0 B10R1.66 C=C(Br)CNc1ccco1 46cb655391dd7ee0099e3f68361df23b [0,0,0,0,0,0|3,0,1]=4 1 B10R1.66 C=C(Br)COc1ccco1 d0b6cd16dd8f8a048de010b54cb1126a [0,0,0,0,0,0|3,0,1]=4 2 B10R1.66 C=C(C)CNc1cccs1 d16c7a810bce5bfe2c251346fc272f1b [0,0,0,0,0,0|3,1,0]=4 3 B10R1.66 C=C(C)CNc1ccno1 e81af668258a6501f050fe1cde60bb8a [0,0,0,0,0,0|4,0,0]=4 4 B10R1.66 C=C(C)CNc1ncco1 0ca709ff7fbabcdc574e2630eee794e2 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.66 C=C(C)COc1ccco1 b3f905ff0261eb167bbdc638ad76153d [0,0,0,0,0,0|3,0,0]=3 6 B10R1.66 C=C(C)COc1cccs1 ba490c6192f94efd35b9a3807f014ce8 [0,0,0,0,0,0|3,1,0]=4 7 B10R1.66 C=C(Cl)COc1ccco1 aba02f3358eca90651a93a5b886bb155 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.66 C=C(F)COc1ccco1 a2f9f6f7135fa61d0ed061da3bb59ad7 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.66 CC(=O)CCN1CC=CC1 d04908ad57d8c9933021e4d53682901f [0,0,0,0,0,0|3,0,1]=4 10 B10R1.66 CC(=O)CNc1c[nH]cn1 be2bea778bbeba0f31cba71636f977f9 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.66 CC(=O)CNc1ccco1 a59c8e4ff03257d947231d2e71f4d6c9 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.66 CC(=O)CNc1cccs1 cd83157d86433e62c17b868e5fb1470c [0,0,0,0,0,0|2,1,0]=3 13 B10R1.66 CC(=O)CNc1ccns1 8a92cdd13240b83844dafa37c1c87abc [0,0,0,0,0,0|3,1,0]=4 14 B10R1.66 CC(=O)CNc1ccoc1 f96f84316e97865366e82ff70b21a405 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.66 CC(=O)CNc1ccsc1 264cfd5bd6905699df6036299a4d94ea [0,0,0,0,0,0|4,0,0]=4 16 B10R1.66 CC(=O)CNc1cncs1 08e34da9bd442eefd33450d52d14bc76 [0,0,0,0,0,0|3,1,0]=4 17 B10R1.66 CC(=O)CNc1cscn1 482c21989e7459cf1cfac3954fb324f0 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.66 CC(=O)CNc1nccs1 77a4f07613bba7bf49318b232ac5c431 [0,0,0,0,0,0|3,1,0]=4 19 B10R1.66 CC(=O)NCC1CC=CC1 fc1eefe51a17cea0ec5688a6927b0e1b [0,0,0,0,0,0|2,0,2]=4 20 B10R1.66 CC(=O)NCc1ccco1 88956646aad494b49b38617dc9c4b71b [0,0,0,0,0,0|1,0,0]=1 21 B10R1.66 CC(=O)NCc1cccs1 f628a56aae62b1b399cb045563e5a584 [0,0,0,0,0,0|1,1,0]=2 22 B10R1.66 CC(=O)NCc1ccno1 23171c461f7c76fb2a080276054f467a [0,0,0,0,0,0|2,0,0]=2 23 B10R1.66 CC(=O)NCc1ccns1 f18c0206268e4f0158791ee7d4b44adb [0,0,0,0,0,0|2,1,0]=3 24 B10R1.66 CC(=O)NCc1ccoc1 ce9871ea53622fcc38533d8f5672809d [0,0,0,0,0,0|3,0,0]=3 25 B10R1.66 CC(=O)NCc1ccon1 5c65e5956a6b69a35911040d15d7c19a [0,0,0,0,0,0|3,0,0]=3 26 B10R1.66 CC(=O)NCc1ccsc1 32c7f46af3edcc14e3d5f823406c656c [0,0,0,0,0,0|3,0,0]=3 27 B10R1.66 CC(=O)NCc1ccsn1 612816c731f283ec818c1ce3ed185f54 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.66 CC(=O)NCc1cnco1 2f9cdc814f8776fe414302b1109682db [0,0,0,0,0,0|2,0,0]=2 29 B10R1.66 CC(=O)NCc1cncs1 ec5ecc8d905108c74de005c1c70641d3 [0,0,0,0,0,0|2,1,0]=3 30 B10R1.66 CC(=O)NCc1cnoc1 3a77bef0085ef939cf7657711c85b32d [0,0,0,0,0,0|4,0,0]=4 31 B10R1.66 CC(=O)NCc1cnsc1 5360a9f0ca8024aec48880c0ca08d867 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.66 CC(=O)NCc1cocn1 8ce50f68f5fa07856aef854923c4aaad [0,0,0,0,0,0|3,0,0]=3 33 B10R1.66 CC(=O)NCc1cscn1 7bbb3e803cbe4292859eedd99dcc8b12 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.66 CC(=O)NCc1ncco1 6519ae7ebb18199243fcd7f03af8a730 [0,0,0,0,0,0|2,0,0]=2 35 B10R1.66 CC(=O)NCc1nccs1 d681868309a7cd5cf6bf7a2c5c44b5ed [0,0,0,0,0,0|2,1,0]=3 36 B10R1.66 CC(=O)OCN1CC=CC1 2ac2e6705215aca1421ec87f555a230b [0,0,0,0,0,0|2,1,1]=4 37 B10R1.66 CC(C)COc1ccco1 9a23c54afcd88900faea26a95d44c122 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.66 CC(C)NCc1ccc[nH]1 c8f8c41b508c6a9e408dd2699920d8e8 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.66 CC(C)NCc1ccco1 e2693f4935da627db7fd450f0265afc1 [0,0,0,0,0,0|2,0,1]=3 40 B10R1.66 CC(C)NCc1cccs1 542111b118739a23c6a7d49f5267f947 [0,0,0,0,0,0|2,1,1]=4 41 B10R1.66 CC(C)NCc1ccno1 8048c2b4942dbf51099ed0a206f8f6e8 [0,0,0,0,0,0|3,0,1]=4 42 B10R1.66 CC(C)NCc1cnco1 efb9476d66687f153835d5c1b16a9ef7 [0,0,0,0,0,0|3,0,1]=4 43 B10R1.66 CC(C)NCc1ncco1 05025edf840bc375a3c3e26d0a96ccdf [0,0,0,0,0,0|3,0,1]=4 44 B10R1.66 CC(C)OCc1ccc[nH]1 4dddb07a03dc24f89786ddb418b6d01e [0,0,0,0,0,0|2,1,1]=4 45 B10R1.66 CC(C)OCc1ccco1 e50c3d4d785de91a25589c3a50142414 [0,0,0,0,0,0|1,1,1]=3 46 B10R1.66 CC(C)OCc1cccs1 3e503778417dd68d76dc700a03f16b0b [0,0,0,0,0,0|1,2,1]=4 47 B10R1.66 CC(C)OCc1ccno1 7aa10af430b7d91c055f89d0f51bdadf [0,0,0,0,0,0|2,1,1]=4 48 B10R1.66 CC(C)OCc1cnco1 781339a65a14a684e1aece08a96ac865 [0,0,0,0,0,0|2,1,1]=4 49 B10R1.66 CC(C)OCc1ncco1 1190308edda12fa27f2bcbfd35f45044 [0,0,0,0,0,0|2,1,1]=4 50 B10R1.66 CN(C)COc1ccco1 c10f1087d88a829336b344ddc05de043 [0,0,0,0,0,0|4,0,0]=4 51 B10R1.66 NC(=O)CNc1ccco1 382c54ff125dc94771cf8fb1720983d9 [0,0,0,0,0,0|3,0,0]=3 52 B10R1.66 NC(=O)CNc1cccs1 c1848d6f8f82234eb7410dbb98641bc4 [0,0,0,0,0,0|3,1,0]=4 53 B10R1.66 NC(=O)CNc1ccno1 9acc666c5eefa558f126b1961e956b46 [0,0,0,0,0,0|4,0,0]=4 54 B10R1.66 NC(=O)CNc1ncco1 fbf6a938366b6f1a796a59255db001be [0,0,0,0,0,0|4,0,0]=4 55 B10R1.66 NC(=O)COc1ccco1 1a2e54051ed18393ef61d43ef5486554 [0,0,0,0,0,0|3,0,0]=3 56 B10R1.66 NC(=O)COc1cccs1 6d788ab9a430fdaac4ae196a6438a596 [0,0,0,0,0,0|3,1,0]=4 57 B10R1.66 NC(=O)SCN1CC=CC1 c180ba95d53c0ae574dda18dbb368f3f [0,0,0,0,0,0|3,0,1]=4 58 B10R1.66 O=C(O)CNc1cccs1 4058449a8cebe920b6e952aa38581266 [0,0,0,0,0,0|3,1,0]=4 59 B10R1.66 O=C(O)CNc1ccno1 375180111439d2c3a881638818b3cb4d [0,0,0,0,0,0|4,0,0]=4 60 B10R1.66 O=C(O)CNc1ncco1 9cee89407c4dddbde9fb6861286ad5b4 [0,0,0,0,0,0|4,0,0]=4 61 B10R1.66 O=C(O)COc1ccco1 6b958b8d422d5fb1092e70422390022e [0,0,0,0,0,0|3,0,0]=3 62 B10R1.66 O=C(O)COc1cccs1 21851641d4378df5c5d5c2979c3c711b [0,0,0,0,0,0|3,1,0]=4 63 B10R1.66 O=[N+]([O-])COc1ccco1 539b21af5fa1c2f96f80cb505519c8fc [0,0,0,0,0,0|4,0,0]=4 64 B9R1.12 C=CCOc1ccco1 718f2f5554bee89c19d4febc6556b9e4 [1,0,0,0,0,0|2,0,1]=4 65 B9R1.12 CCCOc1ccco1 892ad9a1c4eda1b2e579e57ab16386c6 [1,0,0,0,0,0|2,0,1]=4 66 B9R1.12 CCNCc1ccc[nH]1 d148947c496d04ba3fda3d28b4738aad [1,0,0,0,0,0|2,0,1]=4 67 B9R1.12 CCNCc1ccco1 4817cc97570de733e3d59f88500c3b37 [1,0,0,0,0,0|1,0,1]=3 68 B9R1.12 CCNCc1cccs1 4bb993aa1ef7b62c5d2b7781bf586f7d [1,0,0,0,0,0|1,1,1]=4 69 B9R1.12 CCNCc1ccno1 e3d071a4a6a6b5a56e413f5bc114cce7 [1,0,0,0,0,0|2,0,1]=4 70 B9R1.12 CCNCc1cnco1 1035caf61cdb047204144eeeaf71318d [1,0,0,0,0,0|2,0,1]=4 71 B9R1.12 CCNCc1ncco1 d59ea2eedd26cb1a330141171d90cbfb [1,0,0,0,0,0|2,0,1]=4 72 B9R1.12 CCOCc1ccc[nH]1 0b5c52ca398d6e6823ab9d1f4fb92621 [1,0,0,0,0,0|1,1,1]=4 73 B9R1.12 CCOCc1ccco1 e774f039f2ee21ec2e9d047bdeb979aa [1,0,0,0,0,0|0,1,1]=3 74 B9R1.12 CCOCc1cccs1 8766881c6db57c6784fc6c93385667d4 [1,0,0,0,0,0|0,2,1]=4 75 B9R1.12 CCOCc1ccno1 68fd73c165a46ff5a6360ea6e6f9c37e [1,0,0,0,0,0|1,1,1]=4 76 B9R1.12 CCOCc1cnco1 682660b9b5fafc169b6b4f8ad83fea44 [1,0,0,0,0,0|1,1,1]=4 77 B9R1.12 CCOCc1ncco1 7b912d50833e4919d9e0630ebdd06bd0 [1,0,0,0,0,0|1,1,1]=4 78 B9R1.12 COCOc1ccco1 e04897991e5b5a23be25371e2fdd1455 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.12 CSCOc1ccco1 1390e2388610ba4d2a6a9c5a27789bf5 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.12 FCNCc1ccco1 15cf0ef1c142117a022de7e1d8123caa [1,0,0,0,0,0|2,0,1]=4 81 B9R1.12 FCOCc1ccco1 c04c3f12cfd8e7c8e05bcf1ef27a3e13 [1,0,0,0,0,0|1,1,1]=4 82 B9R1.12 N#CNCc1ccco1 4a29a0cee61f6ca4469fdc18ecac181f [1,0,0,0,0,0|2,0,1]=4 83 B9R1.12 O=CCNc1cccs1 60a129f7ce0ed47960cff2a58ff45c1c [1,0,0,0,0,0|2,1,0]=4 84 B9R1.12 O=CCNc1ccno1 d89beb34e7299bb5546d81c088f021b3 [1,0,0,0,0,0|3,0,0]=4 85 B9R1.12 O=CCNc1ncco1 a903c622426cd77e9fe9761a3cc7b9bd [1,0,0,0,0,0|3,0,0]=4 86 B9R1.12 O=CCOc1ccco1 1e74f64104a9bfe1c6a709b4cd3c3941 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.12 O=CCOc1cccs1 8bfa681cbb01e0a1759e3c960c15aeb1 [1,0,0,0,0,0|2,1,0]=4 88 B9R1.12 O=CNCc1ccco1 500b938a7f3d3a911f6dbf809f17e808 [1,0,0,0,0,0|1,0,0]=2 89 B9R1.12 O=CNCc1cccs1 fecfb8c88f46a0100ee636a1638f8376 [1,0,0,0,0,0|1,1,0]=3 90 B9R1.12 O=CNCc1ccno1 1d96e0438d070b6a30ebeea53435d039 [1,0,0,0,0,0|2,0,0]=3 91 B9R1.12 O=CNCc1ccns1 9a0562bc3120ef88df4d92b0ab42240f [1,0,0,0,0,0|2,1,0]=4 92 B9R1.12 O=CNCc1ccoc1 2c2ecd250ae8d80c965c3936a532f64f [1,0,0,0,0,0|3,0,0]=4 93 B9R1.12 O=CNCc1ccon1 05a7c7357b01af9907ee2695fef4fb77 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.12 O=CNCc1ccsc1 71d20289537e24af987dd9a4d89d93c2 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.12 O=CNCc1ccsn1 444c9355991d0957139525c9d0279686 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.12 O=CNCc1cnco1 ee7ea837847f21c2df5abd28f3d73bda [1,0,0,0,0,0|2,0,0]=3 97 B9R1.12 O=CNCc1cncs1 20afedbba0f28c6c3d07abf84cac939f [1,0,0,0,0,0|2,1,0]=4 98 B9R1.12 O=CNCc1cocn1 42478e097d60710681f75d45a49c9050 [1,0,0,0,0,0|3,0,0]=4 99 B9R1.12 O=CNCc1cscn1 41d80a5eda7e9f8599d0e415e67384b2 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.12 O=CNCc1ncco1 ae229f156f358694ec9fa8df5fdba020 [1,0,0,0,0,0|2,0,0]=3 101 B9R1.12 O=CNCc1nccs1 d021f154403f9d3ac1cd2b03fa215329 [1,0,0,0,0,0|2,1,0]=4 102 B9R1.12 OCNCc1ccco1 65cac21f3029c35a0c20d324fb578c01 [1,0,0,0,0,0|1,0,2]=4 103 B11R1.25 C#CC(=O)NCc1ccco1 f79a75d4df58eff9958cbaeb2a982bad [0,1,0,0,0,0|1,0,1]=3 104 B11R1.25 C#CC(=O)NCc1cccs1 55da29a59c71299db91d52631de92dcd [0,1,0,0,0,0|1,1,1]=4 105 B11R1.25 C#CC(=O)NCc1ccno1 1eecf9f06adb03fada14ecbac97a5071 [0,1,0,0,0,0|2,0,1]=4 106 B11R1.25 C#CC(=O)NCc1cnco1 e114d763ea4b0325152aa19a56481c42 [0,1,0,0,0,0|2,0,1]=4 107 B11R1.25 C#CC(=O)NCc1ncco1 dc7d5f01ceb8c0d3fc9326a19507d27a [0,1,0,0,0,0|2,0,1]=4 108 B11R1.25 C#CC(C)NCc1ccco1 0c78173dc55d1cacab0d7b766e528b77 [0,1,0,0,0,0|2,0,1]=4 109 B11R1.25 C#CC(C)OCc1ccco1 87c7710414e7042aedcd76d47a657537 [0,1,0,0,0,0|1,1,1]=4 110 B11R1.25 C#C[C@@H](C)NCc1ccco1 8ee2af49e18acd6351140a60399b99d6 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.25 C#C[C@@H](C)OCc1ccco1 a07315369afedd816b332f25d0ec6e51 [0,1,0,0,0,0|1,1,1]=4 112 B11R1.25 C#C[C@H](C)NCc1ccco1 cedf5f99927cd7769dcaac246b678b46 [0,1,0,0,0,0|2,0,1]=4 113 B11R1.25 C#C[C@H](C)OCc1ccco1 7da392aa09b76585a733a644864632b0 [0,1,0,0,0,0|1,1,1]=4 114 B11R1.25 C=C(C=O)OCc1ccco1 747f2f76c41ad20f9b847b41d5cdb747 [0,1,0,0,0,0|0,1,1]=3 115 B11R1.25 C=C(C=O)OCc1cccs1 53273e7a9753d61aba82daf7053c426a [0,1,0,0,0,0|0,2,1]=4 116 B11R1.25 C=C(C=O)OCc1ccno1 ab03eb1b0a72a495fab96fa928e612b4 [0,1,0,0,0,0|1,1,1]=4 117 B11R1.25 C=C(C=O)OCc1cnco1 7d8588cf440826de76862fe7783881d2 [0,1,0,0,0,0|1,1,1]=4 118 B11R1.25 C=C(C=O)OCc1ncco1 a5846ec3fbe176e4e5101db68d0e0c89 [0,1,0,0,0,0|1,1,1]=4 119 B11R1.25 C=C(CC)COc1ccco1 8404942ce0c127109105c4a4a2ae6d42 [0,1,0,0,0,0|3,0,0]=4 120 B11R1.25 C=C(COc1ccco1)OC 2bb75599a2450eeb215a4f785b4688eb [0,1,0,0,0,0|3,0,0]=4 121 B11R1.25 C=CC(=O)NCc1ccco1 f8a603b31f64c191fd76f8194a2fbbd6 [0,1,0,0,0,0|1,0,1]=3 122 B11R1.25 C=CC(=O)NCc1cccs1 ccf456ef5e27084f994cff41b5267371 [0,1,0,0,0,0|1,1,1]=4 123 B11R1.25 C=CC(=O)NCc1ccno1 2bfcdf59744e8ced317f50e3b7c3c8e7 [0,1,0,0,0,0|2,0,1]=4 124 B11R1.25 C=CC(=O)NCc1cnco1 81ebfe8ca83fa7a7ff89235a042d478a [0,1,0,0,0,0|2,0,1]=4 125 B11R1.25 C=CC(=O)NCc1ncco1 9d4cfd42cbc64e77c762973cf8e96e96 [0,1,0,0,0,0|2,0,1]=4 126 B11R1.25 C=CC(C)NCc1ccco1 70cbfe9701e2df3ead85af2ea011223c [0,1,0,0,0,0|2,0,1]=4 127 B11R1.25 C=CC(C)OCc1ccco1 6f8c46a49552c5e29e7b8018db9931e7 [0,1,0,0,0,0|1,1,1]=4 128 B11R1.25 C=C[C@H](C)OCc1ccco1 d604a40f94494274db2b4cd86ad08ce7 [0,1,0,0,0,0|1,1,1]=4 129 B11R1.25 CC(C#N)NCc1ccco1 faed7e342921344337d95550d424b482 [0,1,0,0,0,0|2,0,1]=4 130 B11R1.25 CC(C=O)NCc1ccc[nH]1 5db4e89fead4887e4d499882f658aa91 [0,1,0,0,0,0|2,0,1]=4 131 B11R1.25 CC(C=O)NCc1ccco1 8ea485d4b6d1c57031030ef36dfb5983 [0,1,0,0,0,0|1,0,1]=3 132 B11R1.25 CC(C=O)NCc1cccs1 6368b189b8ed1ed2464ffdb622d1444f [0,1,0,0,0,0|1,1,1]=4 133 B11R1.25 CC(C=O)NCc1ccno1 cd4ea3f459349b696ec95de0693b0108 [0,1,0,0,0,0|2,0,1]=4 134 B11R1.25 CC(C=O)NCc1cnco1 f587ea8a3ce099218178fac55f42f46d [0,1,0,0,0,0|2,0,1]=4 135 B11R1.25 CC(C=O)NCc1ncco1 d2260ccfef700d4fabb919c883efc4fd [0,1,0,0,0,0|2,0,1]=4 136 B11R1.25 CC(C=O)OCc1ccc[nH]1 8844092793f0a6bf7ad64ce6452d4b62 [0,1,0,0,0,0|1,1,1]=4 137 B11R1.25 CC(C=O)OCc1ccco1 710611fcec921a10f65607f72aaacd05 [0,1,0,0,0,0|0,1,1]=3 138 B11R1.25 CC(C=O)OCc1cccs1 e2f1f17fd0c90954e0e29f101f0ec90e [0,1,0,0,0,0|0,2,1]=4 139 B11R1.25 CC(C=O)OCc1ccno1 ceb711e58d1d12fffb331a0031fbd0b0 [0,1,0,0,0,0|1,1,1]=4 140 B11R1.25 CC(C=O)OCc1cnco1 7bbdae3be049af24516accbe022c3eeb [0,1,0,0,0,0|1,1,1]=4 141 B11R1.25 CC(C=O)OCc1ncco1 19a9fe06438eb321dc2405837b46d530 [0,1,0,0,0,0|1,1,1]=4 142 B11R1.25 CC(CF)OCc1ccco1 7a6c9d5edc9a65d3a477e45540cf06b6 [0,1,0,0,0,0|1,1,1]=4 143 B11R1.25 CC(CO)NCc1ccco1 e11a1dcc997402b9ca10ebd6c1d728d8 [0,1,0,0,0,0|1,0,2]=4 144 B11R1.25 CCC(=O)CNc1cccs1 b4fbace754947742811c99821187431d [0,1,0,0,0,0|2,1,0]=4 145 B11R1.25 CCC(=O)CNc1ccno1 88b6fa67dbfd5e0c949f8969664ed5d2 [0,1,0,0,0,0|3,0,0]=4 146 B11R1.25 CCC(=O)CNc1ncco1 76440fc14e6f7ad0dd7140ac3ef610d7 [0,1,0,0,0,0|3,0,0]=4 147 B11R1.25 CCC(=O)COc1ccco1 84a63c846c70eaac9456a85969f85a7b [0,1,0,0,0,0|2,0,0]=3 148 B11R1.25 CCC(=O)COc1cccs1 62a1dd7ee9a489d60b74777043a9f2b4 [0,1,0,0,0,0|2,1,0]=4 149 B11R1.25 CCC(=O)NCc1ccco1 83a3424c0a2cb7e1166334a3685172c7 [0,1,0,0,0,0|1,0,0]=2 150 B11R1.25 CCC(=O)NCc1cccs1 6c557a7153df782ceae55abb6bb418b3 [0,1,0,0,0,0|1,1,0]=3 151 B11R1.25 CCC(=O)NCc1ccno1 58322e28c7a6659b50819a81f4c4c933 [0,1,0,0,0,0|2,0,0]=3 152 B11R1.25 CCC(=O)NCc1ccns1 c9819aa535efeca49d7cabc83ef3ae5b [0,1,0,0,0,0|2,1,0]=4 153 B11R1.25 CCC(=O)NCc1ccoc1 019db0a416f511a8b3ab418f0ee7c227 [0,1,0,0,0,0|3,0,0]=4 154 B11R1.25 CCC(=O)NCc1ccon1 6366e92ed1a88ce0e764c86b71f0715e [0,1,0,0,0,0|3,0,0]=4 155 B11R1.25 CCC(=O)NCc1ccsc1 bd625af66957d2181c6a9ef822ab4133 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.25 CCC(=O)NCc1ccsn1 936b35ef40f1061cb499b9d85b850543 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.25 CCC(=O)NCc1cnco1 761288d4d2fa2ef7d951297da2e35f88 [0,1,0,0,0,0|2,0,0]=3 158 B11R1.25 CCC(=O)NCc1cncs1 642bc0d4cafddf9cfcfcd52e8a1581c9 [0,1,0,0,0,0|2,1,0]=4 159 B11R1.25 CCC(=O)NCc1cocn1 3cd8317583d3b66432aef148bb9d4668 [0,1,0,0,0,0|3,0,0]=4 160 B11R1.25 CCC(=O)NCc1cscn1 bf38b5d479d0b75d3c0776e9b580e1e0 [0,1,0,0,0,0|3,0,0]=4 161 B11R1.25 CCC(=O)NCc1ncco1 e578991323529f456c684a1a876e4365 [0,1,0,0,0,0|2,0,0]=3 162 B11R1.25 CCC(=O)NCc1nccs1 ef8f755cf84c310f41b86bcd4a497d12 [0,1,0,0,0,0|2,1,0]=4 163 B11R1.25 CCC(C)NCc1ccco1 5f8142dfde0b789474d1611a11bd8a03 [0,1,0,0,0,0|2,0,1]=4 164 B11R1.25 CCC(C)OCc1ccco1 1d3865e51cab5c0be5992c253ab61007 [0,1,0,0,0,0|1,1,1]=4 165 B11R1.25 CC[C@@H](C)OCc1ccco1 a76b1dfd367e870139dad05cc969c789 [0,1,0,0,0,0|1,1,1]=4 166 B11R1.25 CC[C@H](C)OCc1ccco1 f9cdf73fec17b5adbe5d6d95690f8ec6 [0,1,0,0,0,0|1,1,1]=4 167 B11R1.25 CN(C=O)CCc1cccs1 2d56ad68d9909e2002ac43c88c0f1e93 [0,1,0,0,0,0|2,1,0]=4 168 B11R1.25 CNC(=O)CNc1ccco1 9fb8fe20e0faec38b11cfc6e904e8b91 [0,1,0,0,0,0|2,0,0]=3 169 B11R1.25 CNC(=O)CNc1cccs1 6f087d70dc1595761c626ef8cc8ed2e1 [0,1,0,0,0,0|2,1,0]=4 170 B11R1.25 CNC(=O)CNc1ccno1 7de6ef8f9830186d017f4e880d3de9ba [0,1,0,0,0,0|3,0,0]=4 171 B11R1.25 CNC(=O)CNc1ncco1 ceeb9335263c80021a1974fd2776fefd [0,1,0,0,0,0|3,0,0]=4 172 B11R1.25 CNC(=O)COc1ccco1 8de653ac0ba8299d76630db6851014dc [0,1,0,0,0,0|2,0,0]=3 173 B11R1.25 CNC(=O)COc1cccs1 591444907ff3d0e617e25662bdc82222 [0,1,0,0,0,0|2,1,0]=4 174 B11R1.25 COC(=O)CNc1ccco1 3a8934ef990493a0e0bc38424c480317 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.25 COC(=O)CNc1cccs1 59d52dc657b50ac2b04e7700320d3026 [0,1,0,0,0,0|2,1,0]=4 176 B11R1.25 COC(=O)CNc1ccno1 2d1a89cf719dc404cd856267b5c680c3 [0,1,0,0,0,0|3,0,0]=4 177 B11R1.25 COC(=O)CNc1ncco1 feededd87b0a92f1d612ca2091d69650 [0,1,0,0,0,0|3,0,0]=4 178 B11R1.25 COC(=O)COc1ccco1 7e5bb533074d72185d76d28364661292 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.25 COC(=O)COc1cccs1 700d40abb2597ef2d3922f15e3e62a6a [0,1,0,0,0,0|2,1,0]=4 180 B11R1.25 C[C@@H](CO)NCc1ccco1 2b9b1d2922178f6f79ded161cd99a8d3 [0,1,0,0,0,0|1,0,2]=4 181 B11R1.25 C[C@H](C=O)NCc1ccc[nH]1 fc3e9f5aaed48bdcb2036f81cd3b21bd [0,1,0,0,0,0|2,0,1]=4 182 B11R1.25 C[C@H](C=O)NCc1ccco1 b0a84eebe7be135256eaaef882aa33a2 [0,1,0,0,0,0|1,0,1]=3 183 B11R1.25 C[C@H](C=O)NCc1cccs1 f1b634559d3c233eca5b084f151981a9 [0,1,0,0,0,0|1,1,1]=4 184 B11R1.25 C[C@H](C=O)NCc1ccno1 d32f2d975e5d3e095580807f2a4924e5 [0,1,0,0,0,0|2,0,1]=4 185 B11R1.25 C[C@H](C=O)NCc1cnco1 6c30c33f3a61ad345f7f6c87fd6d5390 [0,1,0,0,0,0|2,0,1]=4 186 B11R1.25 C[C@H](C=O)NCc1ncco1 1727fb6721fad79125d86e3d9d321315 [0,1,0,0,0,0|2,0,1]=4 187 B11R1.25 C[C@H](C=O)OCc1ccc[nH]1 5dd28ca69b96658363ecfb666d7724b3 [0,1,0,0,0,0|1,1,1]=4 188 B11R1.25 C[C@H](C=O)OCc1ccco1 838c9bf3f58f5510bcb9fffbefec1241 [0,1,0,0,0,0|0,1,1]=3 189 B11R1.25 C[C@H](C=O)OCc1cccs1 b73d770e559d720c16e6aeb8d7811078 [0,1,0,0,0,0|0,2,1]=4 190 B11R1.25 C[C@H](C=O)OCc1ccno1 ff3a209c0f1016a7ca29046a2e18d2b4 [0,1,0,0,0,0|1,1,1]=4 191 B11R1.25 C[C@H](C=O)OCc1cnco1 ef220e449255617ad810056f3d2e4792 [0,1,0,0,0,0|1,1,1]=4 192 B11R1.25 C[C@H](C=O)OCc1ncco1 e3f8a0ad1564baea118d478200947d2b [0,1,0,0,0,0|1,1,1]=4 193 B11R1.25 C[C@H](CO)NCc1ccco1 d1c1d3584d51f54226efd246214dd928 [0,1,0,0,0,0|1,0,2]=4 194 B11R1.25 O=C(CF)NCc1ccco1 84588230b201d06c07b9a063871937ae [0,1,0,0,0,0|1,0,0]=2 195 B11R1.25 O=C(CF)NCc1cccs1 da3b7d350577e65c6692e055abd20b60 [0,1,0,0,0,0|1,1,0]=3 196 B11R1.25 O=C(CF)NCc1ccno1 255d6a6a39d938810e6068ff2672be5d [0,1,0,0,0,0|2,0,0]=3 197 B11R1.25 O=C(CF)NCc1ccns1 e7afc4c9dd0ec12d2e68a57fb2e6948c [0,1,0,0,0,0|2,1,0]=4 198 B11R1.25 O=C(CF)NCc1ccoc1 ee18e79d18c08f82e769110a246415f4 [0,1,0,0,0,0|3,0,0]=4 199 B11R1.25 O=C(CF)NCc1ccon1 8e3f18af0e387fd5ef1578659466f4a4 [0,1,0,0,0,0|3,0,0]=4 200 B11R1.25 O=C(CF)NCc1ccsc1 999794e8e8b9dc6569a4f36d92556c30 [0,1,0,0,0,0|3,0,0]=4 201 B11R1.25 O=C(CF)NCc1ccsn1 456fd923ad4b24ee377b397ded128630 [0,1,0,0,0,0|3,0,0]=4 202 B11R1.25 O=C(CF)NCc1cnco1 834f7a691045406b4654f82ac39bca96 [0,1,0,0,0,0|2,0,0]=3 203 B11R1.25 O=C(CF)NCc1cncs1 80931ed98c091c0d44e0eda3301389b2 [0,1,0,0,0,0|2,1,0]=4 204 B11R1.25 O=C(CF)NCc1cocn1 eb5e480675259b80b46bee9e192abea5 [0,1,0,0,0,0|3,0,0]=4 205 B11R1.25 O=C(CF)NCc1cscn1 83e1f932e5b4631f2f82e6ba67bb43df [0,1,0,0,0,0|3,0,0]=4 206 B11R1.25 O=C(CF)NCc1ncco1 268b9a58e234628a13e01d0df574f804 [0,1,0,0,0,0|2,0,0]=3 207 B11R1.25 O=C(CF)NCc1nccs1 b432e279a864a8c6caf38f0121f197d3 [0,1,0,0,0,0|2,1,0]=4 208 B11R1.25 O=C(CNc1ccco1)NO 0a52081a67fc28cf2437bd0732b582b4 [0,1,0,0,0,0|3,0,0]=4 209 B11R1.25 O=C(CO)CNc1cccs1 2fa55ac8bbb5c873ad00e48a9966c29f [0,1,0,0,0,0|2,1,0]=4 210 B11R1.25 O=C(CO)CNc1ccno1 194d740518c48fa3d3bb3b01365770e1 [0,1,0,0,0,0|3,0,0]=4 211 B11R1.25 O=C(CO)CNc1ncco1 a77c7f1da0fa7ae8f9927e6aed614ed2 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.25 O=C(CO)NCc1ccco1 df70aa8594e340b9ca90aef387447fda [0,1,0,0,0,0|1,0,0]=2 213 B11R1.25 O=C(CO)NCc1cccs1 99ae0ae91c0a822e251b5bff14f6cde8 [0,1,0,0,0,0|1,1,0]=3 214 B11R1.25 O=C(CO)NCc1ccno1 809b66daea05c8d38ce5a5d49e845c8f [0,1,0,0,0,0|2,0,0]=3 215 B11R1.25 O=C(CO)NCc1ccns1 f3ce9a34048914e078a8c8b6b118b458 [0,1,0,0,0,0|2,1,0]=4 216 B11R1.25 O=C(CO)NCc1ccoc1 1d24d44a2f749ebcb98e10358aad542b [0,1,0,0,0,0|3,0,0]=4 217 B11R1.25 O=C(CO)NCc1ccon1 3abafc1beef1a9251f31610b9598d86e [0,1,0,0,0,0|3,0,0]=4 218 B11R1.25 O=C(CO)NCc1ccsc1 cb06569039dcd858c5bdfd9bf3d31c2f [0,1,0,0,0,0|3,0,0]=4 219 B11R1.25 O=C(CO)NCc1ccsn1 35f66b5178aa1b1e96ec67df0d768af2 [0,1,0,0,0,0|3,0,0]=4 220 B11R1.25 O=C(CO)NCc1cnco1 4a13a21d3b08dc48052a719f6e101dbd [0,1,0,0,0,0|2,0,0]=3 221 B11R1.25 O=C(CO)NCc1cncs1 ed003aa244bdb50fb4baaedf7d0fc0f9 [0,1,0,0,0,0|2,1,0]=4 222 B11R1.25 O=C(CO)NCc1cocn1 833600ada4942dcdce11c47084de5e9d [0,1,0,0,0,0|3,0,0]=4 223 B11R1.25 O=C(CO)NCc1cscn1 78c572a6e258cb111e5ab976305bedbb [0,1,0,0,0,0|3,0,0]=4 224 B11R1.25 O=C(CO)NCc1ncco1 e3899f38fa2e20a5067a6a3ba3371079 [0,1,0,0,0,0|2,0,0]=3 225 B11R1.25 O=C(CO)NCc1nccs1 65d54e94672af8f9f1f2be1a10536bcf [0,1,0,0,0,0|2,1,0]=4 226 B11R1.25 O=C(CS)NCc1ccco1 cd6653eaf0be7fe394f59c7de3df0476 [0,1,0,0,0,0|1,0,0]=2 227 B11R1.25 O=C(CS)NCc1cccs1 ae334004146e0d855e3ddc67faa76e34 [0,1,0,0,0,0|1,1,0]=3 228 B11R1.25 O=C(CS)NCc1ccno1 7390f0b0049973908a31373e437056e9 [0,1,0,0,0,0|2,0,0]=3 229 B11R1.25 O=C(CS)NCc1ccns1 a8d320d776e8a1c68a449cca94e432f2 [0,1,0,0,0,0|2,1,0]=4 230 B11R1.25 O=C(CS)NCc1ccoc1 cc0c00e6ddc84708c6a4771c644d15c1 [0,1,0,0,0,0|3,0,0]=4 231 B11R1.25 O=C(CS)NCc1ccon1 0e892af5f298334721b172899462d0c0 [0,1,0,0,0,0|3,0,0]=4 232 B11R1.25 O=C(CS)NCc1ccsc1 552fd1f32031663f3cfb3aa2c1894246 [0,1,0,0,0,0|3,0,0]=4 233 B11R1.25 O=C(CS)NCc1ccsn1 734448866b2445dd8aa95d14a3a892cd [0,1,0,0,0,0|3,0,0]=4 234 B11R1.25 O=C(CS)NCc1cnco1 5b69c69190507355ecac8f4ec6d4f2df [0,1,0,0,0,0|2,0,0]=3 235 B11R1.25 O=C(CS)NCc1cncs1 f1e539095d224c77037ada0076ba92a4 [0,1,0,0,0,0|2,1,0]=4 236 B11R1.25 O=C(CS)NCc1cocn1 f8900bc7cc73ce9bed4993932f4d1be2 [0,1,0,0,0,0|3,0,0]=4 237 B11R1.25 O=C(CS)NCc1cscn1 8bee3b4d4996b12ec4da076c3c72f320 [0,1,0,0,0,0|3,0,0]=4 238 B11R1.25 O=C(CS)NCc1ncco1 8d62f9204c654f67f617562ca66be425 [0,1,0,0,0,0|2,0,0]=3 239 B11R1.25 O=C(CS)NCc1nccs1 e18ca2c3e41a5414ef567bfc9ee78b0a [0,1,0,0,0,0|2,1,0]=4 240 B11R1.25 O=CC(=O)NCc1ccco1 d2dc8ba1c1dc2bd9370b2891085f68aa [0,1,0,0,0,0|1,0,1]=3 241 B11R1.25 O=CC(=O)NCc1cccs1 b8ae8f336278764c8ae470b9e27a5baf [0,1,0,0,0,0|1,1,1]=4 242 B11R1.25 O=CC(=O)NCc1ccno1 bf7e2bd1dd4d6f79d1431d80dfba865a [0,1,0,0,0,0|2,0,1]=4 243 B11R1.25 O=CC(=O)NCc1cnco1 fbef874aa8c38bb8e00bce68ab9517f2 [0,1,0,0,0,0|2,0,1]=4 244 B11R1.25 O=CC(=O)NCc1ncco1 d6681d65fff6e118bf41e332fcb2c91d [0,1,0,0,0,0|2,0,1]=4 245 B11R1.35 CC(=O)C(=O)Nc1cccs1 de6d70e3306c47e09cb36ff931517690 [0,1,0,0,0,0|2,1,0]=4 246 B11R1.35 CC(=O)C(=O)Nc1ccno1 eef72884d901d25f0c5eceafa48827eb [0,1,0,0,0,0|3,0,0]=4 247 B11R1.35 CC(=O)C(=O)Nc1ncco1 1951beb575cdea14f51dfb91f1315f40 [0,1,0,0,0,0|3,0,0]=4 248 B11R1.35 CC(=O)C(C)Nc1ccno1 95b34b55777b87672e923fe19e39c761 [0,1,0,0,0,0|3,0,0]=4 249 B11R1.35 CC(=O)C(C)Nc1ncco1 775586ee3024e3c0d67456f36e102a07 [0,1,0,0,0,0|3,0,0]=4 250 B11R1.35 CC(=O)C(C)Oc1ccco1 a56d48d537b56e6d77399f0c0c673bb2 [0,1,0,0,0,0|2,0,0]=3 251 B11R1.35 CC(=O)N(C)Cc1ccco1 595130f102a13741ef8c5e6d70797c2c [0,1,0,0,0,0|1,0,0]=2 252 B11R1.35 CC(=O)N(C)Cc1cccs1 0772ccd40fb0e419289038500ce1ac59 [0,1,0,0,0,0|1,1,0]=3 253 B11R1.35 CC(=O)N(C)Cc1ccno1 79d5db58fe26c759732992525b8134eb [0,1,0,0,0,0|2,0,0]=3 254 B11R1.35 CC(=O)N(C)Cc1ccoc1 5cbb32d1835ea7ec1049d53c7ac44884 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.35 CC(=O)N(C)Cc1ccsc1 823f62cacd71cae7b515ff7fa707b235 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.35 CC(=O)N(C)Cc1cncs1 6583c908276bf2b2de03b941c6c544c5 [0,1,0,0,0,0|2,1,0]=4 257 B11R1.35 CC(=O)N(C)Cc1ncco1 03c185527acb051596e25be641bafa58 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.35 CC(=O)N(C)Cc1nccs1 94ddf6672d43a9a3d00ecd27fbe0a253 [0,1,0,0,0,0|2,1,0]=4 259 B11R1.35 CC(C)N(C)Cc1ccco1 cee0dc5c5544607301dd1c2d555bd4e1 [0,1,0,0,0,0|2,0,1]=4 260 B11R1.35 CC(Nc1ccco1)C(=O)N 21482bd34d4a2dafa2d3162f804897b0 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.35 CC(Oc1ccco1)C(=O)N 0ef6af18494e5b6ec1eeb7dff9bb07b6 [0,1,0,0,0,0|3,0,0]=4 262 B11R1.35 C[C@@H](Nc1ccco1)C(=O)N d8f34946d3e641ebfbd2e95882ef9923 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.35 C[C@H](Nc1ccco1)C(=O)N 30436b14ff4e5a5172c84caee18f519a [0,1,0,0,0,0|3,0,0]=4 264 B11R1.35 NC(=O)C(F)Oc1ccco1 d0138be09905b3b17d03bc038e7cdb64 [0,1,0,0,0,0|3,0,0]=4 265 B11R1.75 C=C(C)CNc1cc(co1)C 9a824af34ef512c1875933c4ffb872d0 [0,1,0,0,0,0|3,0,0]=4 266 B11R1.75 C=C(C)CNc1ccc(o1)C 38f43c55846fca3b94b16190a890c79f [0,1,0,0,0,0|3,0,0]=4 267 B11R1.75 CC(=O)CNc1ccc(o1)C a2d4efbcab84d7259315a868deaaa873 [0,1,0,0,0,0|2,0,0]=3 268 B11R1.75 CC(=O)CNc1ccc(s1)C dc48b32a35ca60a3449a92a01b93fb89 [0,1,0,0,0,0|2,1,0]=4 269 B11R1.75 CC(=O)CNc1ccc(s1)F 8479726e6cdfee7e3880572c1d14a94a [0,1,0,0,0,0|2,1,0]=4 270 B11R1.75 CC(=O)NCc1cc(co1)C c264239ea631634196e8ffbc272a6263 [0,1,0,0,0,0|1,0,0]=2 271 B11R1.75 CC(=O)NCc1cc(cs1)Br f821fa34e12e09cd1e600dc31015c2eb [0,1,0,0,0,0|1,1,0]=3 272 B11R1.75 CC(=O)NCc1cc(cs1)C 0d4b575a1b11cb6ea4b4be7c6d495674 [0,1,0,0,0,0|1,1,0]=3 273 B11R1.75 CC(=O)NCc1cc(cs1)Cl 3a2517ce3e79620b78862bd11b65a507 [0,1,0,0,0,0|1,1,0]=3 274 B11R1.75 CC(=O)NCc1cc(no1)C 66072dfdb9c147a93624cd403a09db31 [0,1,0,0,0,0|2,0,0]=3 275 B11R1.75 CC(=O)NCc1cc(ns1)Br 29adea8a1289d3bad7f75e4dab5f1cd6 [0,1,0,0,0,0|2,1,0]=4 276 B11R1.75 CC(=O)NCc1cc(ns1)C f0fba7dd661896c9a6a1b45c70d7909c [0,1,0,0,0,0|2,1,0]=4 277 B11R1.75 CC(=O)NCc1cc(on1)C 47e01145468070a6948ba2a9f3c33435 [0,1,0,0,0,0|3,0,0]=4 278 B11R1.75 CC(=O)NCc1cc(sn1)Br ae8cb576e4e1ad66bc2d02d70a7dbdb3 [0,1,0,0,0,0|3,0,0]=4 279 B11R1.75 CC(=O)NCc1ccc(o1)Br 6e710dbc8a7ab5ca5f302eac2d542d29 [0,1,0,0,0,0|1,0,0]=2 280 B11R1.75 CC(=O)NCc1ccc(o1)C b13cd0bd40ca6cf6e3c39d68d12bdda4 [0,1,0,0,0,0|1,0,0]=2 281 B11R1.75 CC(=O)NCc1ccc(s1)Br ef690d997add5e800fffb852f10def11 [0,1,0,0,0,0|1,1,0]=3 282 B11R1.75 CC(=O)NCc1ccc(s1)C fbe57bc2ff3d0b0d111a80584c69c601 [0,1,0,0,0,0|1,1,0]=3 283 B11R1.75 CC(=O)NCc1ccc(s1)Cl 8946dbc6989b3b104bd57098260101ef [0,1,0,0,0,0|1,1,0]=3 284 B11R1.75 CC(=O)NCc1ccc(s1)F c9981b70a243f88d2eb4fb9ce9558f87 [0,1,0,0,0,0|1,1,0]=3 285 B11R1.75 CC(=O)NCc1ccn(n1)C 9c7726a559ff94859d378348f5cedd5c [0,1,0,0,0,0|3,0,0]=4 286 B11R1.75 CC(=O)NCc1cn(cn1)C fc0c1bb0ffb8b35be6e2cf440ac8d967 [0,1,0,0,0,0|3,0,0]=4 287 B11R1.75 CC(=O)NCc1cnc(o1)C c884235d974f23eff843a6ec5da668ea [0,1,0,0,0,0|2,0,0]=3 288 B11R1.75 CC(=O)NCc1cnc(s1)Br f1cf6ace0e9592d1484a8dbaa052e1ae [0,1,0,0,0,0|2,1,0]=4 289 B11R1.75 CC(=O)NCc1cnc(s1)C b73e1aa9a71048ee3690df81db487142 [0,1,0,0,0,0|2,1,0]=4 290 B11R1.75 CC(=O)NCc1cnc(s1)Cl 7d2d9761c556b27c25cd7bcb9fe984c2 [0,1,0,0,0,0|2,1,0]=4 291 B11R1.75 CC(=O)NCc1coc(n1)C f68086b8999937e17da266e4f80df767 [0,1,0,0,0,0|3,0,0]=4 292 B11R1.75 CC(=O)NCc1csc(c1)Br 25d212c98737f32c95cd9f989e3c66f1 [0,1,0,0,0,0|3,0,0]=4 293 B11R1.75 CC(=O)NCc1csc(c1)Cl 4e85ec7c6bd728ce7a81f9aeeb6b5ce6 [0,1,0,0,0,0|3,0,0]=4 294 B11R1.75 CC(=O)NCc1csc(n1)Br 2fe72f13d7a047cef5ff1aed1ba7470a [0,1,0,0,0,0|3,0,0]=4 295 B11R1.75 CC(=O)NCc1csc(n1)C c8f56a84ab8a5c807766e5951d1f100b [0,1,0,0,0,0|3,0,0]=4 296 B11R1.75 CC(=O)NCc1csc(n1)Cl 1dede6422f7721b80462854645c31b2f [0,1,0,0,0,0|3,0,0]=4 297 B11R1.75 CC(=O)NCc1nc(co1)C 25f1ce64520e2a8b20381c6ab0be5921 [0,1,0,0,0,0|2,0,0]=3 298 B11R1.75 CC(=O)NCc1nc(cs1)Br 80a1a3d1da1476ffa02a41a2404f4ce3 [0,1,0,0,0,0|2,1,0]=4 299 B11R1.75 CC(=O)NCc1nc(cs1)C 87b0edd5d9a1977001e05c17b02118c6 [0,1,0,0,0,0|2,1,0]=4 300 B11R1.75 CC(=O)NCc1nc(cs1)Cl e548b052ec0f7549568e87d25256d1ff [0,1,0,0,0,0|2,1,0]=4 301 B11R1.75 CC(=O)NCc1ncc(o1)Br 3d04f7f69b69ebfc9b082258a32470e6 [0,1,0,0,0,0|2,0,0]=3 302 B11R1.75 CC(=O)NCc1ncc(o1)C b96c864fd9d090130791d073abfa9d4e [0,1,0,0,0,0|2,0,0]=3 303 B11R1.75 CC(=O)NCc1ncc(s1)C c20c2d441d54f13e01b71caf6b20d1c5 [0,1,0,0,0,0|2,1,0]=4 304 B11R1.75 CC(=O)NCc1ncc(s1)Cl 5a89206349512354a19b74e866e48ee7 [0,1,0,0,0,0|2,1,0]=4 305 B11R1.75 CC(=O)NCc1nnc(o1)C 33629d7a65704a94e123c43328709287 [0,1,0,0,0,0|3,0,0]=4 306 B11R1.75 CC(C)NCc1ccc(o1)Br a7d483e22c98aa519c0d57b297a3e305 [0,1,0,0,0,0|2,0,1]=4 307 B11R1.75 CC(C)OCc1cc(co1)Br 6dcc718299df47ca5670faa3ee10cc2a [0,1,0,0,0,0|1,1,1]=4 308 B11R1.75 CC(C)OCc1ccc(o1)Br 4572bd0ae662cbcc2083e6c5e472cae9 [0,1,0,0,0,0|1,1,1]=4 309 B11R1.75 Cc1ccc(o1)CNC(C)C 17906d5fa8553b52e59fdc5d95921f17 [0,1,0,0,0,0|2,0,1]=4 310 B11R1.75 Cc1ccc(o1)COC(C)C 0e7aacbb60b32ca81c5945b28486e61e [0,1,0,0,0,0|1,1,1]=4 311 B11R1.75 Cc1ccc(o1)NCC(=O)N cac804fda3ef34d781c21678c0228f2a [0,1,0,0,0,0|3,0,0]=4 312 B11R1.75 Cc1coc(c1)CNC(C)C 2dcd43bd39a6e62a53c73bb8727417e2 [0,1,0,0,0,0|2,0,1]=4 313 B11R1.75 Cc1coc(c1)NCC(=O)N 639b98bc124c078d87642ebf525476d2 [0,1,0,0,0,0|3,0,0]=4 314 B11R1.77 CC(=O)NC(C)c1ccco1 c1f414cbe29927a43c5ea82bc1066b08 [0,1,0,0,0,0|1,0,0]=2 315 B11R1.77 CC(=O)NC(C)c1cccs1 e7ae72928c15ab3e748d7e1c8cf72906 [0,1,0,0,0,0|1,1,0]=3 316 B11R1.77 CC(=O)NC(C)c1ccoc1 f05fb1ac4899069c33da6b59ba925378 [0,1,0,0,0,0|3,0,0]=4 317 B11R1.77 CC(=O)NC(C)c1ccon1 0ca964294da6ae6106779874e1c2e2f0 [0,1,0,0,0,0|3,0,0]=4 318 B11R1.77 CC(=O)NC(C)c1ccsc1 b5322239eb2b3ea576be5e9c37a82962 [0,1,0,0,0,0|3,0,0]=4 319 B11R1.77 CC(=O)NC(C)c1cncs1 cb797d456b50b3aec89e981e775568b5 [0,1,0,0,0,0|2,1,0]=4 320 B11R1.77 CC(=O)NC(C)c1cscn1 bf490a05719af0dacf6079b03b5c06ba [0,1,0,0,0,0|3,0,0]=4 321 B11R1.77 CC(=O)NC(C)c1ncco1 fd525221588f8253603eb6525149d065 [0,1,0,0,0,0|2,0,0]=3 322 B11R1.77 CC(=O)NC(C)c1nccs1 0a448acc08f5cf357cfb71fa073e12ba [0,1,0,0,0,0|2,1,0]=4 323 B11R1.77 CC(=O)NC(C)c1nnco1 90d8d8536a2caedff288ad480389e898 [0,1,0,0,0,0|3,0,0]=4 324 B11R1.77 CC(=O)N[C@@H](C)c1cccs1 b818cd586259681e42d14261ef748959 [0,1,0,0,0,0|1,1,0]=3 325 B11R1.77 CC(=O)N[C@@H](C)c1ccoc1 e1ec52bf4cf96dc7f38f0bf9b1ce980a [0,1,0,0,0,0|3,0,0]=4 326 B11R1.77 CC(=O)N[C@@H](C)c1ccsc1 a37c11f7f4aa2f992f5f64350aa3a346 [0,1,0,0,0,0|3,0,0]=4 327 B11R1.77 CC(=O)N[C@@H](C)c1cncs1 31cdc634b839f967cbdc0644b2b6f9de [0,1,0,0,0,0|2,1,0]=4 328 B11R1.77 CC(=O)N[C@@H](C)c1nccs1 a2ddac4b6d3dfec46922786d18b57837 [0,1,0,0,0,0|2,1,0]=4 329 B11R1.77 CC(=O)N[C@H](C)c1ccco1 b21b5fa102dd5d98ec9d9b39f45da936 [0,1,0,0,0,0|1,0,0]=2 330 B11R1.77 CC(=O)N[C@H](C)c1cccs1 f815dc1cf41a56fe27ec577f5b868185 [0,1,0,0,0,0|1,1,0]=3 331 B11R1.90 CC(=O)NCc1cccn1C c151d1f61aa9cd59abb8cce6e932be56 [0,1,0,0,0,0|2,0,0]=3 332 B11R1.90 CC(=O)NCc1ccnn1C 15c4672b2cf5e9404ccbcca3a7d4c18e [0,1,0,0,0,0|3,0,0]=4 333 B11R1.90 CC(=O)NCc1ccoc1C d4bf342ef095f84c20b4b56088d719c3 [0,1,0,0,0,0|3,0,0]=4 334 B11R1.90 CC(=O)NCc1ccsc1Br be7751e3a80880d5b038d55245e9d1d3 [0,1,0,0,0,0|3,0,0]=4 335 B11R1.90 CC(=O)NCc1cncn1C 29854fad683d3dbe89e1694fa8b6fea2 [0,1,0,0,0,0|3,0,0]=4 336 B11R1.90 CC(=O)NCc1nccn1C 77e32c6fa27f08a1c2c3d9ffa5da6e3a [0,1,0,0,0,0|3,0,0]=4 337 B11R1.90 CC(=O)NCc1ncoc1C 45d2d5362019d7f10f1974d937ea79ad [0,1,0,0,0,0|3,0,0]=4 338 B11R1.90 CC(=O)NCc1nocc1C 6c27413e56b465c6f7e15dd994363f1f [0,1,0,0,0,0|3,0,0]=4 339 B11R1.90 CC(=O)NCc1occc1C 6dcfcfae995904333b31ef08b1e3652a [0,1,0,0,0,0|1,0,0]=2 340 B11R1.90 CC(=O)NCc1sccc1Br aa8241562c41a8b68afd8977c5e634b3 [0,1,0,0,0,0|1,1,0]=3 341 B11R1.90 CC(=O)NCc1sccc1Cl 469e4ea001d68b0cdcf3b2b0e26a3aef [0,1,0,0,0,0|1,1,0]=3 342 B11R1.90 CC(=O)NCc1sccc1F b59507f5337bd9b9f20d21f304068893 [0,1,0,0,0,0|1,1,0]=3 343 B11R1.90 CC(=O)NCc1scnc1Br 93689180a97bbc7a2baafc901e4f42cc [0,1,0,0,0,0|2,1,0]=4 344 B11R1.90 CC(=O)NCc1scnc1C 589e78d4eb9f0a6d802bb730d38ce454 [0,1,0,0,0,0|2,1,0]=4 345 B11R1.90 CC(C)OCc1occc1Br 5e499d8c54a43fe9cdc83e61ba5cb317 [0,1,0,0,0,0|1,1,1]=4 346 B11R1.90 Cc1ccoc1CNC(C)C 4cb35c14cd660170583bb58b2ce11c75 [0,1,0,0,0,0|2,0,1]=4 347 B11R1.90 Cc1ccoc1COC(C)C 53ce2525eea58424e691bb0419bcb258 [0,1,0,0,0,0|1,1,1]=4 348 B11R1.510 CC(C)(C)NCc1ccco1 0d7c926a0e622b7d3b3c77fa6b1a0c7f [0,1,0,0,0,0|2,0,1]=4 349 B11R1.510 CS(=O)(=O)COc1ccco1 fab2391845fe5dee14e862d0bd72b65e [0,1,0,0,0,0|3,0,0]=4 350 B9R0.2 C=C/C=C/CCNC(=O)C d1d4b0874c1cb5c136899f1ca87a2779 [0,0,1,0,0,0|2,0,1]=4 351 B9R0.2 C=CCOCCCC(=O)C 7c50ee2dd017285f672ea091a47723d2 [0,0,1,0,0,0|1,0,2]=4 352 B9R0.2 C=CCOCCNC(=O)C a53ca486da172a5bf65bca1009789a59 [0,0,1,0,0,0|1,0,2]=4 353 B9R0.2 C=CCOCCOC(=O)C b8c209519513104470d81d0ada77afd3 [0,0,1,0,0,0|0,1,2]=4 354 B9R0.48 C=CCC(O)CNC(=O)C 044a2180840b1053ceaf99d23733edb1 [0,0,1,0,0,0|1,0,2]=4 355 B11R2.385 c1coc(c1)CNC2CC2 a935d11545af700e1f9217e8d211e17d [0,0,0,1,0,0|2,0,1]=4 356 B11R2.385 c1coc(c1)COC2CC2 03ead378b7018e25b154b738e6adcece [0,0,0,1,0,0|1,1,1]=4 357 B9R1.13 CC(=O)Nc1cccs1 f70dc40a2b7a68d7210198fbab697918 [0,0,0,0,1,0|1,1,0]=3 358 B9R1.13 CC(=O)Nc1ccno1 9ee4360e11764428c81b3574e3a5fbc0 [0,0,0,0,1,0|2,0,0]=3 359 B9R1.13 CC(=O)Nc1ccns1 bf48f8f0459ec9fa0c60411c28a05fbc [0,0,0,0,1,0|2,1,0]=4 360 B9R1.13 CC(=O)Nc1ccsc1 b43c291cb5d72b5ddddbae12e8c0d0d9 [0,0,0,0,1,0|3,0,0]=4 361 B9R1.13 CC(=O)Nc1cncs1 8e4d874841813b151af824130870907f [0,0,0,0,1,0|2,1,0]=4 362 B9R1.13 CC(=O)Nc1cocn1 4089e82890500e24c2afb0f19306f425 [0,0,0,0,1,0|3,0,0]=4 363 B9R1.13 CC(=O)Nc1cscn1 40e369b2af88cefbcc061c4b162a2ec0 [0,0,0,0,1,0|3,0,0]=4 364 B9R1.13 CC(=O)Nc1ncco1 b16f0a75e381dc1cebd6e7c0a9c2918e [0,0,0,0,1,0|2,0,0]=3 365 B9R1.13 CC(=O)Nc1nccs1 77a8d229d5e2ebce94e2316ec872dfb6 [0,0,0,0,1,0|2,1,0]=4 366 B9R1.13 