0|1,0,1]=4 943 B12R1.8 OCNC/C=C/c1ccccc1 520f7b9ffc5cf2723b4b289848e239a6 [0,2,0,0,0,0|0,0,2]=4 944 B12R1.8 OCNCCCc1ccccc1 4af827ec2909e74315445a370a932107 [0,2,0,0,0,0|0,0,2]=4 945 B12R1.8 OCNCCOc1ccccc1 641239c62160a991f896e082b9cc08e2 [0,2,0,0,0,0|0,0,2]=4 946 B12R1.27 C#CC(=O)NCc1ccccc1 7af84dc5a7d2034c8d0a1778bc429d59 [0,2,0,0,0,0|2,0,0]=4 947 B12R1.27 C=C(C#N)CNc1ccccc1 875e796ed2331cbf6722fd9951dfc9a2 [0,2,0,0,0,0|2,0,0]=4 948 B12R1.27 C=C(C=O)OCc1ccccc1 d9facb3ea82832fcb2b7bb0a7ba08bec [0,2,0,0,0,0|1,0,1]=4 949 B12R1.27 C=C(CC)CNc1ccccc1 109c052abdb53f9ddab28ed347d98fd8 [0,2,0,0,0,0|2,0,0]=4 950 B12R1.27 C=C(CNc1ccccc1)OC bb949f54d2f54d3e6e888faf57686f4e [0,2,0,0,0,0|2,0,0]=4 951 B12R1.27 C=C(CO)CNc1ccccc1 6dd075951d15cc232b8e7770860ee4cb [0,2,0,0,0,0|1,0,0]=3 952 B12R1.27 C=C(CO)CNc1ccccn1 6105decc4fd535ea60914c586543371b [0,2,0,0,0,0|2,0,0]=4 953 B12R1.27 C=C(CO)CNc1cccnc1 0fd79a449234686b43f3fbd5309569ce [0,2,0,0,0,0|2,0,0]=4 954 B12R1.27 C=C(CO)CNc1ccncc1 b7e5e82015293df9d0487abccba2389f [0,2,0,0,0,0|2,0,0]=4 955 B12R1.27 C=CC(=O)NCc1ccccc1 35494ddcd383d6504b7e0ac93d2e54a2 [0,2,0,0,0,0|2,0,0]=4 956 B12R1.27 CC(CO)CNc1ccccc1 f07a32871260f72c2fb2363a7f611104 [0,2,0,0,0,0|1,0,1]=4 957 B12R1.27 CC(CO)NCc1ccccc1 8f2e7b2c99e7f1ec8ee06bbaf841b37c [0,2,0,0,0,0|1,0,1]=4 958 B12R1.27 CCC(=O)CNc1ccccc1 8a00a9b87cff2992f22bb204b9e2670f [0,2,0,0,0,0|2,0,0]=4 959 B12R1.27 CCC(=O)NCc1ccccc1 cd109163e80059e2763660343f9dbe36 [0,2,0,0,0,0|2,0,0]=4 960 B12R1.27 CN(CO)CCc1ccccc1 c9a67cdf713e4c874ec2d63ed5e8590a [0,2,0,0,0,0|0,0,2]=4 961 B12R1.27 CNC(=O)CNc1ccccc1 9c8781c492a9bef282f2e4766dfd7321 [0,2,0,0,0,0|1,0,1]=4 962 B12R1.27 COC(=O)CNc1ccccc1 4732dba1106eb1ebf4644524cb0d5858 [0,2,0,0,0,0|2,0,0]=4 963 B12R1.27 C[C@@H](CO)CNc1ccccc1 8acaf8396f10bf3948fe3b52f4656e75 [0,2,0,0,0,0|1,0,1]=4 964 B12R1.27 C[C@@H](CO)NCc1ccccc1 a52866c987a35d6e1a5b62fda8afddea [0,2,0,0,0,0|1,0,1]=4 965 B12R1.27 C[C@H](CO)CNc1ccccc1 de01f7c1f1d3b008ec664fad35110bba [0,2,0,0,0,0|1,0,1]=4 966 B12R1.27 C[C@H](CO)NCc1ccccc1 6eed9f4ff81e8b8226b9282b8f3ad13f [0,2,0,0,0,0|1,0,1]=4 967 B12R1.27 Cl/C=C(\Cl)/CNc1ccccc1 c331f0444ba4fa01061032a87aaeed79 [0,2,0,0,0,0|2,0,0]=4 968 B12R1.27 O=C(CF)NCc1ccccc1 