CC(C)Oc1ccco1 6706bc489021fd5e63c9cd08f454e9c6 [0,0,0,0,1,0|1,1,1]=4 367 B11R1.91 CC(=O)CNc1ccccc1 71a2fb3da6b0e889c13cfd81e73bd182 [0,0,0,0,0,1|3,0,0]=4 368 B11R1.91 CC(=O)CNc1ccccn1 9ef5867d6e28a360f3e560522ae4c545 [0,0,0,0,0,1|3,0,0]=4 369 B11R1.91 CC(=O)CNc1cccnc1 35a6037a85b015cc869f557087769b5d [0,0,0,0,0,1|3,0,0]=4 370 B11R1.91 CC(=O)CNc1cccnn1 bd224fe4d75fd6299636314b2659cf40 [0,0,0,0,0,1|3,0,0]=4 371 B11R1.91 CC(=O)CNc1ccncc1 e7e1df2bfec9194a79bb5918ba94764c [0,0,0,0,0,1|3,0,0]=4 372 B11R1.91 CC(=O)CNc1ccncn1 4f817587489a7d067dc5afdf25fc5852 [0,0,0,0,0,1|3,0,0]=4 373 B11R1.91 CC(=O)CNc1cnccn1 f505fd1e568103e89908ef11d0b9c40c [0,0,0,0,0,1|3,0,0]=4 374 B11R1.91 CC(=O)CNc1ncccn1 f18694e3a51e6ffd47e70f441daa4c05 [0,0,0,0,0,1|3,0,0]=4 375 B11R1.91 CC(=O)NCc1ccccc1 29a87354e4243d3817f046f8152f971d [0,0,0,0,0,1|2,0,0]=3 376 B11R1.91 CC(=O)NCc1ccccn1 4a5e0ad0f6fb64ba7eb4726872bef1d0 [0,0,0,0,0,1|2,0,0]=3 377 B11R1.91 CC(=O)NCc1cccnc1 7b71a51c058bd0c2c3114d8b61c7e1f0 [0,0,0,0,0,1|2,0,0]=3 378 B11R1.91 CC(=O)NCc1cccnn1 8df4f95b0595f5061ab86d0c6899ec2c [0,0,0,0,0,1|2,0,0]=3 379 B11R1.91 CC(=O)NCc1ccncc1 9156811b92bf0707f7382e576ceea554 [0,0,0,0,0,1|2,0,0]=3 380 B11R1.91 CC(=O)NCc1ccncn1 bb4e634dd2d2ac1df6c40895aef3c1f0 [0,0,0,0,0,1|2,0,0]=3 381 B11R1.91 CC(=O)NCc1ccnnc1 b7fb9ef1b30e19b3391ac6373f09e991 [0,0,0,0,0,1|3,0,0]=4 382 B11R1.91 CC(=O)NCc1cnccn1 3bc7c046654e0b52f0e8fd5e1c64219d [0,0,0,0,0,1|2,0,0]=3 383 B11R1.91 CC(=O)NCc1cncnc1 1788fa75b9a7d3ec40c95f826ad49ab5 [0,0,0,0,0,1|3,0,0]=4 384 B11R1.91 CC(=O)NCc1ncccn1 7e583fa87c299d4a4eb199dfcfdc7c5d [0,0,0,0,0,1|2,0,0]=3 385 B11R1.172 C/C(=C/CNc1cccs1)/I 7b8ec30fda95dbe98402d9becc88bf73 [0,0,0,0,0,1|2,1,0]=4 386 B11R1.172 C/C(=C/CNc1ccno1)/I 598720a898c31233b75a094b83b1f57d [0,0,0,0,0,1|3,0,0]=4 387 B11R1.172 C/C(=C/CNc1ncco1)/I 1198fd1dc7f4da43d13f169b978d8b36 [0,0,0,0,0,1|3,0,0]=4 388 B11R1.172 C/C(=C/COc1ccco1)/I e7a7256bf0611df4a720252c02faadf1 [0,0,0,0,0,1|2,0,0]=3 389 B11R1.172 C/C(=C/COc1cccs1)/I 5104da2c76a416a6f0eb7a26779baa08 [0,0,0,0,0,1|2,1,0]=4 390 B11R1.172 C/C(=C\CNc1cccs1)/Cl 5064bc44f0f08470b74a6a869fc185db [0,0,0,0,0,1|2,1,0]=4 391 B11R1.172 C/C(=C\CNc1ccno1)/Cl 90d5e07fa8f961dfc91af1816e7a9a0a [0,0,0,0,0,1|3,0,0]=4 392 B11R1.172 C/C(=C\CNc1ncco1)/Cl 8ae58dd4900dbe31d7cd9a18e8d348ca [0,0,0,0,0,1|3,0,0]=4 393 B11R1.172 C/C(=C\COc1ccco1)/Cl 793a2f5d7b618d01d0ab06f1214f9f54 [0,0,0,0,0,1|2,0,0]=3 394 B11R1.172 C/C(=C\COc1cccs1)/Cl 6d14cfe4242f8b0612dd542f2dbefa50 [0,0,0,0,0,1|2,1,0]=4 395 B11R1.172 C=C(Br)CNCc1ccco1 da6f84909e521be128191fe48d0b450c [0,0,0,0,0,1|2,0,1]=4 396 B11R1.172 C=C(Br)COCc1ccco1 adb58c08cd71c960d8d80c04030afd59 [0,0,0,0,0,1|1,1,1]=4 397 B11R1.172 C=C(C)CCNc1ccco1 d13ab3139578804f2db3f1bc827b21b8 [0,0,0,0,0,1|2,0,0]=3 398 B11R1.172 C=C(C)CCNc1cccs1 5a089186d14dec5fc4073b9366288502 [0,0,0,0,0,1|2,1,0]=4 399 B11R1.172 C=C(C)CCNc1ccno1 3271a60246facbc727a759f2886dbbef [0,0,0,0,0,1|3,0,0]=4 400 B11R1.172 C=C(C)CCNc1ncco1 6c80135d7071e9804ef0ff147a3afdee [0,0,0,0,0,1|3,0,0]=4 401 B11R1.172 C=C(C)CCOc1ccco1 b5bfa72618728008bf7e5b105d505c14 [0,0,0,0,0,1|2,0,0]=3 402 B11R1.172 C=C(C)CCOc1cccs1 8b3bb761b6300d709236e7861da73eac [0,0,0,0,0,1|2,1,0]=4 403 B11R1.172 C=C(C)CNCc1ccc[nH]1 24361a3a8cfef21fff5324d265aad641 [0,0,0,0,0,1|3,0,0]=4 404 B11R1.172 C=C(C)CNCc1ccco1 b8e84244edcb166dae9a2b7d3f4218dd [0,0,0,0,0,1|2,0,0]=3 405 B11R1.172 C=C(C)CNCc1cccs1 7ebf6cda319f82ed73d380f9dad6c522 [0,0,0,0,0,1|2,1,0]=4 406 B11R1.172 C=C(C)CNCc1ccno1 d519411305e0279af766f8faebafdc9f [0,0,0,0,0,1|3,0,0]=4 407 B11R1.172 C=C(C)CNCc1cnco1 811fbe1d7ea8683ea85cc9a6d99c8e5a [0,0,0,0,0,1|3,0,0]=4 408 B11R1.172 C=C(C)CNCc1ncco1 bc44d6dc132c98f8fc821a08ee56ae61 [0,0,0,0,0,1|3,0,0]=4 409 B11R1.172 C=C(C)COCc1ccc[nH]1 208f7238ede00f26b111960d3f28b4f5 [0,0,0,0,0,1|2,1,0]=4 410 B11R1.172 C=C(C)COCc1ccco1 ee5f525ea9421d6d2e16283e93cac648 [0,0,0,0,0,1|1,1,0]=3 411 B11R1.172 C=C(C)COCc1cccs1 7c2cb0f06dd6c65fd763460f0aa3e191 [0,0,0,0,0,1|1,2,0]=4 412 B11R1.172 C=C(C)COCc1ccno1 d509b6b282f6eaf9c5ac07098d2e1bf5 [0,0,0,0,0,1|2,1,0]=4 413 B11R1.172 C=C(C)COCc1cnco1 aade584e6e31ffc3c81dda5dd47e27ad [0,0,0,0,0,1|2,1,0]=4 414 B11R1.172 C=C(C)COCc1ncco1 e0671292193454b5ff7081b0df773daf [0,0,0,0,0,1|2,1,0]=4 415 B11R1.172 C=C(Cl)CNCc1ccco1 022aab41716ba12403bec32f9407cd23 [0,0,0,0,0,1|2,0,1]=4 416 B11R1.172 C=C(Cl)COCc1ccco1 39870290ab64f9dd9ce3a957932b776d [0,0,0,0,0,1|1,1,1]=4 417 B11R1.172 C=C(F)CNCc1ccco1 a854fd8c24fdcdd4686a2c657522e223 [0,0,0,0,0,1|2,0,1]=4 418 B11R1.172 C=C(F)COCc1ccco1 54ca9dcca763f82a311c6fd0815f4286 [0,0,0,0,0,1|1,1,1]=4 419 B11R1.172 CC(=CCNc1ccco1)C facc7eca3dfd08a12a25c74be92a3245 [0,0,0,0,0,1|2,0,0]=3 420 B11R1.172 CC(=CCNc1cccs1)C 4bab43296fbe95b51c2395cb2d46dd83 [0,0,0,0,0,1|2,1,0]=4 421 B11R1.172 CC(=CCNc1cccs1)Cl 10eef368c90d85d4c6074539a9f26c34 [0,0,0,0,0,1|2,1,0]=4 422 B11R1.172 CC(=CCNc1cccs1)I e4c00762c0dc79912d2298ebb4bcf62b [0,0,0,0,0,1|2,1,0]=4 423 B11R1.172 CC(=CCNc1ccno1)C a762b9e8172785f31af0e7a6de34d4a5 [0,0,0,0,0,1|3,0,0]=4 424 B11R1.172 CC(=CCNc1ccno1)Cl f78878bde8230dbd2f571ca3768012a4 [0,0,0,0,0,1|3,0,0]=4 425 B11R1.172 CC(=CCNc1ccno1)I 1045d94459f786a612f1def52531b2fd [0,0,0,0,0,1|3,0,0]=4 426 B11R1.172 CC(=CCNc1ncco1)C e4743e390db7b18aafbc9e22ad5dce22 [0,0,0,0,0,1|3,0,0]=4 427 B11R1.172 CC(=CCNc1ncco1)Cl 5a664277b1e629eec86d889339a81ce6 [0,0,0,0,0,1|3,0,0]=4 428 B11R1.172 CC(=CCNc1ncco1)I e0c77bc304d615788b54ab76ee8a0950 [0,0,0,0,0,1|3,0,0]=4 429 B11R1.172 CC(=CCOc1ccco1)C 143f223a2771e7d2e271b2ebb556a34d [0,0,0,0,0,1|2,0,0]=3 430 B11R1.172 CC(=CCOc1ccco1)Cl f90b16e48a4ad6694cf3c5ebb6dba78f [0,0,0,0,0,1|2,0,0]=3 431 B11R1.172 CC(=CCOc1ccco1)I a8b941715521049c9f90a0e42181334c [0,0,0,0,0,1|2,0,0]=3 432 B11R1.172 CC(=CCOc1cccs1)C 533b2b7ba40d63d053cdf6d03daff217 [0,0,0,0,0,1|2,1,0]=4 433 B11R1.172 CC(=CCOc1cccs1)Cl fc4960b961b387f3fa1dcd9e67184d21 [0,0,0,0,0,1|2,1,0]=4 434 B11R1.172 CC(=CCOc1cccs1)I 85f2f145afc4503fb90fefd776fd2123 [0,0,0,0,0,1|2,1,0]=4 435 B11R1.172 CC(=O)CCNc1cc[nH]n1 883daeb3188304b9d7044762105d7937 [0,0,0,0,0,1|3,0,0]=4 436 B11R1.172 CC(=O)CCNc1cccs1 3705e6b236dd0e242edc581b5639fa6d [0,0,0,0,0,1|1,1,0]=3 437 B11R1.172 CC(=O)CCNc1ccno1 abfc6c3a57c95c77d51b6355ee5e87dd [0,0,0,0,0,1|2,0,0]=3 438 B11R1.172 CC(=O)CCNc1ccns1 d2fe2729b8ffd28cfa6ff3bc9a9bd816 [0,0,0,0,0,1|2,1,0]=4 439 B11R1.172 CC(=O)CCNc1ccon1 fa2bb5bb8d68fa453bbdefdb1d759682 [0,0,0,0,0,1|3,0,0]=4 440 B11R1.172 CC(=O)CCNc1ccsc1 651e0759f022e69c9736f48a37d6dc91 [0,0,0,0,0,1|3,0,0]=4 441 B11R1.172 CC(=O)CCNc1cncs1 bce7d96e9d22cce9e72ec22be1ef03a0 [0,0,0,0,0,1|2,1,0]=4 442 B11R1.172 CC(=O)CCNc1cocn1 f4edda95f1039e89d30a273f43e079c6 [0,0,0,0,0,1|3,0,0]=4 443 B11R1.172 CC(=O)CCNc1cscn1 bae0a140e53827c0132f1292745b570f [0,0,0,0,0,1|3,0,0]=4 444 B11R1.172 CC(=O)CCNc1ncc[nH]1 f62fc8122f45927eb0ccc652b7a4c5b1 [0,0,0,0,0,1|3,0,0]=4 445 B11R1.172 CC(=O)CCNc1ncco1 6db9a64456f72643bc08fa8bb5731698 [0,0,0,0,0,1|2,0,0]=3 446 B11R1.172 CC(=O)CCNc1nccs1 3d5d28b8f113842ebbf2ec44dd1bf59f [0,0,0,0,0,1|2,1,0]=4 447 B11R1.172 CC(=O)CCNc1nnco1 cfa5c20fbe8ebe82be2814641008381c [0,0,0,0,0,1|3,0,0]=4 448 B11R1.172 CC(=O)CCOc1c[nH]cn1 5a2c247b0e6ea2d9a0d6482af004727a [0,0,0,0,0,1|3,0,0]=4 449 B11R1.172 CC(=O)CCOc1ccco1 1304331aa569973df701f4c541cd36f9 [0,0,0,0,0,1|1,0,0]=2 450 B11R1.172 CC(=O)CCOc1cccs1 b63fa1eb430f81b21edb5306b25d0cdb [0,0,0,0,0,1|1,1,0]=3 451 B11R1.172 CC(=O)CCOc1ccn[nH]1 c77d754b208302e74f11af0969affc27 [0,0,0,0,0,1|3,0,0]=4 452 B11R1.172 CC(=O)CCOc1ccsc1 fee7f80d39017e359bb48461fa26983e [0,0,0,0,0,1|3,0,0]=4 453 B11R1.172 CC(=O)CCOc1nccs1 cf08ec43f863de4c460f793b78c9f67a [0,0,0,0,0,1|2,1,0]=4 454 B11R1.172 CC(=O)CCOn1cccn1 97b5dcdee09e1afa32f5e7b00efd9045 [0,0,0,0,0,1|3,0,0]=4 455 B11R1.172 CC(=O)CNCc1ccco1 5349a004945f22466223fdea062b1a26 [0,0,0,0,0,1|1,0,0]=2 456 B11R1.172 CC(=O)CNCc1cccs1 b1e4a802d58216630369ed1cb1193c6c [0,0,0,0,0,1|1,1,0]=3 457 B11R1.172 CC(=O)CNCc1ccno1 9d433d4075491746a313ee42cd7c05da [0,0,0,0,0,1|2,0,0]=3 458 B11R1.172 CC(=O)CNCc1ccon1 23626df2e39d6d34262af4f6b23b9170 [0,0,0,0,0,1|3,0,0]=4 459 B11R1.172 CC(=O)CNCc1ccsc1 16ff0b76a99c7d3314b4299765d3106e [0,0,0,0,0,1|3,0,0]=4 460 B11R1.172 CC(=O)CNCc1cnc[nH]1 7961c596f66c2db5f4c710df2da78fd9 [0,0,0,0,0,1|3,0,0]=4 461 B11R1.172 CC(=O)CNCc1cnco1 99f78d679b27a44216bef491e144dcce [0,0,0,0,0,1|2,0,0]=3 462 B11R1.172 CC(=O)CNCc1cocn1 5a325c13f3d51587b1011738e379fe43 [0,0,0,0,0,1|3,0,0]=4 463 B11R1.172 CC(=O)CNCc1cscn1 50abab540491be2882a1c0a0909785fd [0,0,0,0,0,1|3,0,0]=4 464 B11R1.172 CC(=O)CNCc1ncc[nH]1 778742788fb1ab1bab5ccf4fe2a0da32 [0,0,0,0,0,1|3,0,0]=4 465 B11R1.172 CC(=O)CNCc1ncco1 08548bfba2487e3629cbfdeac38ddfed [0,0,0,0,0,1|2,0,0]=3 466 B11R1.172 CC(=O)CNCc1nccs1 a8747eb331576143633e408625f188a4 [0,0,0,0,0,1|2,1,0]=4 467 B11R1.172 CC(=O)CNCc1ncno1 83bb31529ce46ee4ded2789dbac5f2aa [0,0,0,0,0,1|3,0,0]=4 468 B11R1.172 CC(=O)CNCc1nnco1 709d2b2a6e3108900fe1c8be8b9e1227 [0,0,0,0,0,1|3,0,0]=4 469 B11R1.172 CC(=O)COCc1ccco1 eb376918d478215b7784a307211ac4b9 [0,0,0,0,0,1|0,1,0]=2 470 B11R1.172 CC(=O)COCc1cccs1 230c5eb2cad29c6e94ed984c95bb8914 [0,0,0,0,0,1|0,2,0]=3 471 B11R1.172 CC(=O)COCc1ccno1 c0aa8f40aff12f310b3637c4247f89a6 [0,0,0,0,0,1|1,1,0]=3 472 B11R1.172 CC(=O)COCc1ccon1 9e19981729836118dd19c0826084c66d [0,0,0,0,0,1|2,1,0]=4 473 B11R1.172 CC(=O)COCc1ccsc1 78bf80be00349b2116046f3effe94e73 [0,0,0,0,0,1|2,1,0]=4 474 B11R1.172 CC(=O)COCc1cnc[nH]1 8cf8a4d7b712ee5ea9cd56a3720c3ebf [0,0,0,0,0,1|2,1,0]=4 475 B11R1.172 CC(=O)COCc1cocn1 1dc479cb33ceaf076f3723d82bb37f46 [0,0,0,0,0,1|2,1,0]=4 476 B11R1.172 CC(=O)COCc1cscn1 19a63737f28646eb23fa503a4700b862 [0,0,0,0,0,1|2,1,0]=4 477 B11R1.172 CC(=O)COCc1ncc[nH]1 63019179786ec8451185c7af212d962c [0,0,0,0,0,1|2,1,0]=4 478 B11R1.172 CC(=O)COCc1ncco1 6392edc6fd8ff743b74fd77ae0ebc6d1 [0,0,0,0,0,1|1,1,0]=3 479 B11R1.172 CC(=O)COCc1nccs1 f6b227f8e0531f674da6013bb44fdfb1 [0,0,0,0,0,1|1,2,0]=4 480 B11R1.172 CC(=O)COCc1ncno1 1d52bc01789c9da548e7c29e4041ef4d [0,0,0,0,0,1|2,1,0]=4 481 B11R1.172 CC(=O)COCc1nnco1 68ccb48fc8eeef73f00246e8f53646e6 [0,0,0,0,0,1|2,1,0]=4 482 B11R1.172 CC(=O)NCCc1ccco1 f97fcd1be9cacf4675351753b4b97ccf [0,0,0,0,0,1|1,0,0]=2 483 B11R1.172 CC(=O)NCCc1cccs1 b2bccd28809b44ec5e70798b6aa4c45f [0,0,0,0,0,1|1,1,0]=3 484 B11R1.172 CC(=O)NCCc1ccsc1 10819fa3dfc260c6efcff456e5254d1c [0,0,0,0,0,1|3,0,0]=4 485 B11R1.172 CC(=O)NCCc1cscn1 5a0e906e9ec17b0b664a4310d6205079 [0,0,0,0,0,1|3,0,0]=4 486 B11R1.172 CC(=O)NCCc1nccs1 e199f90e06fe8a9fa8ec6cff53ae1078 [0,0,0,0,0,1|2,1,0]=4 487 B11R1.172 CC(=O)NCCn1cccc1 90ca4d7dc3d7deccd3fd7667822b2621 [0,0,0,0,0,1|3,0,0]=4 488 B11R1.172 CC(=O)NCCn1cccn1 09d1495aa7ae7b34ce16de2f3bc9823f [0,0,0,0,0,1|3,0,0]=4 489 B11R1.172 CC(=O)OCNc1cc[nH]n1 f1d4e3409eb19701aaae47828ddadb2c [0,0,0,0,0,1|2,1,0]=4 490 B11R1.172 CC(=O)OCNc1cccs1 9bfb4558c6114317955d0a73b0c80837 [0,0,0,0,0,1|0,2,0]=3 491 B11R1.172 CC(=O)OCNc1ccno1 8b3ce7fe1a45c29dd7c984f3eae3a57e [0,0,0,0,0,1|1,1,0]=3 492 B11R1.172 CC(=O)OCNc1ccns1 01133f4c5678a6331e1021a3842e6d84 [0,0,0,0,0,1|1,2,0]=4 493 B11R1.172 CC(=O)OCNc1ccon1 4d3da0c7217ff2f017b541fce9582b6c [0,0,0,0,0,1|2,1,0]=4 494 B11R1.172 CC(=O)OCNc1ccsc1 a16b14492d247d5b0fba4c89c8652c37 [0,0,0,0,0,1|2,1,0]=4 495 B11R1.172 CC(=O)OCNc1cncs1 9a6e7eff9e67f8d7869dbea990d12924 [0,0,0,0,0,1|1,2,0]=4 496 B11R1.172 CC(=O)OCNc1cocn1 dd521c2131d3bdac6bae185b11c989b6 [0,0,0,0,0,1|2,1,0]=4 497 B11R1.172 CC(=O)OCNc1cscn1 c1fe35d7a3b6c55d0700de45dfb1de72 [0,0,0,0,0,1|2,1,0]=4 498 B11R1.172 CC(=O)OCNc1ncc[nH]1 fa8f0e4b6cef200e463b5cd2599645c4 [0,0,0,0,0,1|2,1,0]=4 499 B11R1.172 CC(=O)OCNc1ncco1 5827ef4ddf2b1a5038d42cb3806f2688 [0,0,0,0,0,1|1,1,0]=3 500 B11R1.172 CC(=O)OCNc1nccs1 dd895c7060485b6d76ce578804f9fd66 [0,0,0,0,0,1|1,2,0]=4 501 B11R1.172 CC(=O)OCNc1nnco1 587d3b4d296aeb2127b5af8bbbf56745 [0,0,0,0,0,1|2,1,0]=4 502 B11R1.172 CC(=O)OCOc1c[nH]cn1 77ad85680c2a23ead707f1ef692fee0a [0,0,0,0,0,1|2,1,0]=4 503 B11R1.172 CC(=O)OCOc1ccco1 18a8842f6bf66d2e01121a7a178b294d [0,0,0,0,0,1|0,1,0]=2 504 B11R1.172 CC(=O)OCOc1cccs1 01a2361020ef2a379439fd07806b9e9d [0,0,0,0,0,1|0,2,0]=3 505 B11R1.172 CC(=O)OCOc1ccn[nH]1 e88b57273b4b2d97d84fd5766bcbdbcc [0,0,0,0,0,1|2,1,0]=4 506 B11R1.172 CC(=O)OCOc1ccsc1 5d38b23aafc842ce5f7b8229487d2e29 [0,0,0,0,0,1|2,1,0]=4 507 B11R1.172 CC(=O)OCOc1nccs1 a61f9bf88998c7775f63e887f1f8e3e8 [0,0,0,0,0,1|1,2,0]=4 508 B11R1.172 CC(=O)OCOn1cccn1 8d7ea3787a22a61e882111ec2e7551a7 [0,0,0,0,0,1|2,1,0]=4 509 B11R1.172 CC(=O)SCCN1CC=CC1 2b2650704a9f25a44d0d30466f1d0a4c [0,0,0,0,0,1|2,0,1]=4 510 B11R1.172 CC(C)CCNc1ccco1 0e041b2f4b640f51ce49397377a10223 [0,0,0,0,0,1|2,0,1]=4 511 B11R1.172 CC(C)CCOc1ccco1 8d841360fc8b7eeb8a9816f92abe8dd7 [0,0,0,0,0,1|2,0,1]=4 512 B11R1.172 CC(C)CNCc1ccco1 1b61b056633b02c6b253717bdc3f6b4e [0,0,0,0,0,1|2,0,1]=4 513 B11R1.172 CC(C)COCc1ccco1 99062e49951b35e6277ae5df50b7eb8b [0,0,0,0,0,1|1,1,1]=4 514 B11R1.172 CC(C)NCCc1ccco1 f5a48b9013a3de5311256701c81ca609 [0,0,0,0,0,1|2,0,1]=4 515 B11R1.172 CC(C)OCCc1ccco1 e7f3ba800a326f72fff6110f1619a3df [0,0,0,0,0,1|1,1,1]=4 516 B11R1.172 CC(C)OCOc1ccco1 94ef49e4a6ce8f3dd52623eab2ad6e1b [0,0,0,0,0,1|1,1,1]=4 517 B11R1.172 CC(F)COCc1ccco1 d0f129770505d2aafab7a0041834f6ad [0,0,0,0,0,1|1,1,1]=4 518 B11R1.172 CC(O)CNCc1ccco1 dba85ac96ca60610e6077e0d05d62bcd [0,0,0,0,0,1|1,0,2]=4 519 B11R1.172 CC(S)COCc1ccco1 64d0adfb42f5538807c786da49eb2388 [0,0,0,0,0,1|0,2,1]=4 520 B11R1.172 CN(C)CCNc1ccco1 9c4c9a92fc72f7218aa7192da3b54150 [0,0,0,0,0,1|3,0,0]=4 521 B11R1.172 CN(C)CCOc1ccco1 7522b649958b5b49c4aef79351655606 [0,0,0,0,0,1|3,0,0]=4 522 B11R1.172 CN(C)CNCc1ccco1 46aa4a5e6d23aa3ba85f84bccf917361 [0,0,0,0,0,1|3,0,0]=4 523 B11R1.172 CN(C)COCc1ccco1 df03d7b24780c6fad8a058d77a006c79 [0,0,0,0,0,1|2,1,0]=4 524 B11R1.172 CS(=O)CCNc1ccco1 b5c41bf9a4c4b4784e62738332f55e27 [0,0,0,0,0,1|2,0,0]=3 525 B11R1.172 CS(=O)CCNc1cccs1 78823b7fe6cdd8da25e017f2ea6de717 [0,0,0,0,0,1|2,1,0]=4 526 B11R1.172 CS(=O)CCNc1ccno1 51fb5ceefe750018a2fb6bdec9830fac [0,0,0,0,0,1|3,0,0]=4 527 B11R1.172 CS(=O)CCNc1ncco1 193b49e7b235775d5a979f1247a1639c [0,0,0,0,0,1|3,0,0]=4 528 B11R1.172 CS(=O)CCOc1ccco1 ebae9dbe7878c9e08d546f06556993fc [0,0,0,0,0,1|2,0,0]=3 529 B11R1.172 CS(=O)CCOc1cccs1 9105791bd08007ee4b3b545cf4f4d4b4 [0,0,0,0,0,1|2,1,0]=4 530 B11R1.172 C[C@@H](F)COCc1ccco1 d6b942e64f19e537e65fb887839c99a6 [0,0,0,0,0,1|1,1,1]=4 531 B11R1.172 C[C@@H](O)CNCc1ccco1 63796111ed16563c371374fd22b9d739 [0,0,0,0,0,1|1,0,2]=4 532 B11R1.172 C[C@H](F)COCc1ccco1 fbf7bd3431d8f8c5f513c23259a8679a [0,0,0,0,0,1|1,1,1]=4 533 B11R1.172 C[C@H](O)CNCc1ccco1 14b70b5b444307109cbe8cf07983b605 [0,0,0,0,0,1|1,0,2]=4 534 B11R1.172 ClC(=CCOc1ccco1)Cl 4ff446ffcb7e393480d9757b9a1099e1 [0,0,0,0,0,1|3,0,0]=4 535 B11R1.172 NC(=O)CCNc1ccco1 ab32532f1c3dbe5d91a357acfbdf218d [0,0,0,0,0,1|2,0,0]=3 536 B11R1.172 NC(=O)CCNc1cccs1 4c3df2dedde37ddbd71ba489063312db [0,0,0,0,0,1|2,1,0]=4 537 B11R1.172 NC(=O)CCNc1ccno1 a3a00f0cbcfd7190a505935461c9207f [0,0,0,0,0,1|3,0,0]=4 538 B11R1.172 NC(=O)CCNc1ncco1 c57de53ae0c567e6c73e34084a704dbb [0,0,0,0,0,1|3,0,0]=4 539 B11R1.172 NC(=O)CCOc1ccco1 62568bce3153cbd2dbe9e7f3e41fdb78 [0,0,0,0,0,1|2,0,0]=3 540 B11R1.172 NC(=O)CCOc1cccs1 abb566272552117d2cc0a0d6c3db031e [0,0,0,0,0,1|2,1,0]=4 541 B11R1.172 NC(=O)CNCc1ccc[nH]1 4d885322b19f56ef9a7adef5ac07e13a [0,0,0,0,0,1|3,0,0]=4 542 B11R1.172 NC(=O)CNCc1ccco1 66bbe09b4a4fd1abe2eabcc09ff61502 [0,0,0,0,0,1|2,0,0]=3 543 B11R1.172 NC(=O)CNCc1cccs1 ff189ba2aaf7a428fabbec9788965050 [0,0,0,0,0,1|2,1,0]=4 544 B11R1.172 NC(=O)CNCc1ccno1 a6a9aa405bf1f5943bff9d9eccc22981 [0,0,0,0,0,1|3,0,0]=4 545 B11R1.172 NC(=O)CNCc1cnco1 79b996ea014dc992e10e1bffe38c4d1b [0,0,0,0,0,1|3,0,0]=4 546 B11R1.172 NC(=O)CNCc1ncco1 b21d6713df6f65ea5d089e9d1a3132df [0,0,0,0,0,1|3,0,0]=4 547 B11R1.172 NC(=O)COCc1ccc[nH]1 b6e75ef9e7be437d4d16b0504d02f6b9 [0,0,0,0,0,1|2,1,0]=4 548 B11R1.172 NC(=O)COCc1ccco1 23772c88c899aa3b4db4adceab3b722e [0,0,0,0,0,1|1,1,0]=3 549 B11R1.172 NC(=O)COCc1cccs1 82a49a500242b4259e12addce264b1e6 [0,0,0,0,0,1|1,2,0]=4 550 B11R1.172 NC(=O)COCc1ccno1 6f721013f21bb80b757919db205aa84b [0,0,0,0,0,1|2,1,0]=4 551 B11R1.172 NC(=O)COCc1cnco1 a85d625518924ef7da0254fd9f9fcb67 [0,0,0,0,0,1|2,1,0]=4 552 B11R1.172 NC(=O)COCc1ncco1 702d6ddeec97d8dc376db8abcd2c8d4c [0,0,0,0,0,1|2,1,0]=4 553 B11R1.172 NC(=O)SCNc1cc[nH]n1 1e2449870f95762c73dd4a322e7521ea [0,0,0,0,0,1|3,0,0]=4 554 B11R1.172 NC(=O)SCNc1cccs1 3d9dd94c661e568f94255e6538ccdf9d [0,0,0,0,0,1|1,1,0]=3 555 B11R1.172 NC(=O)SCNc1ccno1 aebd5b809375a9a04a3d733570a747fd [0,0,0,0,0,1|2,0,0]=3 556 B11R1.172 NC(=O)SCNc1ccns1 ddd31e2da84c8298605531e43da7e01e [0,0,0,0,0,1|2,1,0]=4 557 B11R1.172 NC(=O)SCNc1ccon1 a773e522d61b0f16a33e64c8339676cd [0,0,0,0,0,1|3,0,0]=4 558 B11R1.172 NC(=O)SCNc1ccsc1 5ab9e249b764ce9ca7b6f86009e80fde [0,0,0,0,0,1|3,0,0]=4 559 B11R1.172 NC(=O)SCNc1cncs1 3fb1bf19f61d32f251ea3e0653da2347 [0,0,0,0,0,1|2,1,0]=4 560 B11R1.172 NC(=O)SCNc1cocn1 b98c57ae231029bb80e9d12e48d56330 [0,0,0,0,0,1|3,0,0]=4 561 B11R1.172 NC(=O)SCNc1cscn1 f6e71f6accbc169b0cbf865b16363d91 [0,0,0,0,0,1|3,0,0]=4 562 B11R1.172 NC(=O)SCNc1ncc[nH]1 e26065d60d72aaf23fab478ddc9f1dbd [0,0,0,0,0,1|3,0,0]=4 563 B11R1.172 NC(=O)SCNc1ncco1 a2a3d021a3bf55537f4cb06a88e4d42f [0,0,0,0,0,1|2,0,0]=3 564 B11R1.172 NC(=O)SCNc1nccs1 00facfe8458994e1ac196832c274b6c1 [0,0,0,0,0,1|2,1,0]=4 565 B11R1.172 NC(=O)SCNc1nnco1 f245aab364276326559e746d3f996e97 [0,0,0,0,0,1|3,0,0]=4 566 B11R1.172 NC(=O)SCOc1c[nH]cn1 e972d8d7e60d85746b3d5bc0e68615d4 [0,0,0,0,0,1|3,0,0]=4 567 B11R1.172 NC(=O)SCOc1ccco1 b909ddeb0c2182be35eb564945d38c9f [0,0,0,0,0,1|1,0,0]=2 568 B11R1.172 NC(=O)SCOc1cccs1 0e5d146a5918e42230a363d9bdf07324 [0,0,0,0,0,1|1,1,0]=3 569 B11R1.172 NC(=O)SCOc1ccn[nH]1 e9f76fa5bfe56dba67bf2ba9cc45b2d1 [0,0,0,0,0,1|3,0,0]=4 570 B11R1.172 NC(=O)SCOc1ccsc1 830ab5642a8b8cc41cc2a84feefd0bb5 [0,0,0,0,0,1|3,0,0]=4 571 B11R1.172 NC(=O)SCOc1nccs1 bd10003105d46fa6820107c2d4463f7f [0,0,0,0,0,1|2,1,0]=4 572 B11R1.172 NC(=O)SCOn1cccn1 9d40939e6476b745ca01e0540734da1f [0,0,0,0,0,1|3,0,0]=4 573 B11R1.172 NC(=S)CCNc1ccco1 9c5f9c301eece50604b40c0b83fbe39f [0,0,0,0,0,1|2,1,0]=4 574 B11R1.172 O=C(O)CCNc1cccs1 ce94cb2d46b17a86ed1a73ac7890105f [0,0,0,0,0,1|2,1,0]=4 575 B11R1.172 O=C(O)CCNc1ccno1 d4b6c1aacfe5e557161f479edb046e0e [0,0,0,0,0,1|3,0,0]=4 576 B11R1.172 O=C(O)CCNc1ncco1 dc8071ebf241cbcf7c6a3949dbbf648c [0,0,0,0,0,1|3,0,0]=4 577 B11R1.172 O=C(O)CCOc1ccco1 21b91de83358b466cc7a22fde4a1f9b0 [0,0,0,0,0,1|2,0,0]=3 578 B11R1.172 O=C(O)CNCc1ccc[nH]1 3d138a920c9fb2680fe73ae1ec866070 [0,0,0,0,0,1|3,0,0]=4 579 B11R1.172 O=C(O)CNCc1ccco1 4503a4764d3abcbc8a5487f0f255e772 [0,0,0,0,0,1|2,0,0]=3 580 B11R1.172 O=C(O)CNCc1cccs1 6589353daf6c6878fe13fe1bd5a05a32 [0,0,0,0,0,1|2,1,0]=4 581 B11R1.172 O=C(O)CNCc1ccno1 419f64ab65b7ba14cc8176532520daa1 [0,0,0,0,0,1|3,0,0]=4 582 B11R1.172 O=C(O)CNCc1cnco1 c69761e627827a8043deb8e0d16d89e2 [0,0,0,0,0,1|3,0,0]=4 583 B11R1.172 O=C(O)CNCc1ncco1 b6f80caf75d41ec248134f5ed4e33873 [0,0,0,0,0,1|3,0,0]=4 584 B11R1.172 O=C(O)COCc1ccc[nH]1 1e43b9635f5a6de6df4ac7f9f5040b2a [0,0,0,0,0,1|2,1,0]=4 585 B11R1.172 O=C(O)COCc1ccco1 86ba59a113605253dd8262c236f0c2b8 [0,0,0,0,0,1|1,1,0]=3 586 B11R1.172 O=C(O)COCc1cccs1 956edf8e319dd4bdec98a4daef429110 [0,0,0,0,0,1|1,2,0]=4 587 B11R1.172 O=C(O)COCc1ccno1 92e9977c89b9e5d06471307043a1a583 [0,0,0,0,0,1|2,1,0]=4 588 B11R1.172 O=C(O)COCc1cnco1 ea1da8ce0a76f478c90c89d9c8a90ab0 [0,0,0,0,0,1|2,1,0]=4 589 B11R1.172 O=C(O)COCc1ncco1 cde8867d534088f4e8ef37a93ab4a4b1 [0,0,0,0,0,1|2,1,0]=4 590 B11R1.172 O=S(O)CCNc1ccco1 c8c48422e87940db7945f996ca1a423b [0,0,0,0,0,1|3,0,0]=4 591 B11R1.172 O=S(O)COCc1ccco1 2c4930c72f1264510282a2d0d1cd440d [0,0,0,0,0,1|2,1,0]=4 592 B11R1.172 O=[N+]([O-])CNCc1ccco1 1bde24eaa4ebc3eb0967458552eff194 [0,0,0,0,0,1|3,0,0]=4 593 B11R1.172 O=[N+]([O-])COCc1ccco1 1718c557d4e70dcefef3e4f54a42672b [0,0,0,0,0,1|2,1,0]=4 594 B8R0.7 C=CCOCCC(=O)C 329a78e4caec96ed4eabde1e54085f6f [1,0,1,0,0,0|0,0,2]=4 595 B8R0.7 C=CCOCNC(=O)C 9865141036101ac320553ca04e5ea416 [1,0,1,0,0,0|1,0,1]=4 596 B8R0.7 C=COCCNC(=O)C d3122f3ee5d15f554ff520f72b049913 [1,0,1,0,0,0|1,0,1]=4 597 B8R0.7 CC(=O)CNC/C=C\O 19a7672d1a67f2a1a9815025c4514fdd [1,0,1,0,0,0|1,0,1]=4 598 B8R0.9 C=CC(O)CNC(=O)C 81607a1da75c9494462df99b512c5607 [1,0,1,0,0,0|1,0,1]=4 599 B8R1.8 CCOc1ccco1 e09af78840aa7c50339c3ce236ba2f4c [2,0,0,0,0,0|0,1,1]=4 600 B8R1.8 O=CNc1cccs1 ba17c251fb0707a83067f3ecf6d1d996 [2,0,0,0,0,0|1,1,0]=4 601 B8R1.8 O=CNc1ccno1 aae61b9cd3ebc97474890d3f855206e4 [2,0,0,0,0,0|2,0,0]=4 602 B8R1.8 O=CNc1ncco1 6995c12eff18399819f86d155261d936 [2,0,0,0,0,0|2,0,0]=4 603 B10R0.4 C/C=C/COCCSC(=O)C 6fa6a7719acd256e8be75cd2cbeee977 [0,1,1,0,0,0|0,0,2]=4 604 B10R0.4 C/C=C\COCCSC(=O)C aa6f5579a0987908795f5dba6a56e810 [0,1,1,0,0,0|0,0,2]=4 605 B10R0.4 C=CCCOCCSC(=O)C 9bce2e33a0c87e4c05e0b799cf403b95 [0,1,1,0,0,0|0,0,2]=4 606 B10R0.4 C=CCOCCCSC(=O)C da7871feb3287b70ce6d4796620f0c01 [0,1,1,0,0,0|0,0,2]=4 607 B10R0.4 CC(=O)SCCOC/C=C/Cl 5b4b38509926c48cb21c0a9f293cbe6c [0,1,1,0,0,0|0,0,2]=4 608 B10R0.4 CC(=O)SCCOCC=CCl 5bcd6aeee725ad023752d24aa95ed966 [0,1,1,0,0,0|0,0,2]=4 609 B10R0.4 CC=CCOCCSC(=O)C 7c6e71ecea885f101f5bde99550f7d21 [0,1,1,0,0,0|0,0,2]=4 610 B10R0.55 C=C(C=O)OCCSC(=O)C 634b4ea617a2d4d76dd9628af07f3185 [0,1,1,0,0,0|1,0,1]=4 611 B10R0.55 C=CC(C)OCCSC(=O)C 3ab2c0046a0c6372e2a5cddf49a4e8f0 [0,1,1,0,0,0|0,0,2]=4 612 B10R0.55 C=C[C@H](C)OCCSC(=O)C c061762a23d664985210604a9e1859f3 [0,1,1,0,0,0|0,0,2]=4 613 B10R0.97 C=C(Br)COCCSC(=O)C faa5509ece6d8999ac46f4753be23a5d [0,1,1,0,0,0|0,0,2]=4 614 B10R0.97 C=C(C)COCCSC(=O)C 5baca87cfdc011838c2a17a163914dff [0,1,1,0,0,0|0,0,2]=4 615 B10R0.97 C=C(Cl)COCCSC(=O)C 97274c50575eff1aba32e1d2ab51adf7 [0,1,1,0,0,0|0,0,2]=4 616 B10R0.97 C=C(F)COCCSC(=O)C a4fcaf3fa0a7c08c72ab7f40e793d500 [0,1,1,0,0,0|0,0,2]=4 617 B10R0.97 C=C(I)COCCSC(=O)C 1899fd5b9bcd90b01c4c0b0382e9b457 [0,1,1,0,0,0|0,0,2]=4 618 B10R1.11 CC(NC=O)c1ccco1 ddbe85663f32152ae7a905d80f70dce5 [1,1,0,0,0,0|1,0,0]=3 619 B10R1.11 CC(NC=O)c1cccs1 e140bba64e4c2e9bddbde06232ed8a5f [1,1,0,0,0,0|1,1,0]=4 620 B10R1.11 CC(NC=O)c1ncco1 8048fbe8a07781fd7bf6043c57ee8b10 [1,1,0,0,0,0|2,0,0]=4 621 B10R1.11 CCNC(C)c1ccco1 ee141e1d5a490da9995e04ce24e590f9 [1,1,0,0,0,0|1,0,1]=4 622 B10R1.11 CCN[C@H](C)c1ccco1 28eb0d4eaae628536a1bf1f770a877ab [1,1,0,0,0,0|1,0,1]=4 623 B10R1.11 CCOC(C)c1ccco1 3bd2b9ad01c83442911e7c1be5d2164d [1,1,0,0,0,0|0,1,1]=4 624 B10R1.11 CCO[C@H](C)c1ccco1 3c8ceb0e1dd139cd9173630218700cc9 [1,1,0,0,0,0|0,1,1]=4 625 B10R1.11 C[C@@H](NC=O)c1ccco1 dabf68fc67919a7d4d3c16b33f054bdc [1,1,0,0,0,0|1,0,0]=3 626 B10R1.11 C[C@@H](NC=O)c1cccs1 f70bf3c872f03105dbd63b63dbb8840f [1,1,0,0,0,0|1,1,0]=4 627 B10R1.11 C[C@H](NC=O)c1cccs1 4bb0ea6a6a82193677c759d4799a10ee [1,1,0,0,0,0|1,1,0]=4 628 B10R1.16 CCNCc1cc(co1)C 58c09494a030fd296b651bd5ed8df90b [1,1,0,0,0,0|1,0,1]=4 629 B10R1.16 CCNCc1ccc(o1)Br bc69cf8af8c6eedf459de13024a20023 [1,1,0,0,0,0|1,0,1]=4 630 B10R1.16 CCNCc1ccc(o1)C 16b5b202870b0088f6ce61a25808ad7d [1,1,0,0,0,0|1,0,1]=4 631 B10R1.16 CCOCc1cc(co1)Br 488d484e666bbb5ae0db450dbc11796e [1,1,0,0,0,0|0,1,1]=4 632 B10R1.16 CCOCc1ccc(o1)Br 9782731d1ae87bec8e3774d5ccde32bc [1,1,0,0,0,0|0,1,1]=4 633 B10R1.16 CCOCc1ccc(o1)C 7cf8410aa18fcbf976c33b2a6864e0bc [1,1,0,0,0,0|0,1,1]=4 634 B10R1.16 Cc1cc(on1)CNC=O 7082a65cb2fd0a64ecea39512e6d2c4b [1,1,0,0,0,0|2,0,0]=4 635 B10R1.16 Cc1ccc(o1)CNC=O 02731b87228ef2993aa4f8004ecf0c06 [1,1,0,0,0,0|1,0,0]=3 636 B10R1.16 Cc1ccc(s1)CNC=O fc6468575008e634f5c5946401a36ed1 [1,1,0,0,0,0|1,1,0]=4 637 B10R1.16 Cc1cnc(o1)CNC=O f7b0625438ac26ada645342eaa0f99c5 [1,1,0,0,0,0|2,0,0]=4 638 B10R1.16 Cc1coc(c1)CNC=O 314a057a6471b418ab58d9c60bd4c733 [1,1,0,0,0,0|1,0,0]=3 639 B10R1.16 Cc1coc(n1)CNC=O a760e55a2923bab45dbb87f6cd85c646 [1,1,0,0,0,0|2,0,0]=4 640 B10R1.16 Cc1csc(c1)CNC=O aea632179bec77ae7bed276c7bfa4320 [1,1,0,0,0,0|1,1,0]=4 641 B10R1.16 Cc1ncc(o1)CNC=O 574700874a763c6bca5c22d37610c2de [1,1,0,0,0,0|2,0,0]=4 642 B10R1.16 O=CNCc1cc(cs1)Br eb3763ce56665106c55c60edd6aff943 [1,1,0,0,0,0|1,1,0]=4 643 B10R1.16 O=CNCc1cc(cs1)Cl 55d0ce3a1de8798584f986d8ace121af [1,1,0,0,0,0|1,1,0]=4 644 B10R1.16 O=CNCc1cc(no1)Br 5e75aedcf33ffd9b98c28e1482334e0e [1,1,0,0,0,0|2,0,0]=4 645 B10R1.16 O=CNCc1ccc(o1)Br 757e0e439181d815d74ee7edde717301 [1,1,0,0,0,0|1,0,0]=3 646 B10R1.16 O=CNCc1ccc(s1)Br 6d558d768515f9ea2d6134d57133a8dd [1,1,0,0,0,0|1,1,0]=4 647 B10R1.16 O=CNCc1ccc(s1)Cl f3b25be17f4504a4a45886eb369c45ef [1,1,0,0,0,0|1,1,0]=4 648 B10R1.16 O=CNCc1ccc(s1)F f9e754f12ea44d05bb249ef27e9efe9e [1,1,0,0,0,0|1,1,0]=4 649 B10R1.16 O=CNCc1ncc(o1)Br 389cfec1ee945bd3db9e0cc903f9ce9d [1,1,0,0,0,0|2,0,0]=4 650 B10R1.21 BrCCNCc1ccco1 8c5e0347db7e3491c86fcbf95c4451a4 [1,1,0,0,0,0|1,0,1]=4 651 B10R1.21 C/C=C/CNc1cccs1 ab1bac522f2802f13389e7bc621b424e [1,1,0,0,0,0|1,1,0]=4 652 B10R1.21 C/C=C/CNc1ccno1 23139f6cd18f91f89a39b2616a8415ac [1,1,0,0,0,0|2,0,0]=4 653 B10R1.21 C/C=C/CNc1ncco1 a99b04d5727f3394e742350dcd2a43dc [1,1,0,0,0,0|2,0,0]=4 654 B10R1.21 C/C=C/COc1ccco1 49607601c603ccca16018edf0f4cebb7 [1,1,0,0,0,0|1,0,0]=3 655 B10R1.21 C/C=C/COc1cccs1 6c0f88620d8d632f9895acdbb7bf8cde [1,1,0,0,0,0|1,1,0]=4 656 B10R1.21 C/C=C\CNc1cccs1 539500d96ef7d01796d073eba3a04290 [1,1,0,0,0,0|1,1,0]=4 657 B10R1.21 C/C=C\CNc1ccno1 0a7b9035f3f70a6a87e981bbd3d2529a [1,1,0,0,0,0|2,0,0]=4 658 B10R1.21 C/C=C\CNc1ncco1 b9794d08e5e8c44ca000e5fbc54ce017 [1,1,0,0,0,0|2,0,0]=4 659 B10R1.21 C/C=C\COc1ccco1 081cefe6a82f756391efccda3cbbafc4 [1,1,0,0,0,0|1,0,0]=3 660 B10R1.21 C/C=C\COc1cccs1 35e222574ca63276b07811b3cc3d7e9e [1,1,0,0,0,0|1,1,0]=4 661 B10R1.21 C=CCCNc1ccco1 2dc99c635e0fd320f4473dac533cdebc [1,1,0,0,0,0|1,0,1]=4 662 B10R1.21 C=CCCOc1ccco1 c4a6b7713487c646ea5190de2827309c [1,1,0,0,0,0|1,0,1]=4 663 B10R1.21 C=CCNCc1ccco1 9569a46dbd5a5ad2155580854b10270e [1,1,0,0,0,0|1,0,1]=4 664 B10R1.21 C=CCOCc1ccco1 21d0bb8c5631652a2d6e9c845ea783ac [1,1,0,0,0,0|0,1,1]=4 665 B10R1.21 CC=CCNc1ccco1 8978ca9f1a5aa01b20c5fc0ef6bef405 [1,1,0,0,0,0|1,0,0]=3 666 B10R1.21 CC=CCNc1cccs1 73f844b5dcd117551bcb6a9fa79f218f [1,1,0,0,0,0|1,1,0]=4 667 B10R1.21 CC=CCNc1ccno1 b259316349da6e678220bcedfbe14088 [1,1,0,0,0,0|2,0,0]=4 668 B10R1.21 CC=CCNc1ncco1 460da12e3f54d1c642f3bcff6f684f1d [1,1,0,0,0,0|2,0,0]=4 669 B10R1.21 CCCCNc1ccco1 59676670e7fa0c04d4e8b3beb240e350 [1,1,0,0,0,0|1,0,1]=4 670 B10R1.21 CCCCOc1ccco1 69ea1c44ba0b20cb45990b8719447407 [1,1,0,0,0,0|1,0,1]=4 671 B10R1.21 CCCNCc1ccco1 de6afd493c9d06f3af6e49358fd71eee [1,1,0,0,0,0|1,0,1]=4 672 B10R1.21 CCCOCc1ccco1 68fddc7fa2e66c072844daffb93c2167 [1,1,0,0,0,0|0,1,1]=4 673 B10R1.21 CCNCCc1ccco1 1ad917faeddbc2d8d316341d3d41b62a [1,1,0,0,0,0|1,0,1]=4 674 B10R1.21 CCOCCc1ccco1 bed872e177b1646746b6cb5e6f761166 [1,1,0,0,0,0|0,1,1]=4 675 B10R1.21 CCOCOc1ccco1 50027f11f0ebc3bb1d65662891127453 [1,1,0,0,0,0|0,1,1]=4 676 B10R1.21 COCCNc1ccco1 6446037fd2435f1d5d632a2ea17e6335 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.21 COCCOc1ccco1 7edab0eeb45cb66520c905082a1511e1 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.21 COCNCc1ccco1 ab0a134b649505be2ef4a9f4f282a23e [1,1,0,0,0,0|1,0,1]=4 679 B10R1.21 COCOCc1ccco1 529eee71e246af8b856ae502514aa81f [1,1,0,0,0,0|0,1,1]=4 680 B10R1.21 CSCCNc1ccco1 16997d2db32ec42d1356855cff785f3f [1,1,0,0,0,0|2,0,0]=4 681 B10R1.21 CSCCOc1ccco1 5259ce914bbcf53da4292d4e69a6b1eb [1,1,0,0,0,0|2,0,0]=4 682 B10R1.21 CSCNCc1ccco1 45b3d80d16b3c23ee837399e5f9cf973 [1,1,0,0,0,0|1,0,1]=4 683 B10R1.21 CSCOCc1ccco1 d82d2c3aff1c65cd9f5801d7e0281663 [1,1,0,0,0,0|0,1,1]=4 684 B10R1.21 Cl/C=C/COc1ccco1 7aa32b0722c0c4f5075fd40cec978e4a [1,1,0,0,0,0|2,0,0]=4 685 B10R1.21 Cl/C=C\COc1ccco1 2678d6483afee8d91d4111c377d90626 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.21 FCCNCc1ccco1 eb7e2df8659dc52d8124585605ffbbe6 [1,1,0,0,0,0|1,0,1]=4 687 B10R1.21 FCCOCc1ccco1 967242227467dd8667ea4ec0e6be7d8a [1,1,0,0,0,0|0,1,1]=4 688 B10R1.21 FCNCCc1ccco1 c274e2fe40f74a5250d921378d833f9d [1,1,0,0,0,0|2,0,0]=4 689 B10R1.21 FCOCCc1ccco1 b932bcc9cfe884b19a450cd3b0242ac1 [1,1,0,0,0,0|2,0,0]=4 690 B10R1.21 ICCNCc1ccco1 bd983b5b71179f97af0b655fa1b40bbd [1,1,0,0,0,0|1,0,1]=4 691 B10R1.21 N#CSCOc1ccco1 9b7c1cdd7a8ef506f763c772dd654ad2 [1,1,0,0,0,0|1,0,1]=4 692 B10R1.21 O=CCCNc1cccs1 cf723f42f768b24ec42d1757ae280dc8 [1,1,0,0,0,0|1,1,0]=4 693 B10R1.21 O=CCCNc1ccno1 7a88fe355d2a534b4fd46df3f5808c55 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.21 O=CCCNc1ncco1 fb776ff68a458fb64c5ac0d805cf09aa [1,1,0,0,0,0|2,0,0]=4 695 B10R1.21 O=CCCOc1ccco1 29d0eddc230514e8e3bb8cacc9923f78 [1,1,0,0,0,0|1,0,0]=3 696 B10R1.21 O=CCCOc1cccs1 3c97730eeb94cffc869f74e9b437863e [1,1,0,0,0,0|1,1,0]=4 697 B10R1.21 O=CCNCc1ccc[nH]1 639a18cc5e97b07de5adf524490bad82 [1,1,0,0,0,0|2,0,0]=4 698 B10R1.21 O=CCNCc1ccco1 0ab8a1ebd15283db8f5f3f17ac902f12 [1,1,0,0,0,0|1,0,0]=3 699 B10R1.21 O=CCNCc1cccs1 e94becbb6eb95ee69efd16aa47a4093c [1,1,0,0,0,0|1,1,0]=4 700 B10R1.21 O=CCNCc1ccno1 978aadcc6e01f87e8d8afb3f9e75e90e [1,1,0,0,0,0|2,0,0]=4 701 B10R1.21 O=CCNCc1cnco1 58a57fef6fc554af7226549b91166623 [1,1,0,0,0,0|2,0,0]=4 702 B10R1.21 O=CCNCc1ncco1 ac49783ef77ca87adf8287f4ded3f0f6 [1,1,0,0,0,0|2,0,0]=4 703 B10R1.21 O=CCOCc1ccc[nH]1 97ffcf32763fc9745266acd768ec8a83 [1,1,0,0,0,0|1,1,0]=4 704 B10R1.21 O=CCOCc1ccco1 22e3ccbc249d54fc00073a07f33cc6b4 [1,1,0,0,0,0|0,1,0]=3 705 B10R1.21 O=CCOCc1cccs1 f2a935b74a2608083c2a4099d7794c24 [1,1,0,0,0,0|0,2,0]=4 706 B10R1.21 O=CCOCc1ccno1 fe1747df203186af0b56d5e33facdf5e [1,1,0,0,0,0|1,1,0]=4 707 B10R1.21 O=CCOCc1cnco1 615a5c95d412eed9adf2d90d072cfb2e [1,1,0,0,0,0|1,1,0]=4 708 B10R1.21 O=CCOCc1ncco1 50c7923fde7502fbf1b355e2a11c9baa [1,1,0,0,0,0|1,1,0]=4 709 B10R1.21 O=CNCCc1ccco1 0b737060dc1ee55a5f0568ed4921621c [1,1,0,0,0,0|1,0,0]=3 710 B10R1.21 O=CNCCc1cccs1 fd1222ac3d0e2b6ccbfd32e31af9a8d7 [1,1,0,0,0,0|1,1,0]=4 711 B10R1.21 OCCNCc1ccco1 507ba03e75d5eda37d046de9368bba24 [1,1,0,0,0,0|1,0,1]=4 712 B10R1.21 OCNCCc1ccco1 a517e208412caca7f657ad953f1e4b62 [1,1,0,0,0,0|2,0,0]=4 713 B10R1.21 SCCNCc1ccco1 4422157518229a6c95ffdca9589320be [1,1,0,0,0,0|1,0,1]=4 714 B10R1.21 SCCOCc1ccco1 eb21d9a30652a8f888082605ebcb92a4 [1,1,0,0,0,0|0,1,1]=4 715 B10R1.27 CC(C=O)Oc1ccco1 135f5d833c8d42c9644f16e573ebe678 [1,1,0,0,0,0|2,0,0]=4 716 B10R1.27 CCN(C)Cc1ccco1 76ba84af7af62748e537e57011bb5102 [1,1,0,0,0,0|1,0,1]=4 717 B10R1.27 CN(C=O)Cc1ccco1 717a7d8b3764ff0b3e1e4cf00cb53e3a [1,1,0,0,0,0|1,0,0]=3 718 B10R1.27 CN(C=O)Cc1cccs1 bb1b0a7ece4111e21fe8be693bcf2f97 [1,1,0,0,0,0|1,1,0]=4 719 B10R1.27 CN(C=O)Cc1ccno1 5309846741912f9b401b128276b0f0ea [1,1,0,0,0,0|2,0,0]=4 720 B10R1.27 CN(C=O)Cc1ncco1 a258d8c0a11315bda756d073815db626 [1,1,0,0,0,0|2,0,0]=4 721 B10R1.27 C[C@H](C=O)Oc1ccco1 5bdca6620ba06d658d5ddbf85a11061b [1,1,0,0,0,0|2,0,0]=4 722 B10R1.29 CCNCc1occc1C 9ef238004378a81a0f74d5a2034266a3 [1,1,0,0,0,0|1,0,1]=4 723 B10R1.29 CCOCc1occc1Br 091ac4b360c592cc4f7db4a049ac0a99 [1,1,0,0,0,0|0,1,1]=4 724 B10R1.29 CCOCc1occc1C e7df444d3db70c6d7ce1aeb39d71e1ae [1,1,0,0,0,0|0,1,1]=4 725 B10R1.29 Cc1ccoc1CNC=O 4166e7e09b9e12df33d142c718b4889d [1,1,0,0,0,0|1,0,0]=3 726 B10R1.29 Cn1cccc1CNC=O fb3ffbb884b532b761168b56dd024e12 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.29 O=CNCc1sccc1Br e38710cbe1bd705ddd8bc8db1c12e2d2 [1,1,0,0,0,0|1,1,0]=4 728 B10R1.29 O=CNCc1sccc1Cl 8cafc98a5f0f80157215a91f362a6b71 [1,1,0,0,0,0|1,1,0]=4 729 B10R1.29 O=CNCc1sccc1F 8710ae4ea4c5b20e527185f18c874709 [1,1,0,0,0,0|1,1,0]=4 730 B10R1.23 CC(=O)N(C)c1ncco1 fbef3ee7d925bf7234b315644b4968be [0,1,0,0,1,0|2,0,0]=4 731 B10R1.54 CC(=O)Nc1cnc(o1)C abc73c25d4867826ef3bfc13f8c7316c [0,1,0,0,1,0|2,0,0]=4 732 B10R1.54 CC(=O)Nc1nc(co1)Br 87a95faa6723d91bdd0802718ae9b1f4 [0,1,0,0,1,0|2,0,0]=4 733 B10R1.54 CC(=O)Nc1nc(co1)C 57a302d71eb45e267d8631f9449ec3ea [0,1,0,0,1,0|2,0,0]=4 734 B10R1.54 CC(=O)Nc1ncc(o1)C bf46992bdf79173921a665869350e14e [0,1,0,0,1,0|2,0,0]=4 735 B12R1.21 CC(=O)NCc1ccc(cc1)Br d2cc47a2d2f5d0454a6ab6aa9be01b2e [0,1,0,0,0,1|2,0,0]=4 736 B12R1.21 CC(=O)NCc1ccc(cc1)C 6d1c8fe2cbf40141f0ff7216820c0ba5 [0,1,0,0,0,1|2,0,0]=4 737 