44d0634b73cc2a3134198abb702adc32 [0,2,0,0,0,0|2,0,0]=4 969 B12R1.27 O=C(CNc1ccccc1)NO b700dc391e059a1fe9e2fea74fdf720f [0,2,0,0,0,0|0,0,1]=3 970 B12R1.27 O=C(CNc1ccccn1)NO be9d42adb21d4a69832949b9fc000cc0 [0,2,0,0,0,0|1,0,1]=4 971 B12R1.27 O=C(CNc1cccnc1)NO 8a27a50468684c1595a33212cebac4a8 [0,2,0,0,0,0|1,0,1]=4 972 B12R1.27 O=C(CNc1ccncc1)NO e534a6d29b9c11617e3a2a773fd0b2e3 [0,2,0,0,0,0|1,0,1]=4 973 B12R1.27 O=C(CO)CNc1ccccc1 1cf374c57dfb525ce3f48cecf3edf550 [0,2,0,0,0,0|1,0,0]=3 974 B12R1.27 O=C(CO)CNc1ccccn1 0c5a750a3ead3f0642560291fe4bd338 [0,2,0,0,0,0|2,0,0]=4 975 B12R1.27 O=C(CO)CNc1cccnc1 2c6f296e217cf230fda521b9de841c22 [0,2,0,0,0,0|2,0,0]=4 976 B12R1.27 O=C(CO)CNc1ccncc1 a9956d0800a44e92c213c4374d265d3b [0,2,0,0,0,0|2,0,0]=4 977 B12R1.27 O=C(CO)NCc1ccccc1 f4f787a5214848c6970058ebdb73c876 [0,2,0,0,0,0|1,0,0]=3 978 B12R1.27 O=C(CO)NCc1ccccn1 76eb78e75930ec6892869074780cca40 [0,2,0,0,0,0|2,0,0]=4 979 B12R1.27 O=C(CO)NCc1cccnc1 accc53643db8ccf06656b79e4c302034 [0,2,0,0,0,0|2,0,0]=4 980 B12R1.27 O=C(CO)NCc1ccncc1 e6e3500e223e964fc174f8ea1c4cb0cf [0,2,0,0,0,0|2,0,0]=4 981 B12R1.27 O=C(CS)NCc1ccccc1 f91da9c658c39a4f0c257ce61b60a1a7 [0,2,0,0,0,0|1,1,0]=4 982 B12R1.27 O=CC(=O)NCc1ccccc1 970d8ad05ab6cb0901c43fa67531a907 [0,2,0,0,0,0|1,0,1]=4 983 B12R1.27 OCC(F)CNc1ccccc1 12f6637854cd5607d7beeb33d98c9d66 [0,2,0,0,0,0|1,0,1]=4 984 B12R1.27 OCC(O)CNc1ccccc1 2c98ea52c81c0230088b12196d6eb24a [0,2,0,0,0,0|1,0,1]=4 985 B12R1.27 OC[C@@H](F)CNc1ccccc1 df0a72159854bbc7d14ee531e659ec9c [0,2,0,0,0,0|1,0,1]=4 986 B12R1.27 OC[C@@H](O)CNc1ccccc1 d5ed593b781b051c17ac5c0f665c9b28 [0,2,0,0,0,0|1,0,1]=4 987 B12R1.27 OC[C@H](F)CNc1ccccc1 9734eac13b001b84d3ee28ab012b0276 [0,2,0,0,0,0|1,0,1]=4 988 B12R1.27 OC[C@H](O)CNc1ccccc1 4df6835ea35fcadc1546d95d2a23469d [0,2,0,0,0,0|1,0,1]=4 989 B12R1.32 CC(CCO)Nc1ccccc1 9bf70c52b6fbdda0acbad0fbf8bda5d0 [0,2,0,0,0,0|1,0,1]=4 990 B12R1.32 CN(CCO)Cc1ccccc1 757bf36fdf4b02517da3241e86467be6 [0,2,0,0,0,0|1,0,1]=4 991 B12R1.32 COCN(C)Cc1ccccc1 4d05c3d6ddf3ecec9a6b681c1068023b [0,2,0,0,0,0|2,0,0]=4 992 B12R1.32 C[C@@H](CCO)Nc1ccccc1 fc83b26b05d5bb1e6a4de978429a6aa3 [0,2,0,0,0,0|1,0,1]=4 993 B12R1.32 C[C@H](CCO)Nc1ccccc1 83604672ebfdf7df8b733c8cb4f2aa8a [0,2,0,0,0,0|1,0,1]=4 994 