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 932ef7783d78c6800f8298437d4b88f9 [0,1,0,0,0,1|2,0,0]=4 738 B12R1.21 CC(=O)NCc1ccc(cc1)F c15fb7f7daa1d8d13002cf39462c9e3a [0,1,0,0,0,1|2,0,0]=4 739 B12R1.21 CC(=O)NCc1ccc(cc1)I 638cbc421d0f9cd22ecaa35e0d864cbc [0,1,0,0,0,1|2,0,0]=4 740 B12R1.21 CC(=O)NCc1ccc(cc1)O 3eb259396d79ab6b5f53bb6ff52007c0 [0,1,0,0,0,1|2,0,0]=4 741 B12R1.21 CC(=O)NCc1ccc(cn1)Br fb8f8537a7bbf570a19dea4d0aa6d18d [0,1,0,0,0,1|2,0,0]=4 742 B12R1.21 CC(=O)NCc1ccc(cn1)C f38c03df8524acc05ebff836b6a5b5af [0,1,0,0,0,1|2,0,0]=4 743 B12R1.21 CC(=O)NCc1ccc(cn1)Cl 6a011978ddf38308f5a5156573588194 [0,1,0,0,0,1|2,0,0]=4 744 B12R1.21 CC(=O)NCc1ccc(cn1)F d40665011432ddf8f16403b67189332a [0,1,0,0,0,1|2,0,0]=4 745 B12R1.21 CC(=O)NCc1ccc(cn1)O 7406aaf103c654960018dd961b73cac8 [0,1,0,0,0,1|2,0,0]=4 746 B12R1.21 CC(=O)NCc1ccc(nc1)Br e9dbeda635f5ea81b0bda7268917134d [0,1,0,0,0,1|2,0,0]=4 747 B12R1.21 CC(=O)NCc1ccc(nc1)C c7de52d9e18c5b5eeea94a97977c5605 [0,1,0,0,0,1|2,0,0]=4 748 B12R1.21 CC(=O)NCc1ccc(nc1)Cl 9eb33223753c16aea396f97336de070d [0,1,0,0,0,1|2,0,0]=4 749 B12R1.21 CC(=O)NCc1ccc(nc1)F 6b7a55dd10ce9ac95968778b4ef6141e [0,1,0,0,0,1|2,0,0]=4 750 B12R1.21 CC(=O)NCc1ccc(nn1)C 126f8bc204361b9e2ba4cd218910ca56 [0,1,0,0,0,1|2,0,0]=4 751 B12R1.21 CC(=O)NCc1ccc(nn1)Cl 769ca8d45bf456633fafe46f4250b9cc [0,1,0,0,0,1|2,0,0]=4 752 B12R1.21 CC(=O)NCc1cnc(cn1)Br 0a50bed155535c3b42c62354503d907d [0,1,0,0,0,1|2,0,0]=4 753 B12R1.21 CC(=O)NCc1cnc(cn1)C 2db0c3663a53bfb93147d716c0023ecf [0,1,0,0,0,1|2,0,0]=4 754 B12R1.21 CC(=O)NCc1cnc(cn1)Cl 37ec05e031949654ec9c13a99e5ba82d [0,1,0,0,0,1|2,0,0]=4 755 B12R1.21 CC(=O)NCc1ncc(cn1)Br 5de20d9d7db31824cad73060813aa927 [0,1,0,0,0,1|2,0,0]=4 756 B12R1.21 CC(=O)NCc1ncc(cn1)C 5009afd58a5769b99ccbbfeaafb2b5fd [0,1,0,0,0,1|2,0,0]=4 757 B12R1.21 CC(=O)NCc1ncc(cn1)Cl 9b40a84b699d8ea060a3ddfaaa7d0ee2 [0,1,0,0,0,1|2,0,0]=4 758 B12R1.21 CC(=O)NCc1ncc(cn1)F 52e18490adc22983753294c1dc70bd1a [0,1,0,0,0,1|2,0,0]=4 759 B12R1.27 CCC(=O)NCc1ccccc1 cd109163e80059e2763660343f9dbe36 [0,1,0,0,0,1|2,0,0]=4 760 B12R1.27 CCC(=O)NCc1ccccn1 8feeaaa17ff0b8e92392e088c3f6feb2 [0,1,0,0,0,1|2,0,0]=4 761 B12R1.27 CCC(=O)NCc1cccnc1 163349dbb40d7f18c251a823056c2629 [0,1,0,0,0,1|2,0,0]=4 762 B12R1.27 CCC(=O)NCc1cccnn1 1483b94e7eca014cbe2ad2c78a20b994 [0,1,0,0,0,1|2,0,0]=4 763 B12R1.27 CCC(=O)NCc1ccncc1 144e26626888e38f930efdfdcacd3026 [0,1,0,0,0,1|2,0,0]=4 764 B12R1.27 CCC(=O)NCc1ccncn1 88b81439885ea8cff5a8958cb1bb43ac [0,1,0,0,0,1|2,0,0]=4 765 B12R1.27 CCC(=O)NCc1cnccn1 9cdf4761dd5db2a2596b884b42c64499 [0,1,0,0,0,1|2,0,0]=4 766 B12R1.27 CCC(=O)NCc1ncccn1 d392902d20140819a273d44b32cc0be2 [0,1,0,0,0,1|2,0,0]=4 767 B12R1.27 O=C(CF)NCc1ccccc1 44d0634b73cc2a3134198abb702adc32 [0,1,0,0,0,1|2,0,0]=4 768 B12R1.27 O=C(CF)NCc1ccccn1 4c7b5fbb214e22648f8c87757a037fe0 [0,1,0,0,0,1|2,0,0]=4 769 B12R1.27 O=C(CF)NCc1cccnc1 55aee9f781bad42df720fff04950da75 [0,1,0,0,0,1|2,0,0]=4 770 B12R1.27 O=C(CF)NCc1cccnn1 8fed459d5a1b68a9653d79ba21836e42 [0,1,0,0,0,1|2,0,0]=4 771 B12R1.27 O=C(CF)NCc1ccncc1 3f91363ab12717dc7294b05ffdae271f [0,1,0,0,0,1|2,0,0]=4 772 B12R1.27 O=C(CF)NCc1ccncn1 f0cdcc921b9f28a34d6b78cc1aea3317 [0,1,0,0,0,1|2,0,0]=4 773 B12R1.27 O=C(CF)NCc1cnccn1 ec30b0474ceeace2bea86f7a86e3a5ae [0,1,0,0,0,1|2,0,0]=4 774 B12R1.27 O=C(CF)NCc1ncccn1 435949e5c6b4548aef56b5f8d58b51a4 [0,1,0,0,0,1|2,0,0]=4 775 B12R1.27 O=C(CO)NCc1ccccc1 f4f787a5214848c6970058ebdb73c876 [0,1,0,0,0,1|2,0,0]=4 776 B12R1.27 O=C(CO)NCc1ccccn1 76eb78e75930ec6892869074780cca40 [0,1,0,0,0,1|2,0,0]=4 777 B12R1.27 O=C(CO)NCc1cccnc1 accc53643db8ccf06656b79e4c302034 [0,1,0,0,0,1|2,0,0]=4 778 B12R1.27 O=C(CO)NCc1cccnn1 c7af8776b37791b5de368b369197b739 [0,1,0,0,0,1|2,0,0]=4 779 B12R1.27 O=C(CO)NCc1ccncc1 e6e3500e223e964fc174f8ea1c4cb0cf [0,1,0,0,0,1|2,0,0]=4 780 B12R1.27 O=C(CO)NCc1ccncn1 05dd953bad7485a3c413d234f7d9ba89 [0,1,0,0,0,1|2,0,0]=4 781 B12R1.27 O=C(CO)NCc1cnccn1 1f35d793bce8f5fd30db171aa631f8f9 [0,1,0,0,0,1|2,0,0]=4 782 B12R1.27 O=C(CO)NCc1ncccn1 4206f48fceeee3fa8734c80623676221 [0,1,0,0,0,1|2,0,0]=4 783 B12R1.27 O=C(CS)NCc1ccccc1 f91da9c658c39a4f0c257ce61b60a1a7 [0,1,0,0,0,1|2,0,0]=4 784 B12R1.27 O=C(CS)NCc1ccccn1 ae765a2702e1ea1d8d048ef10891fe36 [0,1,0,0,0,1|2,0,0]=4 785 B12R1.27 O=C(CS)NCc1cccnc1 5a5dc7c7f2b3649e173a6d2509493bc1 [0,1,0,0,0,1|2,0,0]=4 786 B12R1.27 O=C(CS)NCc1cccnn1 f57cabc18b2a07573ee8005ba9b8f995 [0,1,0,0,0,1|2,0,0]=4 787 B12R1.27 O=C(CS)NCc1ccncc1 3c01785cc067c5560ab97b77c8bba642 [0,1,0,0,0,1|2,0,0]=4 788 B12R1.27 O=C(CS)NCc1ccncn1 9b8c12c7209e60fdfd511bdf28f0b540 [0,1,0,0,0,1|2,0,0]=4 789 B12R1.27 O=C(CS)NCc1cnccn1 b2cdea1ec8c3ff1ebae91af81c0a9007 [0,1,0,0,0,1|2,0,0]=4 790 B12R1.27 O=C(CS)NCc1ncccn1 c0ccffbb5ee2913398d86e568ddd7a4a [0,1,0,0,0,1|2,0,0]=4 791 B12R1.43 CC(=O)N(C)Cc1ccccc1 b985bf2c7484ae6a34647301b4683566 [0,1,0,0,0,1|2,0,0]=4 792 B12R1.43 CC(=O)N(C)Cc1ccccn1 c450d3ea04b8e825f53753140b07d344 [0,1,0,0,0,1|2,0,0]=4 793 B12R1.43 CC(=O)N(C)Cc1cccnc1 68d654439a46d431d82ead819a36e573 [0,1,0,0,0,1|2,0,0]=4 794 B12R1.43 CC(=O)N(C)Cc1ccncc1 e53a41aba747eca10244f4b7246f4b7f [0,1,0,0,0,1|2,0,0]=4 795 B12R1.43 CC(=O)N(C)Cc1cnccn1 ad3593576626ba490508690e5f561bbc [0,1,0,0,0,1|2,0,0]=4 796 B12R1.43 CC(=O)N(C)Cc1ncccn1 a92c15c01ec5982dd664d8d452fe8fb9 [0,1,0,0,0,1|2,0,0]=4 797 B12R1.107 CC(=O)NC(C)c1ccccc1 5ac270090224b04d6e18bd0f40247bab [0,1,0,0,0,1|2,0,0]=4 798 B12R1.107 CC(=O)NC(C)c1ccccn1 9f2410e3ed5d3dedf6c6d0d1d301442e [0,1,0,0,0,1|2,0,0]=4 799 B12R1.107 CC(=O)NC(C)c1cccnc1 bd3e42a6def30cb8723774fd29dfd160 [0,1,0,0,0,1|2,0,0]=4 800 B12R1.107 CC(=O)NC(C)c1cccnn1 b8f763e9ee4414149953894acde2afa1 [0,1,0,0,0,1|2,0,0]=4 801 B12R1.107 CC(=O)NC(C)c1ccncc1 c0286e2a14d5d3a09435b90d3ea8035c [0,1,0,0,0,1|2,0,0]=4 802 B12R1.107 CC(=O)NC(C)c1ccncn1 cdfc6bb21fcff83f8836cc0ffa0e98f6 [0,1,0,0,0,1|2,0,0]=4 803 B12R1.107 CC(=O)NC(C)c1cnccn1 a09cd08937deccf4150a561bb950c630 [0,1,0,0,0,1|2,0,0]=4 804 B12R1.107 CC(=O)NC(C)c1ncccn1 f401c9d566dbf6e6bc556727bef0eb8f [0,1,0,0,0,1|2,0,0]=4 805 B12R1.107 CC(=O)N[C@@H](C)c1ccccc1 83a412c49d00ac7737895652e0438906 [0,1,0,0,0,1|2,0,0]=4 806 B12R1.107 CC(=O)N[C@@H](C)c1ccccn1 bbfb864aee062a617392dbd043149f2d [0,1,0,0,0,1|2,0,0]=4 807 B12R1.107 CC(=O)N[C@@H](C)c1cccnc1 053abbdf2a9a3a050db980212be86e97 [0,1,0,0,0,1|2,0,0]=4 808 B12R1.107 CC(=O)N[C@@H](C)c1ccncc1 e6d5d6c9d8ffc57e06bb54ddb1f511e9 [0,1,0,0,0,1|2,0,0]=4 809 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 6af9f7af8ede42291806b12f353a29c9 [0,1,0,0,0,1|2,0,0]=4 810 B12R1.107 CC(=O)N[C@H](C)c1ccccn1 c6420d1df4c62b07acb66dd07c94413a [0,1,0,0,0,1|2,0,0]=4 811 B12R1.107 CC(=O)N[C@H](C)c1cccnc1 6f5e2b5e5c3e848b6c8230b33688a8e9 [0,1,0,0,0,1|2,0,0]=4 812 B12R1.107 CC(=O)N[C@H](C)c1ccncc1 434ca703e8c14bed1fd8b31e47f0d354 [0,1,0,0,0,1|2,0,0]=4 813 B12R1.125 CC(=O)NCc1cccc[n+]1[O-] adc678d961e957320b6e327b1fdff9ab [0,1,0,0,0,1|2,0,0]=4 814 B12R1.125 CC(=O)NCc1ccccc1Br c47d1b381faeb3750f6d77f8a6825780 [0,1,0,0,0,1|2,0,0]=4 815 B12R1.125 CC(=O)NCc1ccccc1C 878373bfe1c9994e38f6b300a4c7508f [0,1,0,0,0,1|2,0,0]=4 816 B12R1.125 CC(=O)NCc1ccccc1Cl b19ee0daad189de3f536de6cee918157 [0,1,0,0,0,1|2,0,0]=4 817 B12R1.125 CC(=O)NCc1ccccc1F 7cb30f4a5a9e7b6ebe7ffa0ec755e5d6 [0,1,0,0,0,1|2,0,0]=4 818 B12R1.125 CC(=O)NCc1ccccc1I 3fdc9f6ca170895ba3e43a993004cbe3 [0,1,0,0,0,1|2,0,0]=4 819 B12R1.125 CC(=O)NCc1ccccc1O 0586c5299a3d61253924ffc29f47c091 [0,1,0,0,0,1|2,0,0]=4 820 B12R1.125 CC(=O)NCc1cccnc1Br 62f6e20039d072bcd7738e6e2318ec61 [0,1,0,0,0,1|2,0,0]=4 821 B12R1.125 CC(=O)NCc1cccnc1C b81f4e2602bed8897ba4d3d274e56b6d [0,1,0,0,0,1|2,0,0]=4 822 B12R1.125 CC(=O)NCc1cccnc1Cl 5ae7fa168c653f1a409fed2b9dc0d75d [0,1,0,0,0,1|2,0,0]=4 823 B12R1.125 CC(=O)NCc1cccnc1F f0671dbd7cff55cce0cc54eb3ae10bb2 [0,1,0,0,0,1|2,0,0]=4 824 B12R1.125 CC(=O)NCc1ccncc1Br c4a95755043f6a0c3d22fc63e4720d23 [0,1,0,0,0,1|2,0,0]=4 825 B12R1.125 CC(=O)NCc1ccncc1C 8c28b95ff25959676d478998d29984fa [0,1,0,0,0,1|2,0,0]=4 826 B12R1.125 CC(=O)NCc1ccncc1Cl 66e09234ca1d6c56ee804d19475e9c3d [0,1,0,0,0,1|2,0,0]=4 827 B12R1.125 CC(=O)NCc1ccncc1F 81b87a60c6add1599b8d077db80dffe5 [0,1,0,0,0,1|2,0,0]=4 828 B12R1.125 CC(=O)NCc1ccncc1O bfcd17ca52115d551859bf61a75280b8 [0,1,0,0,0,1|2,0,0]=4 829 B12R1.125 CC(=O)NCc1cnccc1C 59344c28bf73867bd1874b4bbab5feeb [0,1,0,0,0,1|2,0,0]=4 830 B12R1.125 CC(=O)NCc1ncccc1Br e4fffdfee10e36c569e067c3c218f970 [0,1,0,0,0,1|2,0,0]=4 831 B12R1.125 CC(=O)NCc1ncccc1C aca4e86732225f733801ebe508110b68 [0,1,0,0,0,1|2,0,0]=4 832 B12R1.125 CC(=O)NCc1ncccc1Cl 0b2d7789d42fa9dba1a6fd00984de015 [0,1,0,0,0,1|2,0,0]=4 833 B12R1.125 CC(=O)NCc1ncccc1F 5b6f475df8e6a6b3575519ff77a19400 [0,1,0,0,0,1|2,0,0]=4 834 B12R1.125 CC(=O)NCc1ncccc1O 25474b4a15ab9026b21497dfe5b7bebd [0,1,0,0,0,1|2,0,0]=4 835 B12R1.125 CC(=O)NCc1nccnc1Cl 88a6cf400dbb0bb3642539f129831047 [0,1,0,0,0,1|2,0,0]=4 836 B12R1.125 CC(=O)NCc1nnccc1C f6fd816587299c5cc0b5e706b44ac6cc [0,1,0,0,0,1|2,0,0]=4 837 B12R1.226 CC(=O)NCc1cc(ccn1)Br 3c346d9dddff29000302a5d526317a77 [0,1,0,0,0,1|2,0,0]=4 838 B12R1.226 CC(=O)NCc1cc(ccn1)C 429b26804f717563030425c491283281 [0,1,0,0,0,1|2,0,0]=4 839 B12R1.226 CC(=O)NCc1cc(ccn1)Cl 7586965aa22ceb837f608b8f0594f814 [0,1,0,0,0,1|2,0,0]=4 840 B12R1.226 CC(=O)NCc1ccc[n+](c1)[O-] 24275597d47510c3e041f2e83bfada16 [0,1,0,0,0,1|2,0,0]=4 841 B12R1.226 CC(=O)NCc1cccc(c1)Br de12b91af74adce6491e684ee046a109 [0,1,0,0,0,1|2,0,0]=4 842 B12R1.226 CC(=O)NCc1cccc(c1)C 2a897b53ee5ae4ee12831959238615eb [0,1,0,0,0,1|2,0,0]=4 843 B12R1.226 CC(=O)NCc1cccc(c1)Cl 41ca11020cbae0363ca80ce2470c3eaa [0,1,0,0,0,1|2,0,0]=4 844 B12R1.226 CC(=O)NCc1cccc(c1)F 01d6391ca1042cdbb55ba2e4912ec579 [0,1,0,0,0,1|2,0,0]=4 845 B12R1.226 CC(=O)NCc1cccc(c1)I 5fa08dbe9ba4e88c69d843155ffafe98 [0,1,0,0,0,1|2,0,0]=4 846 B12R1.226 CC(=O)NCc1cccc(c1)O c305a8cebe934755e5a41fc4c98fdcfd [0,1,0,0,0,1|2,0,0]=4 847 B12R1.226 CC(=O)NCc1cccc(n1)Br 0f60240374d98f44993e2c5ba8414971 [0,1,0,0,0,1|2,0,0]=4 848 B12R1.226 CC(=O)NCc1cccc(n1)C ff894d8ae2ecfa1c00d2f0abc4131898 [0,1,0,0,0,1|2,0,0]=4 849 B12R1.226 CC(=O)NCc1cccc(n1)Cl 420099df8a33fec62f353266fdcc63a0 [0,1,0,0,0,1|2,0,0]=4 850 B12R1.226 CC(=O)NCc1cccc(n1)F cc4f35c3fc7c759cf2a59c9c9b1dd0b0 [0,1,0,0,0,1|2,0,0]=4 851 B12R1.226 CC(=O)NCc1ccnc(c1)Br eab8b2206918807938ea11ddc79a956b [0,1,0,0,0,1|2,0,0]=4 852 B12R1.226 CC(=O)NCc1ccnc(c1)C d16c7b99677f4c6cc1ac59a6ab724882 [0,1,0,0,0,1|2,0,0]=4 853 B12R1.226 CC(=O)NCc1ccnc(c1)Cl 8d995cea5bcc2a694c9b597f899eb394 [0,1,0,0,0,1|2,0,0]=4 854 B12R1.226 CC(=O)NCc1ccnc(c1)F 1cf74abba14b4f8a94b3bc1bf310b512 [0,1,0,0,0,1|2,0,0]=4 855 B12R1.226 CC(=O)NCc1ccnc(n1)C e1af3db8f32ffa0ca938e5e44774ad13 [0,1,0,0,0,1|2,0,0]=4 856 B12R1.226 CC(=O)NCc1cncc(c1)Br 98628582e14e1ea7e3b382b4593d9efa [0,1,0,0,0,1|2,0,0]=4 857 B12R1.226 CC(=O)NCc1cncc(c1)C a0b0222bd9beefb065992dcbb0f9157d [0,1,0,0,0,1|2,0,0]=4 858 B12R1.226 CC(=O)NCc1cncc(c1)Cl 8cfb134e8659701dd7549b104bf96d89 [0,1,0,0,0,1|2,0,0]=4 859 B12R1.226 CC(=O)NCc1cncc(c1)F aa4ed4c60f5c266021a898f6861ab12a [0,1,0,0,0,1|2,0,0]=4 860 B12R1.226 CC(=O)NCc1cncc(c1)O 6871085a4fa5a87c8288016f463922cc [0,1,0,0,0,1|2,0,0]=4 861 B12R1.226 CC(=O)NCc1cncc(n1)Cl 9496d6b9e2e705405b14c4b1125b51a0 [0,1,0,0,0,1|2,0,0]=4 862 B12R1.226 CC(=O)NCc1nccc(n1)C c8eb7e7d4c8203111a9dd888dcd3552e [0,1,0,0,0,1|2,0,0]=4 863 B12R1.226 CC(=O)NCc1nccc(n1)Cl 940f5d6d7e12eed9fd68dd08007b5826 [0,1,0,0,0,1|2,0,0]=4 864 B12R1.226 CC(=O)NCc1nccc(n1)O 08d39326ac41bf8354f47a68d131ecd8 [0,1,0,0,0,1|2,0,0]=4 865 B12R1.54 C=C(C)CNC(C)c1ccco1 c9e5d4a874da072240ab08c3788f7fea [0,1,0,0,0,1|2,0,0]=4 866 B12R1.54 C=C(C)CN[C@H](C)c1ccco1 62851749aa26266a0cd2cecf98346857 [0,1,0,0,0,1|2,0,0]=4 867 B12R1.54 C=C(C)COC(C)c1ccco1 bac10378e397b117724d2383af60247a [0,1,0,0,0,1|1,1,0]=4 868 B12R1.54 C=C(C)CO[C@H](C)c1ccco1 f7d362fcddb233d0a64f8741beba9c2f [0,1,0,0,0,1|1,1,0]=4 869 B12R1.54 CC(=O)CCN(C)c1ncco1 187f9286d54bab41b0001714145cb5bd [0,1,0,0,0,1|2,0,0]=4 870 B12R1.54 CC(=O)CNC(=O)c1ccco1 56654b89a8dfbd72cd379dbeb9d1b7b7 [0,1,0,0,0,1|1,0,1]=4 871 B12R1.54 CC(=O)NCC(O)c1ccco1 f2e81afc8e8304b7e3ab1869a2593ba5 [0,1,0,0,0,1|1,0,0]=3 872 B12R1.54 CC(=O)NCC(O)c1cccs1 43262675cb0d43f197929195cc595e21 [0,1,0,0,0,1|1,1,0]=4 873 B12R1.54 CC(=O)OCN(C)c1ncco1 1f6705c88a25f80e90f5d33f3e51ed50 [0,1,0,0,0,1|1,1,0]=4 874 B12R1.54 CC(NCC(=O)N)c1ccco1 eff112b2b40dd8e7050d780004cd011f [0,1,0,0,0,1|2,0,0]=4 875 B12R1.54 CC(NCC(=O)O)c1ccco1 551a5ae64bc1aa1551a5133c7605b454 [0,1,0,0,0,1|2,0,0]=4 876 B12R1.54 CC(OCC(=O)N)c1ccco1 6963a82be71f242c2caf0b6c9446a69b [0,1,0,0,0,1|1,1,0]=4 877 B12R1.54 CC(OCC(=O)O)c1ccco1 e1b893df3f06a2c21df1c6ee9f70db06 [0,1,0,0,0,1|1,1,0]=4 878 B12R1.54 CN(CSC(=O)N)c1ncco1 c64b0f07bda648039e00d6a5e853e77b [0,1,0,0,0,1|2,0,0]=4 879 B12R1.54 C[C@@H](NCC(=O)N)c1ccco1 eab8f4d76044cc453219a84f95d8cf23 [0,1,0,0,0,1|2,0,0]=4 880 B12R1.54 C[C@@H](NCC(=O)O)c1ccco1 baa4be98371dbe86dd2ea9b78b1ecd76 [0,1,0,0,0,1|2,0,0]=4 881 B12R1.54 C[C@@H](OCC(=O)N)c1ccco1 bb68bad85358dd7e87a2ab14dde2f0f9 [0,1,0,0,0,1|1,1,0]=4 882 B12R1.54 C[C@@H](OCC(=O)O)c1ccco1 ce6ad5d380ace876e3e2d1f8389170f2 [0,1,0,0,0,1|1,1,0]=4 883 B12R1.105 C=C(C)CCNc1cc(co1)C 7d440d78e0168bd1974f0e656e49258b [0,1,0,0,0,1|2,0,0]=4 884 B12R1.105 C=C(C)CCNc1ccc(o1)C 97aae9e3867b0db4594657cade28fc32 [0,1,0,0,0,1|2,0,0]=4 885 B12R1.105 C=C(C)CNCc1cc(co1)C 9f32f6d7f4ee05e87fdd1c0c48f2a80f [0,1,0,0,0,1|2,0,0]=4 886 B12R1.105 C=C(C)CNCc1ccc(o1)Br a9aacdfe8e9d897102d504eb43d9453e [0,1,0,0,0,1|2,0,0]=4 887 B12R1.105 C=C(C)CNCc1ccc(o1)C 08b6f31e9875dfcfdd3e014693d4223e [0,1,0,0,0,1|2,0,0]=4 888 B12R1.105 C=C(C)COCc1cc(co1)Br 55d29b640a5ceff693ac90c3827803ec [0,1,0,0,0,1|1,1,0]=4 889 B12R1.105 C=C(C)COCc1ccc(o1)Br c75cbbc72caaff6770e0d19d7603a446 [0,1,0,0,0,1|1,1,0]=4 890 B12R1.105 C=C(C)COCc1ccc(o1)C d99220cdb23452c250353ce3fe08d9bc [0,1,0,0,0,1|1,1,0]=4 891 B12R1.105 CC(=CCNc1cc(co1)C)C 5c444ae27019885531eafcc2a2988e40 [0,1,0,0,0,1|2,0,0]=4 892 B12R1.105 CC(=CCNc1ccc(o1)C)C 4f3bbd1dd31f5dd38f11fa4a07186890 [0,1,0,0,0,1|2,0,0]=4 893 B12R1.105 CC(=O)CCNc1cc(=O)[nH]o1 69976d32a1f30649de931a70b7dab740 [0,1,0,0,0,1|2,0,0]=4 894 B12R1.105 CC(=O)CCNc1cc(no1)C b1f70d928f4e03de35f2ae89dbd27e8b [0,1,0,0,0,1|2,0,0]=4 895 B12R1.105 CC(=O)CCNc1ccc(s1)Br f93c60d519130dd8a4285bcbc2e70e50 [0,1,0,0,0,1|1,1,0]=4 896 B12R1.105 CC(=O)CCNc1ccc(s1)C 46c4b7c31332949ee35b4535108f6ef7 [0,1,0,0,0,1|1,1,0]=4 897 B12R1.105 CC(=O)CCNc1cnc(o1)C ac13ad6058792727f3a7d2310f61b4fd [0,1,0,0,0,1|2,0,0]=4 898 B12R1.105 CC(=O)CCNc1nc(co1)Br 237d24fabd0137e1aabd16c28d2debe3 [0,1,0,0,0,1|2,0,0]=4 899 B12R1.105 CC(=O)CCNc1nc(co1)C 36a01da57362e5274163373c6e895314 [0,1,0,0,0,1|2,0,0]=4 900 B12R1.105 CC(=O)CCNc1ncc(o1)C cb0606317e516920f53ba3b34cd048ab [0,1,0,0,0,1|2,0,0]=4 901 B12R1.105 CC(=O)CCOC1C=CC(=O)O1 e1e1d4dd7b2b7295e69025213392509b [0,1,0,0,0,1|1,0,1]=4 902 B12R1.105 CC(=O)CCOc1cc(cs1)C bfba57169091ae5ce7e7d152aada4bec [0,1,0,0,0,1|1,1,0]=4 903 B12R1.105 CC(=O)CCOc1ccc(s1)Br 2269c1bec652aa7806dc09c200fc77e5 [0,1,0,0,0,1|1,1,0]=4 904 B12R1.105 CC(=O)CNCc1cc(cs1)Br 3cdb97e37533203d2f196d3099edd228 [0,1,0,0,0,1|1,1,0]=4 905 B12R1.105 CC(=O)CNCc1cc(no1)Br 2723e8503c7889fd8c8d13c5593eac72 [0,1,0,0,0,1|2,0,0]=4 906 B12R1.105 CC(=O)CNCc1cc(no1)C 48106fd824a172911a8b1b001823549a [0,1,0,0,0,1|2,0,0]=4 907 B12R1.105 CC(=O)CNCc1ccc(s1)Br c2ff2e73d7b4003823bfc1fe8efa5791 [0,1,0,0,0,1|1,1,0]=4 908 B12R1.105 CC(=O)CNCc1ccc(s1)Cl d25ce649a2f579ccba0983ecb1bb6a53 [0,1,0,0,0,1|1,1,0]=4 909 B12R1.105 CC(=O)CNCc1cnc(o1)C 5ea66ee1bfa294f5db21664ef7b49a35 [0,1,0,0,0,1|2,0,0]=4 910 B12R1.105 CC(=O)CNCc1coc(=O)o1 5febe13b76758dee1c70f652e4881c1d [0,1,0,0,0,1|2,0,0]=4 911 B12R1.105 CC(=O)CNCc1ncc(o1)Br 6150483ec3e60f2fadc9ec33ed49d9da [0,1,0,0,0,1|2,0,0]=4 912 B12R1.105 CC(=O)CNCc1ncc(o1)C 5438898b77745572fc253656b2c6ef1c [0,1,0,0,0,1|2,0,0]=4 913 B12R1.105 CC(=O)COCc1cc(cs1)Br 836e0d65824447f4d1745656309b5e2c [0,1,0,0,0,1|0,2,0]=4 914 B12R1.105 CC(=O)COCc1cc(no1)Br 9ab8696884e456eb652299d294734e1d [0,1,0,0,0,1|1,1,0]=4 915 B12R1.105 CC(=O)COCc1cc(no1)C 2c62f6f1421e6e9daa61efd0fb5a9991 [0,1,0,0,0,1|1,1,0]=4 