B12R1.32 NOCC(=O)Nc1ccccc1 c5d51d2b3f28976c6bd3c98cfe9f6a86 [0,2,0,0,0,0|2,0,0]=4 995 B12R1.252 C/C(=C/CNc1ccccc1)/I 0655b4b8bd1a651f428f8af38afb9805 [0,2,0,0,0,0|2,0,0]=4 996 B12R1.252 C/C(=C\CNc1ccccc1)/Cl 03a2a67b224185dfa00dfc501ddc5144 [0,2,0,0,0,0|2,0,0]=4 997 B12R1.252 CC(=CCNc1ccccc1)C eb01c4541faf3d2e0c0e5ab3c7071819 [0,2,0,0,0,0|2,0,0]=4 998 B12R1.252 CC(=CCNc1ccccc1)Cl f13a71d1d4148a74f0302cf2c11de8f3 [0,2,0,0,0,0|2,0,0]=4 999 B12R1.252 CC(=CCNc1ccccc1)I ca45f16e4e3e563d8f77df266f95064c [0,2,0,0,0,0|2,0,0]=4 1000 B12R1.252 CC(O)CCNc1ccccc1 5c6c9358fbd8939fc6c9f54dcb2d3a37 [0,2,0,0,0,0|1,0,1]=4 1001 B12R1.252 CC(O)CNCc1ccccc1 19d19f96fb686d7cbd72f5df359e9dd8 [0,2,0,0,0,0|1,0,1]=4 1002 B12R1.252 C[C@@H](O)CCNc1ccccc1 3c324f6ae4acc93f637fccf82ee7ce0d [0,2,0,0,0,0|1,0,1]=4 1003 B12R1.252 C[C@@H](O)CNCc1ccccc1 6c2312c00225852faacfd748f3e179a9 [0,2,0,0,0,0|1,0,1]=4 1004 B12R1.252 C[C@H](O)CCNc1ccccc1 6e2f4bd6880dfbdf2c0288d2956dbdc6 [0,2,0,0,0,0|1,0,1]=4 1005 B12R1.252 C[C@H](O)CNCc1ccccc1 300dc860ca45284f1e63efe30c8515f8 [0,2,0,0,0,0|1,0,1]=4 1006 B12R1.252 ClC(=CCNc1ccccc1)Cl f93ac06425c349741681a1c82b9f122b [0,2,0,0,0,0|2,0,0]=4 1007 B12R1.252 O=C(O)CCNc1ccccc1 ed7f72bbe0b1599eda9c30db2d051414 [0,2,0,0,0,0|1,0,1]=4 1008 B12R1.252 O=C(O)CNCc1ccccc1 db9e4b752c6e68fd22fb535c2b9167d2 [0,2,0,0,0,0|1,0,1]=4 1009 B12R1.252 O=C(O)COCc1ccccc1 a919d4e5b6621fc6b657c329a5a5b2a3 [0,2,0,0,0,0|1,0,1]=4 1010 B12R1.252 O=S(O)CCNc1ccccc1 0ff7b55f6ed3d9a491931fe66155130d [0,2,0,0,0,0|1,0,1]=4 1011 B12R1.252 O=S(O)COCc1ccccc1 b3f70ea663599ebd17c7712fcc9ee3f6 [0,2,0,0,0,0|1,0,1]=4 1012 B12R2.2 c1cc(ccn1)c2ccno2 e60a8ba21562c4093bed7b8c7e55b5d0 [0,1,0,1,0,0|1,0,1]=4 1013 B12R2.2 c1cc(ccn1)c2cnco2 6ec4b90a5f9ce9205c21b4b3f72a8a76 [0,1,0,1,0,0|1,0,1]=4 1014 B12R2.2 c1cc(ccn1)c2cnoc2 7e4377323635cdca99cf8d7b27a54c88 [0,1,0,1,0,0|1,0,1]=4 1015 B12R2.2 c1ccc(cc1)c2c[nH]nn2 a1fb77adff563490f1ed05e60137a346 [0,1,0,1,0,0|1,0,1]=4 1016 B12R2.2 c1ccc(cc1)c2ccco2 67d5bff31c39591a62f72fefb1796923 [0,1,0,1,0,0|1,0,1]=4 1017 B12R2.2 c1ccc(cc1)c2ccno2 43e56304d00da0163b84bc8aac75bf60 [0,1,0,1,0,0|0,0,1]=3 1018 B12R2.2 c1ccc(cc1)c2ccns2 9fe01b29879878645a20197465a91c70 [0,1,0,1,0,0|0,1,1]=4 1019 B12R2.2 