916 B12R1.105 CC(=O)COCc1ccc(s1)Br 66827622e588e329c0ccda14d329a5a6 [0,1,0,0,0,1|0,2,0]=4 917 B12R1.105 CC(=O)COCc1ccc(s1)Cl 3d83c1160d3f887a8001ea3ec24dac92 [0,1,0,0,0,1|0,2,0]=4 918 B12R1.105 CC(=O)COCc1coc(=O)o1 edc9a3cfea5ea6c085f6da5928a0c7e4 [0,1,0,0,0,1|1,1,0]=4 919 B12R1.105 CC(=O)COCc1ncc(o1)Br 3955c91997702cdb1e42fc650dea0881 [0,1,0,0,0,1|1,1,0]=4 920 B12R1.105 CC(=O)COCc1ncc(o1)C 28ee0e758f50ab44187f4fae4982f0b7 [0,1,0,0,0,1|1,1,0]=4 921 B12R1.105 CC(=O)NCCc1ccc(o1)C 4144320537f66e193f4d4afa8ee729d8 [0,1,0,0,0,1|1,0,0]=3 922 B12R1.105 CC(=O)NCCc1ccc(s1)Br a0b2b99f536ee6e2b9d90a6a9b83004c [0,1,0,0,0,1|1,1,0]=4 923 B12R1.105 CC(=O)NCCc1ccc(s1)C c9e2ebb4e9c51f1e96468b2a4fdce03b [0,1,0,0,0,1|1,1,0]=4 924 B12R1.105 CC(=O)NCCc1ncc(o1)C 4d6a2e6fcd496d7e64bc793507caac8a [0,1,0,0,0,1|2,0,0]=4 925 B12R1.105 CC(=O)OCNc1cc(=O)[nH]o1 cf9a643f327b505c973076c5807ecce5 [0,1,0,0,0,1|1,1,0]=4 926 B12R1.105 CC(=O)OCNc1cc(no1)C 42a878ade0477bd262c127e99021998b [0,1,0,0,0,1|1,1,0]=4 927 B12R1.105 CC(=O)OCNc1ccc(s1)Br 1ae8ed11d4cc752ef8b725638e378706 [0,1,0,0,0,1|0,2,0]=4 928 B12R1.105 CC(=O)OCNc1ccc(s1)C eed6a0006883d8e6306c8af5be01554f [0,1,0,0,0,1|0,2,0]=4 929 B12R1.105 CC(=O)OCNc1cnc(o1)C d8674a1a0b895f5d1035d03a33cb797e [0,1,0,0,0,1|1,1,0]=4 930 B12R1.105 CC(=O)OCNc1nc(co1)Br a6f00a105cc6cc2938ecda5659dbbae1 [0,1,0,0,0,1|1,1,0]=4 931 B12R1.105 CC(=O)OCNc1nc(co1)C 3fda9a65b339624173a5c26772400f19 [0,1,0,0,0,1|1,1,0]=4 932 B12R1.105 CC(=O)OCNc1ncc(o1)C a49c0c4f5ce40a43430da8e5f3b1c228 [0,1,0,0,0,1|1,1,0]=4 933 B12R1.105 CC(=O)OCOC1C=CC(=O)O1 4b22de127593f33763b68d3f080ff999 [0,1,0,0,0,1|0,1,1]=4 934 B12R1.105 CC(=O)OCOc1cc(cs1)C 067fad245c06b150093e892edfabecee [0,1,0,0,0,1|0,2,0]=4 935 B12R1.105 CC(=O)OCOc1ccc(s1)Br 46faa14757fc9ef0149a7a0be7a4fd68 [0,1,0,0,0,1|0,2,0]=4 936 B12R1.105 Cc1cc(on1)NCSC(=O)N f76a763ba8acecb369b7e8927ca15c7a [0,1,0,0,0,1|2,0,0]=4 937 B12R1.105 Cc1ccc(o1)CNCC(=O)N 6a580427de969a21f90298b37a767a99 [0,1,0,0,0,1|2,0,0]=4 938 B12R1.105 Cc1ccc(o1)CNCC(=O)O a8309b50dabd01a06985c91452f319e8 [0,1,0,0,0,1|2,0,0]=4 939 B12R1.105 Cc1ccc(o1)COCC(=O)N 5500f24f29388a93b8c765190ebdb4fd [0,1,0,0,0,1|1,1,0]=4 940 B12R1.105 Cc1ccc(o1)COCC(=O)O 691f5f2b1306a7838c51ce93440209d8 [0,1,0,0,0,1|1,1,0]=4 941 B12R1.105 Cc1ccc(o1)NCCC(=O)N efaa9ea032a2a1188a5311350852fd14 [0,1,0,0,0,1|2,0,0]=4 942 B12R1.105 Cc1ccc(o1)NCCC(=O)O 76eb15bd41e6481f3ec09a45ac5cef75 [0,1,0,0,0,1|2,0,0]=4 943 B12R1.105 Cc1ccc(o1)NCCS(=O)C 474b587f4ad6d193182e604e495bea4d [0,1,0,0,0,1|2,0,0]=4 944 B12R1.105 Cc1ccc(s1)NCSC(=O)N 4af0202089504cff5eb21452aecda65c [0,1,0,0,0,1|1,1,0]=4 945 B12R1.105 Cc1cnc(o1)NCSC(=O)N 12c3c9679d9850db25e90fce357d4f9a [0,1,0,0,0,1|2,0,0]=4 946 B12R1.105 Cc1coc(c1)CNCC(=O)N 476bc05b69a2df8f69fb14ec2a517733 [0,1,0,0,0,1|2,0,0]=4 947 B12R1.105 Cc1coc(c1)CNCC(=O)O e0bd6c70eed7f2ded747dc702a365699 [0,1,0,0,0,1|2,0,0]=4 948 B12R1.105 Cc1coc(c1)NCCS(=O)C 1d3e86ae495c4dffd28f73f3c79cc0ed [0,1,0,0,0,1|2,0,0]=4 949 B12R1.105 Cc1coc(n1)NCSC(=O)N a15ea53dce4b88f071e7f02952c1c134 [0,1,0,0,0,1|2,0,0]=4 950 B12R1.105 Cc1csc(c1)OCSC(=O)N d3bda036fe9450752540cd88f0d2c4ab [0,1,0,0,0,1|1,1,0]=4 951 B12R1.105 Cc1ncc(o1)NCSC(=O)N bad19b0f38644d92ad0142c6431e9991 [0,1,0,0,0,1|2,0,0]=4 952 B12R1.105 NC(=O)CNCc1ccc(o1)Br 8a2a1b21b4b05491e9a01b379b3b7c72 [0,1,0,0,0,1|2,0,0]=4 953 B12R1.105 NC(=O)COCc1cc(co1)Br a70f54d46072af558da365e2cf407eff [0,1,0,0,0,1|1,1,0]=4 954 B12R1.105 NC(=O)COCc1ccc(o1)Br 93b6f6fbd51df7e5556d414ef994e6b0 [0,1,0,0,0,1|1,1,0]=4 955 B12R1.105 NC(=O)SCNc1cc(=O)[nH]o1 d5fc1a72db60e92fc76d2253e57d3399 [0,1,0,0,0,1|2,0,0]=4 956 B12R1.105 NC(=O)SCNc1ccc(s1)Br 548e9ed0b6e4cc3ea1cf98c22ccc04c0 [0,1,0,0,0,1|1,1,0]=4 957 B12R1.105 NC(=O)SCNc1nc(co1)Br b1b5c3fd69deeb370988f89eccfb408c [0,1,0,0,0,1|2,0,0]=4 958 B12R1.105 NC(=O)SCOC1C=CC(=O)O1 98454eb69e68e993880d71debd598602 [0,1,0,0,0,1|1,0,1]=4 959 B12R1.105 NC(=O)SCOc1ccc(s1)Br b7382cfd71120a52d8aef89cab4a808d [0,1,0,0,0,1|1,1,0]=4 960 B12R1.105 O=C(O)CNCc1ccc(o1)Br 0d8bb09d4af65736a5df9bc92e287b52 [0,1,0,0,0,1|2,0,0]=4 961 B12R1.105 O=C(O)COCc1cc(co1)Br 40a8290dce5ba404210a85fdd1d0911d [0,1,0,0,0,1|1,1,0]=4 962 B12R1.105 O=C(O)COCc1ccc(o1)Br f759ad5bf240d9d3ebb5490fd5e6983d [0,1,0,0,0,1|1,1,0]=4 963 B12R1.130 C=C(C)CNCc1occc1C 007152b13b75e639c2ebf57c99076168 [0,1,0,0,0,1|2,0,0]=4 964 B12R1.130 C=C(C)COCc1occc1Br 56560d960e7bb5a0d9686ebdc5b5f93b [0,1,0,0,0,1|1,1,0]=4 965 B12R1.130 C=C(C)COCc1occc1C c4ab2c460de51090852137b9cd769a1a [0,1,0,0,0,1|1,1,0]=4 966 B12R1.130 CC(=O)CCNc1oncc1C 17406e873093d338c18f2af27310d0b1 [0,1,0,0,0,1|2,0,0]=4 967 B12R1.130 CC(=O)CCOc1cccn1C c6ed782981032c501d1a58e382064055 [0,1,0,0,0,1|2,0,0]=4 968 B12R1.130 CC(=O)NCCc1cccn1C 228840714ab5d74414a22726164b559c [0,1,0,0,0,1|2,0,0]=4 969 B12R1.130 CC(=O)NCCc1sccc1C 54d2325cc7c28ca90bd4f8f05c8ba280 [0,1,0,0,0,1|1,1,0]=4 970 B12R1.130 CC(=O)OCNc1oncc1C bca7723d17c61ccb5c15a0e6eacbe314 [0,1,0,0,0,1|1,1,0]=4 971 B12R1.130 CC(=O)OCOc1cccn1C b778dc17452aa1d5f47e4e1329ab7670 [0,1,0,0,0,1|1,1,0]=4 972 B12R1.130 Cc1ccoc1CNCC(=O)N a495dfd1656e51150ce2c2a7aa82fccf [0,1,0,0,0,1|2,0,0]=4 973 B12R1.130 Cc1ccoc1CNCC(=O)O 3ed0dedb8bf9d1915527eccacc205494 [0,1,0,0,0,1|2,0,0]=4 974 B12R1.130 Cc1ccoc1COCC(=O)N 20ea08f0db706444b26b39846e46d1b1 [0,1,0,0,0,1|1,1,0]=4 975 B12R1.130 Cc1ccoc1COCC(=O)O b2e6b759ffaae3726b10514cb115700c [0,1,0,0,0,1|1,1,0]=4 976 B12R1.130 Cc1cnoc1NCSC(=O)N c1bba727b5ac81ae4934ff42bcf1efd4 [0,1,0,0,0,1|2,0,0]=4 977 B12R1.130 Cn1cccc1OCSC(=O)N 09a33eaaff299f573ef6e3379031554a [0,1,0,0,0,1|2,0,0]=4 978 B12R1.130 NC(=O)COCc1occc1Br e4035cb41954e0c09176b30134664c46 [0,1,0,0,0,1|1,1,0]=4 979 B12R1.130 O=C(O)COCc1occc1Br dad39375a0889930933a50a5c8d371c7 [0,1,0,0,0,1|1,1,0]=4 980 B12R1.260 C=C(C)CN(C)Cc1ccco1 79a1ace72ff7879138e9244db56f276a [0,1,0,0,0,1|2,0,0]=4 981 B12R1.260 CC(=O)NC(C)Cc1ccco1 6cb720845f829a0cf0aeb92e5ca9c2a4 [0,1,0,0,0,1|1,0,0]=3 982 B12R1.260 CC(=O)OC(C)Nc1ccno1 5e4c9a2102c5451efe87baefa99089f2 [0,1,0,0,0,1|1,1,0]=4 983 B12R1.260 CC(=O)OC(C)Nc1ncco1 fa6018de7b9d77d4177b53a4a44daa66 [0,1,0,0,0,1|1,1,0]=4 984 B12R1.260 CC(=O)OC(C)Oc1ccco1 07baab0a0b9e646211d1cabdfe3102a5 [0,1,0,0,0,1|0,1,0]=3 985 B12R1.260 CN(CC(=O)N)Cc1ccco1 80bdecd1903c0982366e396a6dfba2e2 [0,1,0,0,0,1|2,0,0]=4 986 B12R1.260 CN(CC(=O)O)Cc1ccco1 1c964894c2f7db8f3f04c51d8682d0ae [0,1,0,0,0,1|2,0,0]=4 987 B12R1.264 C=C(C)C(=O)NCc1ccco1 05adb93a8819c7dc5bee48272e51a8a8 [0,1,0,0,0,1|2,0,0]=4 988 B12R1.264 C=C(COc1ccco1)C(=O)O 5df9988d02b09d6b01aec7fd8c6fa47f [0,1,0,0,0,1|2,0,0]=4 989 B12R1.264 CC(=O)C(=O)CNc1cccs1 ff0f90fd198bafd333a5eea64769aca2 [0,1,0,0,0,1|1,1,0]=4 990 B12R1.264 CC(=O)C(=O)CNc1ccno1 15ed07136cf30ea484b20685c182e8e4 [0,1,0,0,0,1|2,0,0]=4 991 B12R1.264 CC(=O)C(=O)CNc1ncco1 4a4a14bb6ef90944201e68f3896410ae [0,1,0,0,0,1|2,0,0]=4 992 B12R1.264 CC(=O)C(=O)COc1ccco1 33ddb1d05fe1ee198a420a72025dc11c [0,1,0,0,0,1|1,0,0]=3 993 B12R1.264 CC(=O)C(=O)COc1cccs1 b913076a77c7924647f4714a1e2872f9 [0,1,0,0,0,1|1,1,0]=4 994 B12R1.264 CC(=O)C(=O)NCc1ccco1 1463993c0a66e22ea8a7320ed0182526 [0,1,0,0,0,1|1,0,0]=3 995 B12R1.264 CC(=O)C(=O)NCc1cccs1 7deb0aae3425bb8ad0c2acf73da110aa [0,1,0,0,0,1|1,1,0]=4 996 B12R1.264 CC(=O)C(=O)NCc1ccno1 de45376588588f1f0244ee2777c2e778 [0,1,0,0,0,1|2,0,0]=4 997 B12R1.264 CC(=O)C(=O)NCc1cnco1 d1f0929bd411414c2ec2f6546005b522 [0,1,0,0,0,1|2,0,0]=4 998 B12R1.264 CC(=O)C(=O)NCc1ncco1 7aa8240e6efa6560fc563a90a9955a1d [0,1,0,0,0,1|2,0,0]=4 999 B12R1.264 CC(=O)C(C)NCc1ccc[nH]1 04e286644e5ad94107f6c808e59f682e [0,1,0,0,0,1|2,0,0]=4 1000 B12R1.264 CC(=O)C(C)NCc1ccco1 5ed04d239b29383a4a242eb75c9af02f [0,1,0,0,0,1|1,0,0]=3 1001 B12R1.264 CC(=O)C(C)NCc1cccs1 5cea9573895ebd6dfff1939e098d02cc [0,1,0,0,0,1|1,1,0]=4 1002 B12R1.264 CC(=O)C(C)NCc1ccno1 ea2311890f31e391ac8a8d45d392c13a [0,1,0,0,0,1|2,0,0]=4 1003 B12R1.264 CC(=O)C(C)NCc1cnco1 40110984eab50ee89cd54d845ef87f71 [0,1,0,0,0,1|2,0,0]=4 1004 B12R1.264 CC(=O)C(C)NCc1ncco1 8e59de5915a82dd40a5f9d85aaeb8e1d [0,1,0,0,0,1|2,0,0]=4 1005 B12R1.264 CC(=O)C(C)OCc1ccc[nH]1 ac54616b1c56e5017ec53f0ab4212789 [0,1,0,0,0,1|1,1,0]=4 1006 B12R1.264 CC(=O)C(C)OCc1ccco1 7fb5e58e2645fb3557688b0c531807e1 [0,1,0,0,0,1|0,1,0]=3 1007 B12R1.264 CC(=O)C(C)OCc1cccs1 69836dc3ab3238b1f7ec607a30dd354d [0,1,0,0,0,1|0,2,0]=4 1008 B12R1.264 CC(=O)C(C)OCc1ccno1 de2131e2f2d1e681e4a1760e3bb3652a [0,1,0,0,0,1|1,1,0]=4 1009 B12R1.264 CC(=O)C(C)OCc1cnco1 cd826e632dc3b86c8ec243ae6c7ee8b5 [0,1,0,0,0,1|1,1,0]=4 1010 B12R1.264 CC(=O)C(C)OCc1ncco1 ca0ef4a1c67462d25304f29026149178 [0,1,0,0,0,1|1,1,0]=4 1011 B12R1.264 CC(=O)N(C)CCc1cccs1 1c9999f099c6a54703cd1e3489f23412 [0,1,0,0,0,1|1,1,0]=4 1012 B12R1.264 CC(COc1ccco1)C(=O)O 7a6f8d7051a7cf005c1a3a5df32a97dd [0,1,0,0,0,1|2,0,0]=4 1013 B12R1.264 CC(NCc1ccco1)C(=O)N 780c6fc89b682816abd42b3a51b01084 [0,1,0,0,0,1|2,0,0]=4 1014 B12R1.264 CC(NCc1ccco1)C(=O)O c319a516f0551dc43f8198cb596ab8e1 [0,1,0,0,0,1|2,0,0]=4 1015 B12R1.264 CC(OCc1ccco1)C(=O)N d42030bb0e4fcb73e85f7635f898ac64 [0,1,0,0,0,1|1,1,0]=4 1016 B12R1.264 CC(OCc1ccco1)C(=O)O ea0ec8b3d4418b5b853084248ac11705 [0,1,0,0,0,1|1,1,0]=4 1017 B12R1.264 C[C@@H](NCc1ccco1)C(=O)N f31462ea869ecea4a97a3a9b9af82e53 [0,1,0,0,0,1|2,0,0]=4 1018 B12R1.264 C[C@@H](NCc1ccco1)C(=O)O f66e8200ab7ca65408eb4032ac3c04cb [0,1,0,0,0,1|2,0,0]=4 1019 B12R1.264 C[C@@H](OCc1ccco1)C(=O)N 9ab2a50f4d3d08f50c8be7dc0f190450 [0,1,0,0,0,1|1,1,0]=4 1020 B12R1.264 C[C@@H](OCc1ccco1)C(=O)O 24b40db53c5ba5cfac18e494ea2c2556 [0,1,0,0,0,1|1,1,0]=4 1021 B12R1.264 C[C@H](NCc1ccco1)C(=O)N 12476a04f3182a83562d49d4ce7d224e [0,1,0,0,0,1|2,0,0]=4 1022 B12R1.264 C[C@H](NCc1ccco1)C(=O)O dc75f5c529d6c10465091ee0f469007c [0,1,0,0,0,1|2,0,0]=4 1023 B12R1.264 C[C@H](OCc1ccco1)C(=O)N 897bdfb15a03ccf3e596ced9769a900b [0,1,0,0,0,1|1,1,0]=4 1024 B12R1.264 C[C@H](OCc1ccco1)C(=O)O 0dbd1fbe414c5b9823f07ff9348cbb8b [0,1,0,0,0,1|1,1,0]=4 1025 B12R1.264 NC(=O)C(=O)NCc1ccco1 e2d6cbd561399aa9c39b7348c0e803f1 [0,1,0,0,0,1|2,0,0]=4 1026 B12R1.264 NC(=O)C(F)NCc1ccco1 b0a315aeb8861426ad6185832cd5d3dd [0,1,0,0,0,1|2,0,0]=4 1027 B12R1.264 O=C(O)C(F)CNc1ccco1 47f66d077227cecf64f14590791c092c [0,1,0,0,0,1|2,0,0]=4 1028 B12R1.264 O=C(O)C(O)CNc1ccco1 3adfee59226b548cd1bd91b5c4bcbcc2 [0,1,0,0,0,1|2,0,0]=4 1029 B12R1.264 O=C(O)C(O)NCc1ccco1 6207fbed09c8a679c1ea59efc3aa193b [0,1,0,0,0,1|2,0,0]=4 1030 B12R1.264 O=C(O)[C@@H](O)CNc1ccco1 9bc05dfbd9966ded5aca3d805afae0e3 [0,1,0,0,0,1|2,0,0]=4 1031 B12R1.264 O=C(O)[C@H](O)CNc1ccco1 8a3558ba898061a1b897176e7f21ec6b [0,1,0,0,0,1|2,0,0]=4 1032 B12R1.477 C#CC(=O)NCCc1ccco1 acc3fec118e663ac0cbb0160e81e745a [0,1,0,0,0,1|1,0,1]=4 1033 B12R1.477 C/C(=C\I)/COCc1ccco1 9fd1638ac5dfd2596a95058cbc9ae119 [0,1,0,0,0,1|1,1,0]=4 1034 B12R1.477 C=C(CC)CNCc1ccco1 de7480fb5a36c60e5b464ab1d38fd0a4 [0,1,0,0,0,1|2,0,0]=4 1035 B12R1.477 C=C(CNCc1ccco1)OC 72aaf78a67edea843054720f701edb45 [0,1,0,0,0,1|2,0,0]=4 1036 B12R1.477 C=C(CO)CNCc1ccco1 0f48fe7aa0214764fed85a48f78036ec [0,1,0,0,0,1|2,0,0]=4 1037 B12R1.477 C=C(COCc1ccco1)OC f0864796c8651abe752612368fd6077d [0,1,0,0,0,1|1,1,0]=4 1038 B12R1.477 C=CC(=O)NCCc1ccco1 1ddb9046ba07351bdd94e2a85d1031a4 [0,1,0,0,0,1|1,0,1]=4 1039 B12R1.477 CC(=CI)COCc1ccco1 6007dfd12993e01ca90ded39882d101d [0,1,0,0,0,1|1,1,0]=4 1040 B12R1.477 CC(C=O)NCCc1ccco1 74c805978d89fb335630f3e0efc6cf33 [0,1,0,0,0,1|1,0,1]=4 1041 B12R1.477 CC(C=O)OCCc1ccco1 ab33596ad02716f50eb32de5fbdc10c2 [0,1,0,0,0,1|0,1,1]=4 1042 B12R1.477 CCC(=O)CNCc1ccc[nH]1 3221180a38e4641c93c4543465d8adb3 [0,1,0,0,0,1|2,0,0]=4 1043 B12R1.477 CCC(=O)CNCc1ccco1 332fbee55619f533c08ae7d9332b6766 [0,1,0,0,0,1|1,0,0]=3 1044 B12R1.477 CCC(=O)CNCc1cccs1 fa9708472910a71ebed18db35c96e0d0 [0,1,0,0,0,1|1,1,0]=4 1045 B12R1.477 CCC(=O)CNCc1ccno1 c4807466287af395d38854d8a45bbeaa [0,1,0,0,0,1|2,0,0]=4 1046 B12R1.477 CCC(=O)CNCc1cnco1 f385aa9da5420e4c5edaecbb8175d8e5 [0,1,0,0,0,1|2,0,0]=4 1047 B12R1.477 CCC(=O)CNCc1ncco1 7fbd5fddbf93d91e151027347fcc8a00 [0,1,0,0,0,1|2,0,0]=4 1048 B12R1.477 CCC(=O)COCc1ccc[nH]1 f686d906313a26ba2c68978346cdd9ad [0,1,0,0,0,1|1,1,0]=4 1049 B12R1.477 CCC(=O)COCc1ccco1 68361409d1dbfb6e8674ce6dc25f290a [0,1,0,0,0,1|0,1,0]=3 1050 B12R1.477 CCC(=O)COCc1cccs1 18e63268f947d8a64791e46423b910f1 [0,1,0,0,0,1|0,2,0]=4 1051 B12R1.477 CCC(=O)COCc1ccno1 b8d73e0e804615a94e2ddcad684225c6 [0,1,0,0,0,1|1,1,0]=4 1052 B12R1.477 CCC(=O)COCc1cnco1 6b01a7cdd6a98e45ee18574e35d7232e [0,1,0,0,0,1|1,1,0]=4 1053 B12R1.477 CCC(=O)COCc1ncco1 ceeb0bcef2509aeffa2c9022fbf77e97 [0,1,0,0,0,1|1,1,0]=4 1054 B12R1.477 CCC(=O)NCCc1ccco1 a57a3f81596031473f72e71516ffc990 [0,1,0,0,0,1|1,0,0]=3 1055 B12R1.477 CCC(=O)NCCc1cccs1 fc6c794fcf581c196e6509dcd1a8b636 [0,1,0,0,0,1|1,1,0]=4 1056 B12R1.477 CCC(=O)OCOc1ccco1 3def9ac8a660063bb39db21da77cdd03 [0,1,0,0,0,1|0,1,0]=3 1057 B12R1.477 CCC(=O)OCOc1cccs1 3448581a546aebfa49a4e73797b52cea [0,1,0,0,0,1|0,2,0]=4 1058 B12R1.477 CCS(=O)CCOc1ccco1 e2a948ec5b367d785bf7bb0c11376c57 [0,1,0,0,0,1|2,0,0]=4 1059 B12R1.477 CN(C=O)CCCc1ccco1 72656ee95f6fa4e99768c1cc908e7579 [0,1,0,0,0,1|2,0,0]=4 1060 B12R1.477 CNC(=O)CCNc1ccco1 33b427b60e829153a014a8f41d150ecc [0,1,0,0,0,1|1,0,0]=3 1061 B12R1.477 CNC(=O)CCNc1cccs1 262d9e3c87740f9b1c53d09115bff5ae [0,1,0,0,0,1|1,1,0]=4 1062 B12R1.477 CNC(=O)CCNc1ccno1 785ec75d16933a820b96c2b3db8c6c8f [0,1,0,0,0,1|2,0,0]=4 1063 B12R1.477 CNC(=O)CCNc1ncco1 926e9a1072cfbccefb9c700f982ec8da [0,1,0,0,0,1|2,0,0]=4 1064 B12R1.477 CNC(=O)CCOc1ccco1 2c1c050d84fb3852f37d6f344af2148c [0,1,0,0,0,1|1,0,0]=3 1065 B12R1.477 CNC(=O)CCOc1cccs1 0d55e337d2d7cad9b4bea17161db3bc6 [0,1,0,0,0,1|1,1,0]=4 1066 B12R1.477 CNC(=O)CNCc1ccc[nH]1 350e4256c2204893423e536c7844436f [0,1,0,0,0,1|2,0,0]=4 1067 B12R1.477 CNC(=O)CNCc1ccco1 5568df0d9e2d743ce8d86888b1cb214e [0,1,0,0,0,1|1,0,0]=3 1068 B12R1.477 CNC(=O)CNCc1cccs1 00b6f444a892a191ed45d5b131bf6d54 [0,1,0,0,0,1|1,1,0]=4 1069 B12R1.477 CNC(=O)CNCc1ccno1 7721faf0dd5b98dfcacb8e5ed01a1530 [0,1,0,0,0,1|2,0,0]=4 1070 B12R1.477 CNC(=O)CNCc1cnco1 71b5e7aefbc81058ca8d016ea18a3425 [0,1,0,0,0,1|2,0,0]=4 1071 B12R1.477 CNC(=O)CNCc1ncco1 04ce5fc05a6c74a3f8913dc0e28fd800 [0,1,0,0,0,1|2,0,0]=4 1072 B12R1.477 CNC(=O)COCc1ccc[nH]1 0f9329286fb3906a729f960648927b21 [0,1,0,0,0,1|1,1,0]=4 1073 B12R1.477 CNC(=O)COCc1ccco1 998e2f835daa6cd19c743c5b2dcaedfa [0,1,0,0,0,1|0,1,0]=3 1074 B12R1.477 CNC(=O)COCc1cccs1 47b2c280ca95ad9474be02d63bfeaec9 [0,1,0,0,0,1|0,2,0]=4 1075 B12R1.477 CNC(=O)COCc1ccno1 e9aa6abb0b2f437b17ef5a85e36d9b1a [0,1,0,0,0,1|1,1,0]=4 1076 B12R1.477 CNC(=O)COCc1cnco1 d650dba91ddce4a36c8ddfd787d2f102 [0,1,0,0,0,1|1,1,0]=4 1077 B12R1.477 CNC(=O)COCc1ncco1 3953e62f9550c582bc13bd0917a8d94e [0,1,0,0,0,1|1,1,0]=4 1078 B12R1.477 COC(=O)CCNc1ccco1 e0e8335b06d744a1b449a668f80683a2 [0,1,0,0,0,1|1,0,0]=3 1079 B12R1.477 COC(=O)CCNc1cccs1 aaa9cfd402dcc2f0870ffeb2e27cdb33 [0,1,0,0,0,1|1,1,0]=4 1080 B12R1.477 COC(=O)CCNc1ccno1 188b6557cbaf8cbb63bae3f5c0567ced [0,1,0,0,0,1|2,0,0]=4 1081 B12R1.477 COC(=O)CCNc1ncco1 564c4aa0fd0cd06a056f7a55919daa93 [0,1,0,0,0,1|2,0,0]=4 1082 B12R1.477 COC(=O)CCOc1ccco1 649aeb6738bc8c896167b5648b168d5d [0,1,0,0,0,1|1,0,0]=3 1083 B12R1.477 COC(=O)CCOc1cccs1 664ac22ce41f5e45b386b1395c7eb518 [0,1,0,0,0,1|1,1,0]=4 1084 B12R1.477 COC(=O)CNCc1ccc[nH]1 dd41e28ea929e66af9ea0d101dfdd982 [0,1,0,0,0,1|2,0,0]=4 1085 B12R1.477 COC(=O)CNCc1ccco1 2bf3ed1f5d44112ec1c684ec23a4918a [0,1,0,0,0,1|1,0,0]=3 1086 B12R1.477 COC(=O)CNCc1cccs1 01bbb1df4d37a3c8e183d57b1b059ae1 [0,1,0,0,0,1|1,1,0]=4 1087 B12R1.477 COC(=O)CNCc1ccno1 d135e19f93bf30312aef35200b55d1ed [0,1,0,0,0,1|2,0,0]=4 1088 B12R1.477 COC(=O)CNCc1cnco1 3598916c9b260aca5fb271b9e1fecb11 [0,1,0,0,0,1|2,0,0]=4 1089 B12R1.477 COC(=O)CNCc1ncco1 e333a4656cc09e339d1b06f389312f40 [0,1,0,0,0,1|2,0,0]=4 1090 B12R1.477 COC(=O)COCc1ccc[nH]1 17206b59383caa5cb2a5dd4187c8aac8 [0,1,0,0,0,1|1,1,0]=4 1091 B12R1.477 COC(=O)COCc1ccco1 185a389c71177752b8db1093a565458c [0,1,0,0,0,1|0,1,0]=3 1092 B12R1.477 COC(=O)COCc1cccs1 7313aa22ef222247eb9faa1630bead64 [0,1,0,0,0,1|0,2,0]=4 1093 B12R1.477 COC(=O)COCc1ccno1 15498348e4f5f35b9515226d0a984211 [0,1,0,0,0,1|1,1,0]=4 1094 B12R1.477 COC(=O)COCc1cnco1 d779b1e02ac688be5f32e8f00648ff46 [0,1,0,0,0,1|1,1,0]=4 1095 B12R1.477 COC(=O)COCc1ncco1 b6480ba64dd750e1a310cd3c5bba6eb9 [0,1,0,0,0,1|1,1,0]=4 1096 B12R1.477 COC(=O)OCOc1ccco1 4d7165c5ec76885d8ea5fd3ff931bb7c [0,1,0,0,0,1|0,1,0]=3 1097 B12R1.477 C[C@H](C=O)NCCc1ccco1 9a950faafafd4ac5cfe77991e35bd62b [0,1,0,0,0,1|1,0,1]=4 1098 B12R1.477 C[C@H](C=O)OCCc1ccco1 bf9fd42601f306211d69a6535e282ba0 [0,1,0,0,0,1|0,1,1]=4 1099 B12R1.477 O=C(CCNc1ccco1)NO 43b578ed31a826b423d864d6cf1b45aa [0,1,0,0,0,1|2,0,0]=4 1100 B12R1.477 O=C(CF)NCCc1ccco1 a5468b77bbeee8125a1cf82982213246 [0,1,0,0,0,1|1,0,0]=3 1101 B12R1.477 O=C(CF)NCCc1cccs1 8ad0a550d473de8f84056b481bfae7f4 [0,1,0,0,0,1|1,1,0]=4 1102 B12R1.477 O=C(CNCc1ccco1)NO b5209eb00d5583d9ef71edc99d9eaa76 [0,1,0,0,0,1|2,0,0]=4 1103 B12R1.477 O=C(CO)CNCc1ccc[nH]1 cb70c0c9bad6f9c6747fe4d167164893 [0,1,0,0,0,1|2,0,0]=4 1104 B12R1.477 O=C(CO)CNCc1ccco1 d8cc6500cc77cfd6bde88c6313aea249 [0,1,0,0,0,1|1,0,0]=3 1105 B12R1.477 O=C(CO)CNCc1cccs1 1999440da216a8c47c747f181d5094af [0,1,0,0,0,1|1,1,0]=4 1106 B12R1.477 O=C(CO)CNCc1ccno1 d5a8bc2780b9b0bde70cf42f4f4df800 [0,1,0,0,0,1|2,0,0]=4 1107 B12R1.477 O=C(CO)CNCc1cnco1 741ec2d9167a12c96abd983c41ff05b3 [0,1,0,0,0,1|2,0,0]=4 1108 B12R1.477 O=C(CO)CNCc1ncco1 1e26cfb9808fe5d0aca2ab36336d1226 [0,1,0,0,0,1|2,0,0]=4 1109 B12R1.477 O=C(CO)NCCc1ccco1 ad96d88f7253f10830cfafa1d4f43183 [0,1,0,0,0,1|1,0,0]=3 1110 B12R1.477 O=C(CO)NCCc1cccs1 9f2e0da32d88862d93c942c60f2d338a [0,1,0,0,0,1|1,1,0]=4 1111 B12R1.477 O=C(CS)NCCc1ccco1 3467c703b66b0c74a5d31bad2d6c4232 [0,1,0,0,0,1|1,0,0]=3 1112 B12R1.477 O=C(CS)NCCc1cccs1 727fb833bd1797230419b932f1b67fc0 [0,1,0,0,0,1|1,1,0]=4 1113 B12R1.477 O=CC(=O)NCCc1ccco1 748bbf1293f222141b476fa3de2650f5 [0,1,0,0,0,1|1,0,1]=4 1114 B12R1.890 CS(=O)(=O)CCNc1ccco1 ac277dc8859ba2b36f198b835ddc7ff9 [0,1,0,0,0,1|2,0,0]=4 1115 B12R1.890 CS(=O)(=O)CCOc1ccco1 3366e14ca2a5524edf6f7b4aa99617fb [0,1,0,0,0,1|2,0,0]=4 1116 B12R1.890 CS(=O)(=O)CNCc1ccco1 ea418f95aa4f62ac4867995af52e4117 [0,1,0,0,0,1|2,0,0]=4 1117 B12R1.890 CS(=O)(=O)COCc1ccco1 6c68a39e38b6b84f0d75fc1761bf4e80 [0,1,0,0,0,1|1,1,0]=4 1118 B12R1.15 C#CC(=O)NC(C)c1ccco1 037985a6b93f5cc7f98cce9f8bfaef52 [0,2,0,0,0,0|1,0,1]=4 1119 B12R1.15 C#CC(=O)N[C@H](C)c1ccco1 2b47e6f2e8001a2f1db4674d58ecab02 [0,2,0,0,0,0|1,0,1]=4 1120 B12R1.15 C=CC(=O)NC(C)c1ccco1 d6511b6591fbf7364aea25c0308e16df [0,2,0,0,0,0|1,0,1]=4 1121 B12R1.15 C=CC(=O)N[C@H](C)c1ccco1 f2898a4e8a85eec5ebd10819eda1d95f [0,2,0,0,0,0|1,0,1]=4 1122 B12R1.15 CC(C=O)NC(C)c1ccco1 212375a979905f1f74364686ef243419 [0,2,0,0,0,0|1,0,1]=4 1123 B12R1.15 CC(C=O)N[C@H](C)c1ccco1 3e0d721793a5bb96a85a870947b03416 [0,2,0,0,0,0|1,0,1]=4 1124 B12R1.15 CC(C=O)OC(C)c1ccco1 0dfc9f8e114baec3794d27f5760a32e4 [0,2,0,0,0,0|0,1,1]=4 1125 B12R1.15 CC(C=O)O[C@H](C)c1ccco1 59c73190e977492e534a6376fd8485a0 [0,2,0,0,0,0|0,1,1]=4 1126 B12R1.15 CC(NC(=O)C=O)c1ccco1 0003e83d1ab23fa96fe0e09e9dcbf06c [0,2,0,0,0,0|1,0,1]=4 1127 B12R1.15 CC(NC(=O)CF)c1ccco1 5e633ec784282814b9f5c4e2597cc847 [0,2,0,0,0,0|1,0,0]=3 1128 B12R1.15 CC(NC(=O)CF)c1cccs1 fab18c23ec86ba9f6d6acdcdd07513b3 [0,2,0,0,0,0|1,1,0]=4 1129 B12R1.15 CC(NC(=O)CF)c1ncco1 f38fcc871f02e241109e3e980dd7326d [0,2,0,0,0,0|2,0,0]=4 1130 B12R1.15 CC(NC(=O)CO)c1ccco1 b272aaefa5de1b54c344dea91536a18c [0,2,0,0,0,0|1,0,0]=3 1131 B12R1.15 CC(NC(=O)CO)c1cccs1 129082182470a76e12c7f0519c8b1bcf [0,2,0,0,0,0|1,1,0]=4 1132 B12R1.15 CC(NC(=O)CO)c1ncco1 71171a039f0d5e0da4293abf1f239041 [0,2,0,0,0,0|2,0,0]=4 1133 B12R1.15 CC(NC(=O)CS)c1ccco1 7c057b94321345652be575f5e6b2176e [0,2,0,0,0,0|1,0,0]=3 1134 B12R1.15 CC(NC(=O)CS)c1cccs1 610b150bc8ed74c48745df62a0e7a63c [0,2,0,0,0,0|1,1,0]=4 1135 B12R1.15 CC(NC(=O)CS)c1ncco1 ad13cc37e7df2e3841f5378aa7530e70 [0,2,0,0,0,0|2,0,0]=4 1136 B12R1.15 CC(N[C@H](C)C=O)c1ccco1 d8fec9e4b94c6342120bc4f717765ad6 [0,2,0,0,0,0|1,0,1]=4 1137 B12R1.15 CC(O[C@H](C)C=O)c1ccco1 25dacb7761a149c38471eb2787fa8a9b [0,2,0,0,0,0|0,1,1]=4 1138 B12R1.15 CCC(=O)NC(C)c1ccco1 00d62021e0fd2bcc7006d596e064ba6b [0,2,0,0,0,0|1,0,0]=3 1139 B12R1.15 CCC(=O)NC(C)c1cccs1 acbf5a91884b81a7ea759b341a07e49f [0,2,0,0,0,0|1,1,0]=4 1140 B12R1.15 CCC(=O)NC(C)c1ncco1 d0fb1ff5a4156bf185d8c48000aeeb6a [0,2,0,0,0,0|2,0,0]=4 1141 B12R1.15 CCC(=O)N[C@@H](C)c1cccs1 e4f53b61c63e64d714bfd9376bd068ed [0,2,0,0,0,0|1,1,0]=4 1142 B12R1.15 CCC(=O)N[C@H](C)c1ccco1 dc83c0eb3e3d4a456d7d8dad5a07d713 [0,2,0,0,0,0|1,0,0]=3 1143 B12R1.15 CCC(=O)N[C@H](C)c1cccs1 d4dcab01b4a97dff17f0bae3b4c474f8 [0,2,0,0,0,0|1,1,0]=4 1144 B12R1.15 C[C@@H](NC(=O)C=O)c1ccco1 aab2d6bbb3bdbe40d4eff42b01e40323 [0,2,0,0,0,0|1,0,1]=4 1145 B12R1.15 C[C@@H](NC(=O)CF)c1ccco1 b4c6293c435fc4b4ffb1a509699e6474 [0,2,0,0,0,0|1,0,0]=3 1146 B12R1.15 C[C@@H](NC(=O)CF)c1cccs1 5770a592818014f4558d2a066318ff10 [0,2,0,0,0,0|1,1,0]=4 1147 B12R1.15 C[C@@H](NC(=O)CO)c1ccco1 b0705173842a282141b325a99d26a5c8 [0,2,0,0,0,0|1,0,0]=3 1148 B12R1.15 C[C@@H](NC(=O)CO)c1cccs1 40b0a56c3a707c17286db487d669e6c2 [0,2,0,0,0,0|1,1,0]=4 1149 B12R1.15 C[C@@H](NC(=O)CS)c1ccco1 e5a2a0ac4db12c038403570952bbabfe [0,2,0,0,0,0|1,0,0]=3 1150 B12R1.15 C[C@@H](NC(=O)CS)c1cccs1 cd704498f3cdb32587286c6b691d424d [0,2,0,0,0,0|1,1,0]=4 1151 B12R1.15 C[C@H](C=O)N[C@H](C)c1ccco1 c464d6c6e5e95539f24f3cfebeaa3712 [0,2,0,0,0,0|1,0,1]=4 1152 B12R1.15 C[C@H](C=O)O[C@H](C)c1ccco1 249b7f6d80a59bff48fb387e882bfe71 [0,2,0,0,0,0|0,1,1]=4 1153 B12R1.15 C[C@H](NC(=O)CF)c1cccs1 9802cf6dbf46f4c52a5e452b7cff86c5 [0,2,0,0,0,0|1,1,0]=4 1154 B12R1.15 C[C@H](NC(=O)CO)c1cccs1 bb3591181a06fa905b64da13d463993b [0,2,0,0,0,0|1,1,0]=4 1155 B12R1.15 C[C@H](NC(=O)CS)c1cccs1 f6c701a18a49c7be055361a3c8c539d5 [0,2,0,0,0,0|1,1,0]=4 1156 B12R1.26 C#CC(=O)NCc1cc(co1)C 67ea42fad3f38d2ba370060e73165976 [0,2,0,0,0,0|1,0,1]=4 1157 B12R1.26 C#CC(=O)NCc1ccc(o1)Br 5e164a38646fd0c15b42590b91933427 [0,2,0,0,0,0|1,0,1]=4 1158 B12R1.26 C#CC(=O)NCc1ccc(o1)C 71213ce748ca71b1e2dc93e62f0dad6c [0,2,0,0,0,0|1,0,1]=4 1159 B12R1.26 C=CC(=O)NCc1cc(co1)C f1294ed3307086bbf85e2ec5a34861d2 [0,2,0,0,0,0|1,0,1]=4 1160 B12R1.26 C=CC(=O)NCc1ccc(o1)Br ac5802f73f1ca2924756b8e7917b1060 [0,2,0,0,0,0|1,0,1]=4 1161 B12R1.26 C=CC(=O)NCc1ccc(o1)C 8ec807f40d676fc257138fd4cd3d02fd [0,2,0,0,0,0|1,0,1]=4 1162 B12R1.26 CC(C=O)NCc1ccc(o1)Br 34305039d554752c772dca8101ecda45 [0,2,0,0,0,0|1,0,1]=4 1163 B12R1.26 CC(C=O)OCc1cc(co1)Br 11ea0c9005066635ea442f3687288bad [0,2,0,0,0,0|0,1,1]=4 1164 B12R1.26 CC(C=O)OCc1ccc(o1)Br 3a0a6bba918fcb3e6370a10e61d04d87 [0,2,0,0,0,0|0,1,1]=4 1165 B12R1.26 CCC(=O)NCc1cc(co1)C 6b7d4036b371979527d69cf73cf04129 [0,2,0,0,0,0|1,0,0]=3 1166 B12R1.26 CCC(=O)NCc1cc(cs1)Br 4b37529e1e72d711b3eb04f8aa376baf [0,2,0,0,0,0|1,1,0]=4 1167 B12R1.26 CCC(=O)NCc1cc(cs1)C b0ba41c41d035dc2a9f10458e271ae84 [0,2,0,0,0,0|1,1,0]=4 1168 B12R1.26 CCC(=O)NCc1cc(cs1)Cl b837e29746acbb6a84b9736ed5514368 [0,2,0,0,0,0|1,1,0]=4 1169 B12R1.26 CCC(=O)NCc1cc(no1)C ec42b7702334c24419808193576ea855 [0,2,0,0,0,0|2,0,0]=4 1170 B12R1.26 CCC(=O)NCc1ccc(o1)Br 9f84fca0a2efdcd787ae3dff498ac13a [0,2,0,0,0,0|1,0,0]=3 1171 B12R1.26 CCC(=O)NCc1ccc(o1)C f9b5c830943b0d0ab523c0f7dbd93a5e [0,2,0,0,0,0|1,0,0]=3 1172 B12R1.26 CCC(=O)NCc1ccc(s1)Br 00964838866b30b81011064c10df882b [0,2,0,0,0,0|1,1,0]=4 1173 B12R1.26 CCC(=O)NCc1ccc(s1)C fa387cc0a6e5c8f74aa871d6004ab469 [0,2,0,0,0,0|1,1,0]=4 1174 B12R1.26 CCC(=O)NCc1ccc(s1)Cl 443219c1b7ba239f5653246011c7bfd5 [0,2,0,0,0,0|1,1,0]=4 1175 B12R1.26 CCC(=O)NCc1ccc(s1)F d4227032c7d2c3217b0f9f11398ac998 [0,2,0,0,0,0|1,1,0]=4 1176 B12R1.26 CCC(=O)NCc1cnc(o1)C f5380897449b211e5e1167e8fbdd23c1 [0,2,0,0,0,0|2,0,0]=4 1177 B12R1.26 CCC(=O)NCc1nc(co1)C 880cf4e1912edff72432d0ce1a7c9247 [0,2,0,0,0,0|2,0,0]=4 1178 B12R1.26 CCC(=O)NCc1ncc(o1)Br bb8920475710d18c42b5e20540ae9a9a [0,2,0,0,0,0|2,0,0]=4 1179 B12R1.26 CCC(=O)NCc1ncc(o1)C 7ee8d9bb548b7284bf9dd3083a16ba11 [0,2,0,0,0,0|2,0,0]=4 1180 B12R1.26 CNC(=O)CNc1cc(co1)C 5553b9001ca7ea1a77bd269a3b8d715f [0,2,0,0,0,0|2,0,0]=4 1181 B12R1.26 CNC(=O)CNc1ccc(o1)C 6c9b763f3067710ef72e1df79fd59006 [0,2,0,0,0,0|2,0,0]=4 1182 B12R1.26 COC(=O)CNc1ccc(o1)C 6ae35b6665e7c174f5c14feb64475c34 [0,2,0,0,0,0|2,0,0]=4 1183 B12R1.26 C[C@H](C=O)NCc1ccc(o1)Br 04d395c41f1449e2db70973b730759a9 [0,2,0,0,0,0|1,0,1]=4 1184 B12R1.26 C[C@H](C=O)OCc1cc(co1)Br f3720967399eedd132ec100b7429934a [0,2,0,0,0,0|0,1,1]=4 1185 B12R1.26 C[C@H](C=O)OCc1ccc(o1)Br 634730723f4715fe852e513a6ca7f8bc [0,2,0,0,0,0|0,1,1]=4 1186 B12R1.26 Cc1cc(on1)CNC(=O)CF 5222499f70314fc10fe89b0d3dccc362 [0,2,0,0,0,0|2,0,0]=4 1187 B12R1.26 Cc1cc(on1)CNC(=O)CO 9dbc19785e88ab1bae554cca02ee3be4 [0,2,0,0,0,0|2,0,0]=4 1188 B12R1.26 Cc1cc(on1)CNC(=O)CS 94f0d0318c2dd0545f6aa1cd40055d30 [0,2,0,0,0,0|2,0,0]=4 1189 B12R1.26 Cc1ccc(o1)CNC(=O)C=O 4789dde5c31f2880e8da2459140d9afd [0,2,0,0,0,0|1,0,1]=4 1190 B12R1.26 Cc1ccc(o1)CNC(=O)CF c12303872467df4af587d460485ed2c7 [0,2,0,0,0,0|1,0,0]=3 1191 B12R1.26 Cc1ccc(o1)CNC(=O)CO 4b89eee0b1aff397079a7ec8c117847d [0,2,0,0,0,0|1,0,0]=3 1192 B12R1.26 Cc1ccc(o1)CNC(=O)CS 934c1dac0a713255c9a547852bfb2f65 [0,2,0,0,0,0|1,0,0]=3 1193 B12R1.26 Cc1ccc(o1)CNC(C)C=O 53eaf062eee92109d13b869696dd1c55 [0,2,0,0,0,0|1,0,1]=4 1194 B12R1.26 Cc1ccc(o1)CN[C@H](C)C=O f7d2692f25e8f43d25137c3ff422c269 [0,2,0,0,0,0|1,0,1]=4 1195 B12R1.26 Cc1ccc(o1)COC(C)C=O 6632f5002752aea652e01c077cceac27 [0,2,0,0,0,0|0,1,1]=4 1196 B12R1.26 Cc1ccc(o1)CO[C@H](C)C=O 57131f8e5893f9bbfd81431901d0515d [0,2,0,0,0,0|0,1,1]=4 1197 B12R1.26 Cc1ccc(s1)CNC(=O)CF f667fe6883e172088bb39dd944aab355 [0,2,0,0,0,0|1,1,0]=4 1198 B12R1.26 Cc1ccc(s1)CNC(=O)CO 0934263177737dedd5da2a8bd3a4002d [0,2,0,0,0,0|1,1,0]=4 1199 B12R1.26 Cc1ccc(s1)CNC(=O)CS 13927ad744579d4e85fe4f162bdcb1b8 [0,2,0,0,0,0|1,1,0]=4 1200 B12R1.26 Cc1cnc(o1)CNC(=O)CF fd27ecbbd5496588903401a0915e5237 [0,2,0,0,0,0|2,0,0]=4 1201 B12R1.26 Cc1cnc(o1)CNC(=O)CO 36e67ab6a1ac6862e9172aa1fc416ca5 [0,2,0,0,0,0|2,0,0]=4 1202 B12R1.26 Cc1cnc(o1)CNC(=O)CS ceb3e8b773d42c0a527d7239bbe20765 [0,2,0,0,0,0|2,0,0]=4 1203 B12R1.26 Cc1coc(c1)CNC(=O)C=O e2c1370e503c7770da0d01da74ea78cc [0,2,0,0,0,0|1,0,1]=4 1204 B12R1.26 Cc1coc(c1)CNC(=O)CF bdf867fdd3723cfb1b578dd1458e7e0e [0,2,0,0,0,0|1,0,0]=3 1205 B12R1.26 Cc1coc(c1)CNC(=O)CO 8110a09cb5033dda8997eb4dc8edd08e [0,2,0,0,0,0|1,0,0]=3 1206 B12R1.26 Cc1coc(c1)CNC(=O)CS 03dd10a2215ff7efb44ea6b09374de40 [0,2,0,0,0,0|1,0,0]=3 1207 B12R1.26 Cc1coc(c1)CNC(C)C=O 97998c03e3534d9b61eb304fe87bc345 [0,2,0,0,0,0|1,0,1]=4 1208 B12R1.26 Cc1coc(c1)CN[C@H](C)C=O df67d77ace2ce0d10424d39c72830b95 [0,2,0,0,0,0|1,0,1]=4 1209 B12R1.26 Cc1coc(n1)CNC(=O)CF e4a2c46c7c75fdd0cf0f4f8a534225a9 [0,2,0,0,0,0|2,0,0]=4 1210 B12R1.26 Cc1coc(n1)CNC(=O)CO 73a955a33701e74aef0344c907e2a669 [0,2,0,0,0,0|2,0,0]=4 1211 B12R1.26 Cc1coc(n1)CNC(=O)CS 2128c746adae077c92fbc84adfffceb1 [0,2,0,0,0,0|2,0,0]=4 1212 B12R1.26 Cc1csc(c1)CNC(=O)CF 3ad7a3a54be3782b6aaa26f8235595a7 [0,2,0,0,0,0|1,1,0]=4 1213 B12R1.26 Cc1csc(c1)CNC(=O)CO 640e35351ed3b2e44c93c782131aeb62 [0,2,0,0,0,0|1,1,0]=4 1214 B12R1.26 Cc1csc(c1)CNC(=O)CS abc2a9dbab3e22e5945398e7881744be [0,2,0,0,0,0|1,1,0]=4 1215 B12R1.26 Cc1ncc(o1)CNC(=O)CF c402f21828f07e6f9942b819561e9447 [0,2,0,0,0,0|2,0,0]=4 1216 B12R1.26 Cc1ncc(o1)CNC(=O)CO 74452ab4437279ee8f07dd19dab19e3a [0,2,0,0,0,0|2,0,0]=4 1217 B12R1.26 Cc1ncc(o1)CNC(=O)CS 901b5e1fedd9a8466664023cc4680901 [0,2,0,0,0,0|2,0,0]=4 1218 B12R1.26 O=C(CF)NCc1cc(cs1)Cl 55dd21236b1fa866cf46392169eadfd4 [0,2,0,0,0,0|1,1,0]=4 1219 B12R1.26 O=C(CF)NCc1cc(no1)Br 34fcf6e1d7a97bdc5be2d9cb3eabb0d4 [0,2,0,0,0,0|2,0,0]=4 1220 B12R1.26 O=C(CF)NCc1ccc(o1)Br b4bb004f9fb655b67ed04b48b2db3b31 [0,2,0,0,0,0|1,0,0]=3 1221 B12R1.26 O=C(CF)NCc1ccc(s1)Br 860b566c7a181e9ce92103db9c3bcc81 [0,2,0,0,0,0|1,1,0]=4 1222 B12R1.26 O=C(CF)NCc1ccc(s1)Cl 52c78dff4eb289c8ee311e042b74950a [0,2,0,0,0,0|1,1,0]=4 1223 B12R1.26 O=C(CF)NCc1ccc(s1)F d96d853c44ce34fa747cd4c721c61502 [0,2,0,0,0,0|1,1,0]=4 1224 B12R1.26 O=C(CF)NCc1ncc(o1)Br ae79ed98f9acb8582206cb000e9bab09 [0,2,0,0,0,0|2,0,0]=4 1225 B12R1.26 O=C(CO)NCc1cc(cs1)Br 6fb16c065eb76e0c9d903c6094f41262 [0,2,0,0,0,0|1,1,0]=4 1226 B12R1.26 O=C(CO)NCc1cc(cs1)Cl bd84ce5888d9a1fc5813808225055c4f [0,2,0,0,0,0|1,1,0]=4 1227 B12R1.26 O=C(CO)NCc1ccc(o1)Br 32bab6c4ccfc349202de07bf9faaad22 [0,2,0,0,0,0|1,0,0]=3 1228 B12R1.26 O=C(CO)NCc1ccc(s1)Br e90d045b07b91e113d1f5015a4e8b587 [0,2,0,0,0,0|1,1,0]=4 1229 B12R1.26 O=C(CO)NCc1ccc(s1)Cl 78f6d5614e81b1fb27a03fe76dfc675a [0,2,0,0,0,0|1,1,0]=4 1230 B12R1.26 O=C(CO)NCc1ccc(s1)F bd2c3cf356337262325ad8b770785c91 [0,2,0,0,0,0|1,1,0]=4 1231 B12R1.26 O=C(CO)NCc1ncc(o1)Br 3f4966cc3b00a1a424a53df2bb88b8a4 [0,2,0,0,0,0|2,0,0]=4 1232 B12R1.26 O=C(CS)NCc1cc(cs1)Br b98b353b1537d0085c64117398c1066d [0,2,0,0,0,0|1,1,0]=4 1233 B12R1.26 O=C(CS)NCc1cc(cs1)Cl 5fc395ed0454f9479768ee1a3e53e4d0 [0,2,0,0,0,0|1,1,0]=4 1234 B12R1.26 O=C(CS)NCc1ccc(o1)Br 775b3c54b17beaa57925226f66d133ec [0,2,0,0,0,0|1,0,0]=3 1235 B12R1.26 O=C(CS)NCc1ccc(s1)Br 43754337a17df7a5134c8e7848dd69a6 [0,2,0,0,0,0|1,1,0]=4 1236 B12R1.26 O=C(CS)NCc1ccc(s1)Cl 5cf9efed626313337eb1a2e3e7012c01 [0,2,0,0,0,0|1,1,0]=4 1237 B12R1.26 O=C(CS)NCc1ccc(s1)F f7d9b6fb74b2ab041fc2b302b8227994 [0,2,0,0,0,0|1,1,0]=4 1238 B12R1.26 O=C(CS)NCc1ncc(o1)Br 336219cfc25967d92153e57a58945f2c [0,2,0,0,0,0|2,0,0]=4 1239 B12R1.26 O=CC(=O)NCc1ccc(o1)Br 24cfa03b10f75e569a943122f17da141 [0,2,0,0,0,0|1,0,1]=4 1240 B12R1.51 C#CCC(=O)NCc1ccco1 6ea8dc52ed1030262a633f90bb725d59 [0,2,0,0,0,0|1,0,0]=3 1241 B12R1.51 C#CCC(=O)NCc1cccs1 92c66cc2eccb6e41f24822102c9a63af [0,2,0,0,0,0|1,1,0]=4 1242 B12R1.51 C#CCC(=O)NCc1ccno1 fbe828952989d27f6bf25cee10b43f3c [0,2,0,0,0,0|2,0,0]=4 1243 B12R1.51 C#CCC(=O)NCc1cnco1 e0be0af9a03cb69d9139f34c7d5cf836 [0,2,0,0,0,0|2,0,0]=4 1244 B12R1.51 C#CCC(=O)NCc1ncco1 53dee1d32975afb40aa49ddbc2c1d67f [0,2,0,0,0,0|2,0,0]=4 1245 B12R1.51 C/C=C/C(=O)NCc1ccco1 22834d2dfbfcc74e0a7d9a0b5153a364 [0,2,0,0,0,0|1,0,0]=3 1246 B12R1.51 C/C=C/C(=O)NCc1cccs1 d11bde4d8e409eb3b914111814fd4226 [0,2,0,0,0,0|1,1,0]=4 1247 B12R1.51 C/C=C/C(=O)NCc1ccno1 20f00d391e331958ad1766f033837153 [0,2,0,0,0,0|2,0,0]=4 1248 B12R1.51 C/C=C/C(=O)NCc1cnco1 2a0f60656cd6cbf73bf8beb056f59ff2 [0,2,0,0,0,0|2,0,0]=4 1249 B12R1.51 C/C=C/C(=O)NCc1ncco1 dd2122a96fc1eb338d825840e0942f1b [0,2,0,0,0,0|2,0,0]=4 1250 B12R1.51 C=CCC(=O)NCc1ccco1 a08d669ecb490459b829365f79f527ec [0,2,0,0,0,0|1,0,0]=3 1251 B12R1.51 C=CCC(=O)NCc1cccs1 a00c80addfe150924fb68e87ef4c282a [0,2,0,0,0,0|1,1,0]=4 1252 B12R1.51 C=CCC(=O)NCc1ccno1 9c4d0f6ab4fda20f83f6fff56860a8e0 [0,2,0,0,0,0|2,0,0]=4 1253 B12R1.51 C=CCC(=O)NCc1cnco1 5d1fdc92117993e3af6f0b2eafef8f7f [0,2,0,0,0,0|2,0,0]=4 1254 B12R1.51 C=CCC(=O)NCc1ncco1 fe851f748ab0b8bb0ed7244a18c3e032 [0,2,0,0,0,0|2,0,0]=4 1255 B12R1.51 CC#CC(=O)NCc1ccco1 f874842c5e34578d5df177e8c0116d7e [0,2,0,0,0,0|1,0,0]=3 1256 B12R1.51 CC#CC(=O)NCc1cccs1 e02c72086abaf02b53c70f8b526c784e [0,2,0,0,0,0|1,1,0]=4 1257 B12R1.51 CC#CC(=O)NCc1ccno1 f7f31b34b8221b573b2a9ffb947a48c9 [0,2,0,0,0,0|2,0,0]=4 1258 B12R1.51 CC#CC(=O)NCc1cnco1 622beba475b6ce4306052f51d3f36bbc [0,2,0,0,0,0|2,0,0]=4 1259 B12R1.51 CC#CC(=O)NCc1ncco1 a9d4f3e1ada6b7b1988d6f495415a4f8 [0,2,0,0,0,0|2,0,0]=4 1260 B12R1.51 CC(CCc1ccco1)NC=O 1c82c8a0205a8482693e263e47a5852f [0,2,0,0,0,0|1,0,1]=4 1261 B12R1.51 CCCC(=O)COc1ccco1 17063ad1e4dbe751a7be7a21bba1bcd0 [0,2,0,0,0,0|2,0,0]=4 1262 B12R1.51 CCCC(=O)NCc1ccco1 ce73a3e2d6c143c7e7957ed4af9c441b [0,2,0,0,0,0|1,0,0]=3 1263 B12R1.51 CCCC(=O)NCc1cccs1 3fa9b846891b27864ac91e4223d91ff8 [0,2,0,0,0,0|1,1,0]=4 1264 B12R1.51 CCCC(=O)NCc1ccno1 bb009afb5ee5098af3de925656ab6618 [0,2,0,0,0,0|2,0,0]=4 1265 B12R1.51 CCCC(=O)NCc1cnco1 247013ccfda1e1c10b7d5ef3e5bd1005 [0,2,0,0,0,0|2,0,0]=4 1266 B12R1.51 CCCC(=O)NCc1ncco1 88d40b36d042ed543e81e4449612f1c4 [0,2,0,0,0,0|2,0,0]=4 1267 B12R1.51 CCCC(=S)OCc1ccco1 8121dc76523569851a233c8994ab0d3d [0,2,0,0,0,0|0,2,0]=4 1268 B12R1.51 CCNC(=O)CNc1ccco1 5590b2ece633c7c02a9cd4be42be8d20 [0,2,0,0,0,0|2,0,0]=4 1269 B12R1.51 CCNC(=O)COc1ccco1 aa407d45a7af23fc8b77c5341fbc5fa7 [0,2,0,0,0,0|2,0,0]=4 1270 B12R1.51 CCOC(=O)CNc1ccco1 