c1ccc(cc1)c2ccoc2 943a3166e2c0d8deacea159f1af77584 [0,1,0,1,0,0|1,0,1]=4 1020 B12R2.2 c1ccc(cc1)c2ccon2 f5a7154212377e56a115aa8bde828f0c [0,1,0,1,0,0|1,0,1]=4 1021 B12R2.2 c1ccc(cc1)c2cn[nH]c2 be4a681aed3d612250a8a908fe0c61a6 [0,1,0,1,0,0|1,0,1]=4 1022 B12R2.2 c1ccc(cc1)c2cnco2 2e69350309650d294610cdfd138ca5ee [0,1,0,1,0,0|0,0,1]=3 1023 B12R2.2 c1ccc(cc1)c2cncs2 0159bbc9e5156efd8a149997d4a791d9 [0,1,0,1,0,0|0,1,1]=4 1024 B12R2.2 c1ccc(cc1)c2cnns2 fb2b084bbd736371b3fd77a0d336210d [0,1,0,1,0,0|0,1,1]=4 1025 B12R2.2 c1ccc(cc1)c2cnoc2 a10948557e486353e1e9efd1544a1b7a [0,1,0,1,0,0|0,0,1]=3 1026 B12R2.2 c1ccc(cc1)c2cnsc2 23fa8ce39ce783d9d384a004da139025 [0,1,0,1,0,0|0,1,1]=4 1027 B12R2.2 c1ccc(cc1)c2cnsn2 c0070606933b921c07cef0585421c520 [0,1,0,1,0,0|0,1,1]=4 1028 B12R2.2 c1ccc(cc1)c2csnn2 a396f2ede87df7a4dfd3c834750a19df [0,1,0,1,0,0|1,0,1]=4 1029 B12R2.2 c1ccc(cc1)c2ncco2 a0fc7771bcc722874649153b6d011e45 [0,1,0,1,0,0|1,0,1]=4 1030 B12R2.2 c1ccc(cc1)c2ncns2 e0afff2d11875a6c57688481934ac1f4 [0,1,0,1,0,0|0,1,1]=4 1031 B12R2.2 c1ccc(cc1)c2nnco2 b0f9906170d0b6f7766656d1bdbf553a [0,1,0,1,0,0|1,0,1]=4 1032 B12R2.2 c1ccc(cc1)c2nncs2 9ea8ad8235b072e42096c00fadfecefc [0,1,0,1,0,0|1,0,1]=4 1033 B12R2.2 c1ccc(cc1)n2ccnc2 b5590a048e73d1452d700beebfdfe551 [0,1,0,1,0,0|1,0,1]=4 1034 B12R2.2 c1ccc(cc1)n2ccnn2 50128d2133b4faab9fb20a5e87a80a4c [0,1,0,1,0,0|1,0,1]=4 1035 B12R2.2 c1ccc(nc1)c2ccno2 336b02d275c6e8f22c9afb3fe4a2cfaf [0,1,0,1,0,0|1,0,1]=4 1036 B12R2.2 c1ccc(nc1)c2cnco2 3202bb0835a1a05a036919f9000f25da [0,1,0,1,0,0|1,0,1]=4 1037 B12R2.2 c1ccc(nc1)c2cnoc2 c044388a3c71783d837faa43c10f2487 [0,1,0,1,0,0|1,0,1]=4 1038 B12R2.2 c1cncc(c1)c2ccno2 2e2118eafdf7f5418750adf7ea0574ad [0,1,0,1,0,0|1,0,1]=4 1039 B12R2.2 c1cncc(c1)c2cnco2 39e06c050183ab8abccdf98c613a1875 [0,1,0,1,0,0|1,0,1]=4 1040 B12R2.2 c1cncc(c1)c2cnoc2 1161625b51938de25e0ac404dd2981c4 [0,1,0,1,0,0|1,0,1]=4 1041 B12R2.27 OCN1CC1c2ccccc2 380946bf56a518a4f82b6f06607820f1 [0,1,0,1,0,0|0,0,2]=4 1042 B12R2.27 OCN1C[C@@H]1c2ccccc2 b0131158d23691f2ccd2899d00b705c5 [0,1,0,1,0,0|0,0,2]=4 1043 B12R2.32 OCN1Cc2ccccc2C1 67d53a903b838c41ecebb3a336e33160 [0,1,0,1,0,0|2,0,0]=4 1044 B12R2.1 OCN1CCc2c1cccc2 b6afa4fa6bad5e1cd18ef7eeaa43164b [0,1,0,1,0,0|0,0,2]=4