670527ba3dc1dd36636f60cb57c041c2 [0,2,0,0,0,0|2,0,0]=4 1271 B12R1.51 CCOC(=O)COc1ccco1 d79d63bf6dfa9a495311c3938169b1d0 [0,2,0,0,0,0|2,0,0]=4 1272 B12R1.51 COCC(=O)COc1ccco1 9864eb1033730562313eca64e79023b9 [0,2,0,0,0,0|2,0,0]=4 1273 B12R1.51 COCC(=O)NCc1ccco1 d361af16eac5f104984530292107aa26 [0,2,0,0,0,0|1,0,0]=3 1274 B12R1.51 COCC(=O)NCc1cccs1 17a5e8446399ac1cc5708fd3a322859b [0,2,0,0,0,0|1,1,0]=4 1275 B12R1.51 COCC(=O)NCc1ccno1 c9b4c569a6735379b0992ce3b948759e [0,2,0,0,0,0|2,0,0]=4 1276 B12R1.51 COCC(=O)NCc1cnco1 22edcc68fa354d30555cb96958425013 [0,2,0,0,0,0|2,0,0]=4 1277 B12R1.51 COCC(=O)NCc1ncco1 fec39f7d8dd5cca33c8547b9ab6aec7a [0,2,0,0,0,0|2,0,0]=4 1278 B12R1.51 CSCC(=O)NCc1ccco1 22aacf48f67d51e903ab97124be12ef7 [0,2,0,0,0,0|1,0,0]=3 1279 B12R1.51 CSCC(=O)NCc1cccs1 139601ec2ef91fc28858209e2523e927 [0,2,0,0,0,0|1,1,0]=4 1280 B12R1.51 CSCC(=O)NCc1ccno1 3159dac1e9bf2912c093d87661447187 [0,2,0,0,0,0|2,0,0]=4 1281 B12R1.51 CSCC(=O)NCc1cnco1 5794254ddb3c2947928edb7491d4bf46 [0,2,0,0,0,0|2,0,0]=4 1282 B12R1.51 CSCC(=O)NCc1ncco1 623cb02f6bf4afeae866bb8fc65b2ccf [0,2,0,0,0,0|2,0,0]=4 1283 B12R1.51 N#CCC(=O)NCc1ccco1 b89d60a0d69d715632b047b7357c1671 [0,2,0,0,0,0|1,0,0]=3 1284 B12R1.51 N#CCC(=O)NCc1cccs1 6c2e97d1509e8fe3eb61a197c17ae195 [0,2,0,0,0,0|1,1,0]=4 1285 B12R1.51 N#CCC(=O)NCc1ccno1 08dd6e0e8e77bf101e8e35a5becb2dc0 [0,2,0,0,0,0|2,0,0]=4 1286 B12R1.51 N#CCC(=O)NCc1cnco1 0cf9869cf7498b4a33afe63e6422d779 [0,2,0,0,0,0|2,0,0]=4 1287 B12R1.51 N#CCC(=O)NCc1ncco1 ae190ee66df701cca1c9ff6bff28a06f [0,2,0,0,0,0|2,0,0]=4 1288 B12R1.51 N#CNC(=O)CCc1ccco1 a060821dcd2e53c8f047a9897abf3ded [0,2,0,0,0,0|1,0,1]=4 1289 B12R1.51 N#CNC(=O)NCc1ccco1 6eba08bf214dda3ba3deb6859c2e0b72 [0,2,0,0,0,0|1,0,1]=4 1290 B12R1.51 NOCC(=O)NCc1ccco1 55c89cd71ee583253c7fc3c85e0df85d [0,2,0,0,0,0|1,0,0]=3 1291 B12R1.51 NOCC(=O)NCc1cccs1 86bba110102c957f321a82d553cb5bc8 [0,2,0,0,0,0|1,1,0]=4 1292 B12R1.51 NOCC(=O)NCc1ccno1 604dcbbeadc0d9d2f38363130603db0c [0,2,0,0,0,0|2,0,0]=4 1293 B12R1.51 NOCC(=O)NCc1cnco1 7548e4bd7bef81b2bcad6f269d7e296e [0,2,0,0,0,0|2,0,0]=4 1294 B12R1.51 NOCC(=O)NCc1ncco1 dae1681fc71f666b58965be4117dd732 [0,2,0,0,0,0|2,0,0]=4 1295 B12R1.51 O=C(/C=C/Br)NCc1ccco1 614d6065fa25c2d67695ad23680cb549 [0,2,0,0,0,0|1,0,1]=4 1296 B12R1.51 O=C(/C=C/Cl)NCc1ccco1 c1f2edb5f88275f65c16f44ee1d56daa [0,2,0,0,0,0|1,0,1]=4 1297 B12R1.51 O=C(/C=C/I)NCc1ccco1 eef62f7a79454e281741d562870c356c [0,2,0,0,0,0|1,0,1]=4 1298 B12R1.51 O=C(/C=C\Br)NCc1ccco1 b2710f38fd9511ce6012eb97c5524459 [0,2,0,0,0,0|1,0,1]=4 1299 B12R1.51 O=C(/C=C\Cl)NCc1ccco1 fbe7f45a17e6d8b120a66ddc81ac24de [0,2,0,0,0,0|1,0,1]=4 1300 B12R1.51 O=C(/C=C\I)NCc1ccco1 257c14ea38b62068334ebd6f30f00d04 [0,2,0,0,0,0|1,0,1]=4 1301 B12R1.51 O=C(C#CBr)NCc1ccco1 3f1786b278933f911689c105c4f22158 [0,2,0,0,0,0|1,0,1]=4 1302 B12R1.51 O=C(C=CBr)NCc1ccco1 b62e19418533c97aa78db525bb6581f2 [0,2,0,0,0,0|1,0,1]=4 1303 B12R1.51 O=C(C=CI)NCc1ccco1 03bd230848cd9ffc43cb169c275b9106 [0,2,0,0,0,0|1,0,1]=4 1304 B12R1.51 O=C(CCF)NCc1ccco1 de87c88b7371ee6a55d143d10f42ba71 [0,2,0,0,0,0|1,0,0]=3 1305 B12R1.51 O=C(CCF)NCc1cccs1 045ecfb57c01091faa55587d07524e3d [0,2,0,0,0,0|1,1,0]=4 1306 B12R1.51 O=C(CCF)NCc1ccno1 ae07e7f8914fe1c9df8f6d720448464e [0,2,0,0,0,0|2,0,0]=4 1307 B12R1.51 O=C(CCF)NCc1cnco1 901d08beefc57deab74fbd3abe5937ef [0,2,0,0,0,0|2,0,0]=4 1308 B12R1.51 O=C(CCF)NCc1ncco1 9381fcdbcd2753a63625c42b9370b7df [0,2,0,0,0,0|2,0,0]=4 1309 B12R1.51 O=C(CCO)NCc1ccco1 6d6a148358e8c13c0dbc5c3ac54846b8 [0,2,0,0,0,0|1,0,0]=3 1310 B12R1.51 O=C(CCO)NCc1cccs1 ce42179162a865088fbee076fc4b5f4c [0,2,0,0,0,0|1,1,0]=4 1311 B12R1.51 O=C(CCO)NCc1ccno1 0c6c42845930d1f94334efccccdaebe7 [0,2,0,0,0,0|2,0,0]=4 1312 B12R1.51 O=C(CCO)NCc1cnco1 20e2bb10fba6d7814e964102dc595de3 [0,2,0,0,0,0|2,0,0]=4 1313 B12R1.51 O=C(CCO)NCc1ncco1 e24be4bfc2450d1e80928e80a829a795 [0,2,0,0,0,0|2,0,0]=4 1314 B12R1.51 O=C(CCS)NCc1ccco1 f7fddeeb38ca92e0955608e835407398 [0,2,0,0,0,0|1,0,0]=3 1315 B12R1.51 O=C(CCS)NCc1cccs1 302cf06de464e88d7b60b037d4bf288d [0,2,0,0,0,0|1,1,0]=4 1316 B12R1.51 O=C(CCS)NCc1ccno1 caac430e9eadca05fdb94e2ceb3d3b94 [0,2,0,0,0,0|2,0,0]=4 1317 B12R1.51 O=C(CCS)NCc1cnco1 a6fecd441e4615c46ac3b87547dad3ce [0,2,0,0,0,0|2,0,0]=4 1318 B12R1.51 O=C(CCS)NCc1ncco1 a3d490c31f1b64da2bbd7a258eccd7e8 [0,2,0,0,0,0|2,0,0]=4 1319 B12R1.51 O=CCC(=O)NCc1ccco1 446fe2ef4c74b694f0bf0d446ec23dff [0,2,0,0,0,0|1,0,0]=3 1320 B12R1.51 O=CCC(=O)NCc1cccs1 db277326a2149f28ff862c272c5eb0a8 [0,2,0,0,0,0|1,1,0]=4 1321 B12R1.51 O=CCC(=O)NCc1ccno1 93ec50d19f03180efabf043c963b0dcc [0,2,0,0,0,0|2,0,0]=4 1322 B12R1.51 O=CCC(=O)NCc1cnco1 b2bc36411f09cbaab5ce52ed41856ae9 [0,2,0,0,0,0|2,0,0]=4 1323 B12R1.51 O=CCC(=O)NCc1ncco1 073effcf2f2e9023c21da477a833333c [0,2,0,0,0,0|2,0,0]=4 1324 B12R1.108 C#CC(=O)N(C)Cc1ccco1 ae47b273a4f643d7beaa6b07261d4d08 [0,2,0,0,0,0|1,0,1]=4 1325 B12R1.108 C=CC(=O)N(C)Cc1ccco1 920c8519c43cdbb6a69df5c97cfd7bfe [0,2,0,0,0,0|1,0,1]=4 1326 B12R1.108 CC(C=O)N(C)Cc1ccco1 3777c92c12c36502657f71a224979b77 [0,2,0,0,0,0|1,0,1]=4 1327 B12R1.108 CCC(=O)C(C)Oc1ccco1 5fd9b228b217e9b05df8e4fcab02405a [0,2,0,0,0,0|2,0,0]=4 1328 B12R1.108 CCC(=O)N(C)Cc1ccco1 fab6c5c62443d4dcbdd6bbbd6b681e11 [0,2,0,0,0,0|1,0,0]=3 1329 B12R1.108 CCC(=O)N(C)Cc1cccs1 3478c8138ff3865ea56672a7d5c9a33e [0,2,0,0,0,0|1,1,0]=4 1330 B12R1.108 CCC(=O)N(C)Cc1ccno1 66e4acba3dcaaa7da3dd8f839769efb1 [0,2,0,0,0,0|2,0,0]=4 1331 B12R1.108 CCC(=O)N(C)Cc1ncco1 2218c1c44317ae82f3e6895f039a1276 [0,2,0,0,0,0|2,0,0]=4 1332 B12R1.108 CN(Cc1ccco1)C(=O)C=O 5aa5e48bf7f28764f2def41bb5aeafb1 [0,2,0,0,0,0|1,0,1]=4 1333 B12R1.108 CN(Cc1ccco1)C(=O)CF c1772e9a3c396f190870b3323944513a [0,2,0,0,0,0|1,0,0]=3 1334 B12R1.108 CN(Cc1ccco1)C(=O)CO 9a7331e31757378bc0dc65458323fc28 [0,2,0,0,0,0|1,0,0]=3 1335 B12R1.108 CN(Cc1ccco1)C(=O)CS 9ec2e7071ccea555204213b0ec372249 [0,2,0,0,0,0|1,0,0]=3 1336 B12R1.108 CN(Cc1cccs1)C(=O)CF 6a615883a8b2187e97a31cee96aca93f [0,2,0,0,0,0|1,1,0]=4 1337 B12R1.108 CN(Cc1cccs1)C(=O)CO 2c18ba6fa74ab99200701b39f2ec2646 [0,2,0,0,0,0|1,1,0]=4 1338 B12R1.108 CN(Cc1cccs1)C(=O)CS f73c131b85df253bd3bcc61980ffc817 [0,2,0,0,0,0|1,1,0]=4 1339 B12R1.108 CN(Cc1ccno1)C(=O)CF 3deb7a2f23e3089477b3923daf1a3e1b [0,2,0,0,0,0|2,0,0]=4 1340 B12R1.108 CN(Cc1ccno1)C(=O)CO 7d846130a2eabd32f9dd1e05e6a43c55 [0,2,0,0,0,0|2,0,0]=4 1341 B12R1.108 CN(Cc1ccno1)C(=O)CS e44ccea069a54716e364e160c92d880a [0,2,0,0,0,0|2,0,0]=4 1342 B12R1.108 CN(Cc1ncco1)C(=O)CF 948f443ed75724845dd51469fd5854a3 [0,2,0,0,0,0|2,0,0]=4 1343 B12R1.108 CN(Cc1ncco1)C(=O)CO 53da6f6278965ed8fbec296c8d9e83a1 [0,2,0,0,0,0|2,0,0]=4 1344 B12R1.108 CN(Cc1ncco1)C(=O)CS c55c82703673c243002300c0f8c7aca2 [0,2,0,0,0,0|2,0,0]=4 1345 B12R1.108 CNC(=O)C(C)Nc1ccco1 c5089502553e0eb09483ca4203f0d8bf [0,2,0,0,0,0|2,0,0]=4 1346 B12R1.108 COC(=O)C(C)Oc1ccco1 02d2aff09eb2c5af5f3fede2bfa320f5 [0,2,0,0,0,0|2,0,0]=4 1347 B12R1.108 COC(=O)[C@@H](C)Oc1ccco1 7a22247524cf70aa176b9e3e948f30ea [0,2,0,0,0,0|2,0,0]=4 1348 B12R1.108 COC(=O)[C@H](C)Oc1ccco1 7b5e3e9a348c6aba5d65742c6fda466c [0,2,0,0,0,0|2,0,0]=4 1349 B12R1.108 C[C@H](C=O)N(C)Cc1ccco1 e86a72e3f2a4af41d17fa97f7c765fde [0,2,0,0,0,0|1,0,1]=4 1350 B12R1.297 CCC(C=O)NCc1ccco1 856e135eecac705a7dc836af14239519 [0,2,0,0,0,0|1,0,1]=4 1351 B12R1.297 CCC(C=O)OCc1ccco1 573cf798ce6387eaf35edd96250f243a [0,2,0,0,0,0|0,1,1]=4 1352 B12R1.353 C#CC(=O)NCc1occc1C 85df19e9db04cddfcd98131f6ab46794 [0,2,0,0,0,0|1,0,1]=4 1353 B12R1.353 C=CC(=O)NCc1occc1C dcfde5af2df8c5cab240a840a2691204 [0,2,0,0,0,0|1,0,1]=4 1354 B12R1.353 CC(C=O)OCc1occc1Br 79a100c16331a0367923fe6f8d564e40 [0,2,0,0,0,0|0,1,1]=4 1355 B12R1.353 CCC(=O)NCc1cccn1C b08a1b727123d04180fbb5195010218e [0,2,0,0,0,0|2,0,0]=4 1356 B12R1.353 CCC(=O)NCc1occc1C fd86fbb381cff844f3568ea0c04d875e [0,2,0,0,0,0|1,0,0]=3 1357 B12R1.353 CCC(=O)NCc1sccc1Br 79e6c95af4db604d48d4025680a9fdf3 [0,2,0,0,0,0|1,1,0]=4 1358 B12R1.353 CCC(=O)NCc1sccc1Cl afdc3effa1cae4dfac8c8b2cb309525a [0,2,0,0,0,0|1,1,0]=4 1359 B12R1.353 CCC(=O)NCc1sccc1F 9bad560cc4f1a76d07a87ca16d2d021c [0,2,0,0,0,0|1,1,0]=4 1360 B12R1.353 C[C@H](C=O)OCc1occc1Br f04e8753ca74e18a7ba3a86eb7a70493 [0,2,0,0,0,0|0,1,1]=4 1361 B12R1.353 Cc1ccoc1CNC(=O)C=O cd44484f01e9ce891e7ff7c137e6059c [0,2,0,0,0,0|1,0,1]=4 1362 B12R1.353 Cc1ccoc1CNC(=O)CF 83404353e5b263e7cf7f78f0370df398 [0,2,0,0,0,0|1,0,0]=3 1363 B12R1.353 Cc1ccoc1CNC(=O)CO 7d95e3fe7dd231ec400cc0756ee3917f [0,2,0,0,0,0|1,0,0]=3 1364 B12R1.353 Cc1ccoc1CNC(=O)CS b5842925d597bcfc3eec30467d20c392 [0,2,0,0,0,0|1,0,0]=3 1365 B12R1.353 Cc1ccoc1CNC(C)C=O 3a384b1d7fe520fdf9a9c35f877b39ca [0,2,0,0,0,0|1,0,1]=4 1366 B12R1.353 Cc1ccoc1CN[C@H](C)C=O ae3ce72d4df08aaa99eb795194cc5f13 [0,2,0,0,0,0|1,0,1]=4 1367 B12R1.353 Cc1ccoc1COC(C)C=O 128b7515039869329e915e48bae8ab6d [0,2,0,0,0,0|0,1,1]=4 1368 B12R1.353 Cc1ccoc1CO[C@H](C)C=O a39e32728429dc3f818a0daec2f7a4c8 [0,2,0,0,0,0|0,1,1]=4 1369 B12R1.353 Cn1cccc1CNC(=O)CF b227bbe2f2065eab4c8fa79e26b72c86 [0,2,0,0,0,0|2,0,0]=4 1370 B12R1.353 Cn1cccc1CNC(=O)CO 9cc41b7f45dea5410309d4ff1f1ca779 [0,2,0,0,0,0|2,0,0]=4 1371 B12R1.353 Cn1cccc1CNC(=O)CS 590022afd73682aa2b586d4a30ad477e [0,2,0,0,0,0|2,0,0]=4 1372 B12R1.353 O=C(CF)NCc1sccc1Br 979fd5cabab2f96b964fc3bd37e3c559 [0,2,0,0,0,0|1,1,0]=4 1373 B12R1.353 O=C(CF)NCc1sccc1Cl 557c8d8688fc4c263c74d406a23c102c [0,2,0,0,0,0|1,1,0]=4 1374 B12R1.353 O=C(CF)NCc1sccc1F 3998dc5ef8fbd0bbea856bf0676f9628 [0,2,0,0,0,0|1,1,0]=4 1375 B12R1.353 O=C(CO)NCc1sccc1Br e347c789dddb159b6111c6a082967f7c [0,2,0,0,0,0|1,1,0]=4 1376 B12R1.353 O=C(CO)NCc1sccc1Cl 43071d40d24df15e9998c9226ac438e0 [0,2,0,0,0,0|1,1,0]=4 1377 B12R1.353 O=C(CO)NCc1sccc1F 27bb122be04fe360471169da32640259 [0,2,0,0,0,0|1,1,0]=4 1378 B12R1.353 O=C(CS)NCc1sccc1Br dc2558995383b8a96173db3279bf2e4e [0,2,0,0,0,0|1,1,0]=4 1379 B12R1.353 O=C(CS)NCc1sccc1Cl f81bfdc6a0bb4ee353b0d32af86fa738 [0,2,0,0,0,0|1,1,0]=4 1380 B12R1.353 O=C(CS)NCc1sccc1F c2073f20bdc00b8b91b96bcdffc65903 [0,2,0,0,0,0|1,1,0]=4 1381 B12R1.104 CC(=O)N(C)Cc1cc(cs1)C 44197624c15ce2eb684545c0c6c7136d [0,2,0,0,0,0|1,1,0]=4 1382 B12R1.104 CC(=O)N(C)Cc1ccc(o1)C 59007f739d1f99363de3060be769c190 [0,2,0,0,0,0|1,0,0]=3 1383 B12R1.104 CC(=O)N(C)Cc1ccc(s1)Br ed96c18c91b25b7ca6ea6e1075eba26c [0,2,0,0,0,0|1,1,0]=4 1384 B12R1.104 CC(=O)N(C)Cc1ccc(s1)C f832553b5a5059bc75d716f3dbc00bf5 [0,2,0,0,0,0|1,1,0]=4 1385 B12R1.104 CC(=O)N(C)Cc1ccc(s1)Cl c3a1141cda6fb06e07fa6cc6dbb1b8b9 [0,2,0,0,0,0|1,1,0]=4 1386 B12R1.120 CC(=O)N(C)C(C)c1cccs1 8b0441c098c0ddebcadb8f8952f3d490 [0,2,0,0,0,0|1,1,0]=4 1387 B12R1.145 CC(=O)N(C)Cc1cccn1C 9648fbf7da398da30e6c692c25a47b79 [0,2,0,0,0,0|2,0,0]=4 1388 B12R1.145 CC(=O)N(C)Cc1occc1C 03173b060bf668c0c0e1b70aced7cc11 [0,2,0,0,0,0|1,0,0]=3 1389 B12R1.298 CCN(Cc1ccco1)C(=O)C 8e34880ce2d5e2ba359ddd3b4b0429f7 [0,2,0,0,0,0|1,0,0]=3 1390 B12R1.298 CCN(Cc1cccs1)C(=O)C 82cf32a528b8c9316ca58c6996f49450 [0,2,0,0,0,0|1,1,0]=4 1391 B12R1.1373 CC(=O)C(C)(C)Nc1ccco1 21af57853849d4c754f6fc5ea695ecb5 [0,2,0,0,0,0|2,0,0]=4 1392 B12R1.59 CC(=O)CNc1cc(co1)C#N c785461582f743176e0f0d22406e9a0d [0,2,0,0,0,0|2,0,0]=4 1393 B12R1.59 CC(=O)CNc1ccc(o1)C#N f5311fe596bc65b69dbb865db67565de [0,2,0,0,0,0|2,0,0]=4 1394 B12R1.59 CC(=O)CNc1ccc(o1)C=O 30e2e690885590fd7ecb5c5cd471fe87 [0,2,0,0,0,0|2,0,0]=4 1395 B12R1.59 CC(=O)CNc1ccc(o1)CO 88deb4fa0d6e79f7b802ebba305d9568 [0,2,0,0,0,0|2,0,0]=4 1396 B12R1.59 CC(=O)NCc1cc(co1)C#N fab04bae72aca7cdf39524decf9f5dcd [0,2,0,0,0,0|1,0,0]=3 1397 B12R1.59 CC(=O)NCc1cc(cs1)C#N b01c556dcfc4eae6f4000fafb8d8ec78 [0,2,0,0,0,0|1,1,0]=4 1398 B12R1.59 CC(=O)NCc1ccc(o1)CO 1c79861a8323cdfd9d57c07c6408237b [0,2,0,0,0,0|1,0,0]=3 1399 B12R1.59 CC(=O)NCc1ccc(s1)C#N e53e0ba3c96ccdca9f1347654d851bbc [0,2,0,0,0,0|1,1,0]=4 1400 B12R1.59 CCc1cc(on1)CNC(=O)C 9a752cceab19b9492232348f01c1aa2f [0,2,0,0,0,0|2,0,0]=4 1401 B12R1.59 CCc1ccc(o1)NCC(=O)C 1ee99ad5de7eaa2654d8301bf3d52463 [0,2,0,0,0,0|2,0,0]=4 1402 B12R1.103 CC(=O)NC(C)c1cc(no1)Br 96e2286a71e1b62a061f70c0478fd443 [0,2,0,0,0,0|2,0,0]=4 1403 B12R1.103 CC(=O)NC(C)c1ccc(o1)C 14a20018db4e1debf3fe6aa5b76e92ac [0,2,0,0,0,0|1,0,0]=3 1404 B12R1.103 CC(=O)NC(C)c1ccc(s1)Br 2da7b6768efd3e33610d9e4904025ca9 [0,2,0,0,0,0|1,1,0]=4 1405 B12R1.103 CC(=O)NC(C)c1ccc(s1)Cl ceb7cac0085c2046b71abc98b15b5cba [0,2,0,0,0,0|1,1,0]=4 1406 B12R1.103 CC(=O)N[C@@H](C)c1cc(cs1)Br 3dc6fcfc041f62026047010813f8a696 [0,2,0,0,0,0|1,1,0]=4 1407 B12R1.103 CC(=O)N[C@@H](C)c1ccc(s1)C e954d5894c784cca9eb3d710a275b1c9 [0,2,0,0,0,0|1,1,0]=4 1408 B12R1.103 CC(=O)N[C@H](C)c1cc(cs1)Br 5a1aa67eade83197324448a9a4221879 [0,2,0,0,0,0|1,1,0]=4 1409 B12R1.103 CC(=O)N[C@H](C)c1ccc(o1)C faeeb9777d1dcbea4d54f534cc0e11d3 [0,2,0,0,0,0|1,0,0]=3 1410 B12R1.103 CC(=O)N[C@H](C)c1ccc(s1)Br 0c0572cac6384d039e82f2cc3081cb4f [0,2,0,0,0,0|1,1,0]=4 1411 B12R1.103 CC(=O)N[C@H](C)c1ccc(s1)Cl d1e501255336cc2673c9bbc7f1e7cbd3 [0,2,0,0,0,0|1,1,0]=4 1412 B12R1.110 CC(=O)NCc1nc(c(o1)C)Br 8d614d090b866c0834479774b96f2882 [0,2,0,0,0,0|2,0,0]=4 1413 B12R1.110 CC(=O)NCc1nc(c(o1)C)C cfeed0c2a98ef32c13ebb0607fe14a76 [0,2,0,0,0,0|2,0,0]=4 1414 B12R1.861 CC(=O)NCc1oc(nc1C)C c7e68fe0c94468dfd84cd6547f3d91e4 [0,2,0,0,0,0|2,0,0]=4 1415 B12R1.870 CC(=O)NCc1ccc(n1C)C 372f2741b5d5692d93255f73a25b37f2 [0,2,0,0,0,0|2,0,0]=4 1416 B12R1.259 CC(=O)NC(C)(C)c1cccs1 6f6c76b9948af68663f27c9862e8aa3d [0,2,0,0,0,0|1,1,0]=4 1417 B12R1.476 CCC(NC(=O)C)c1ccco1 6906981556ee166cd75b44fafb7d0ffe [0,2,0,0,0,0|1,0,0]=3 1418 B12R1.476 CCC(NC(=O)C)c1cccs1 e32be0ffa41f76c7206a4ddd8ed69929 [0,2,0,0,0,0|1,1,0]=4 1419 B12R1.81 COc1ccsc1CNC(=O)C 16287217f6261163d817e8ff590e8e76 [0,2,0,0,0,0|1,1,0]=4 1420 B12R2.6 Cc1cc(cs1)c2ccco2 4e9de336fcd30bd116c1d4cf4b6bdc49 [0,0,0,1,0,1|1,0,1]=4 1421 B12R2.6 Cc1cc(ns1)c2ccco2 5d652dadc822270a4be4453187f9994a [0,0,0,1,0,1|1,0,1]=4 1422 B12R2.6 Cc1cc(sn1)c2ccco2 6d914703e0ee7b89adcaa3779fb10d90 [0,0,0,1,0,1|1,0,1]=4 1423 B12R2.6 Cc1csc(c1)c2ccco2 3a0f49632a265669f7beb2e44ebf88ea [0,0,0,1,0,1|1,0,1]=4 1424 B12R2.6 Cc1csc(n1)c2ccco2 300cd8762efdd1e0d44b0f6f6c3aa061 [0,0,0,1,0,1|1,0,1]=4 1425 B12R2.6 Cc1nc(cs1)c2ccco2 e687eec462faf3376d62b05144a64055 [0,0,0,1,0,1|1,0,1]=4 1426 B12R2.6 Cc1nc(ns1)c2ccco2 4c2242d003001c95bb49a1eeb116577a [0,0,0,1,0,1|1,0,1]=4 1427 B12R2.6 Cc1nsc(n1)c2ccco2 a21ee9ca7b110766d69346cac2312604 [0,0,0,1,0,1|1,0,1]=4 1428 B12R2.136 O=C1CC(C1)Nc2ccno2 7e5c23fceab2e167f2dcaafdb0cb24f0 [0,0,0,1,0,1|2,0,0]=4 1429 B12R2.136 O=C1CC(C1)Oc2ccco2 c7945d307366b05a4dbdeb1d8dba021a [0,0,0,1,0,1|1,0,0]=3 1430 B12R2.44 O=CN1CCc2occc2C1 ca5bfcdba4e9412da7f5f49a0b3cf676 [0,1,0,1,0,0|2,0,0]=4 1431 B10R1.17 O=CNCc1ccccc1 8c79f42269c527e7ed1741ce8019791f [1,0,0,0,0,1|2,0,0]=4 1432 B10R1.17 O=CNCc1ccccn1 2a4bd7c465ac0ab8804867d1eeb7fd18 [1,0,0,0,0,1|2,0,0]=4 1433 B10R1.17 O=CNCc1cccnc1 86ebf2990a9293a0c4bc35942f9e4571 [1,0,0,0,0,1|2,0,0]=4 1434 B10R1.17 O=CNCc1cccnn1 c5e83bdac2e2f539bc82d2501f5689bd [1,0,0,0,0,1|2,0,0]=4 1435 B10R1.17 O=CNCc1ccncc1 1f2ebcdeb77286cfab7ddcdf6ac042b2 [1,0,0,0,0,1|2,0,0]=4 1436 B10R1.17 O=CNCc1ccncn1 9cc8575563436bdab6bb5758cdf1aa10 [1,0,0,0,0,1|2,0,0]=4 1437 B10R1.17 O=CNCc1cnccn1 2bd46c5e573c56891fa964a095c4e2d7 [1,0,0,0,0,1|2,0,0]=4 1438 B10R1.17 O=CNCc1ncccn1 7d1c42dda8acac697d69ce2b0a3b68b6 [1,0,0,0,0,1|2,0,0]=4 1439 B12R1.252 CC(=O)CCNc1ccccc1 9b0f0a0043bcfdd99ee44d3d72b922e5 [0,0,0,0,0,2|2,0,0]=4 1440 B12R1.252 CC(=O)CCNc1ccccn1 997919901794ee27201838f3f268a693 [0,0,0,0,0,2|2,0,0]=4 1441 B12R1.252 CC(=O)CCNc1cccnc1 d55d133f13b833b5bf8507a979c71c53 [0,0,0,0,0,2|2,0,0]=4 1442 B12R1.252 CC(=O)CCNc1cccnn1 32d799f5ae0f043ddfd98d242d6e2b83 [0,0,0,0,0,2|2,0,0]=4 1443 B12R1.252 CC(=O)CCNc1ccncc1 bbf0d1b9e62272e08678140c87e735f6 [0,0,0,0,0,2|2,0,0]=4 1444 B12R1.252 CC(=O)CCNc1ccncn1 0028a4c9e1e1e7e2cab45e31e5dcdf1c [0,0,0,0,0,2|2,0,0]=4 1445 B12R1.252 CC(=O)CCNc1cnccn1 8194d0ad6d30ebb45605078893d0b86f [0,0,0,0,0,2|2,0,0]=4 1446 B12R1.252 CC(=O)CCNc1ncccn1 f9af544460838f47ce2dd0d8d6fb8e65 [0,0,0,0,0,2|2,0,0]=4 1447 B12R1.252 CC(=O)CCOc1ccccn1 f0d6b589e7af691479be38abbd6bcdf3 [0,0,0,0,0,2|2,0,0]=4 1448 B12R1.252 CC(=O)CCOc1cccnc1 67dae2709723517ab5af883d0837054b [0,0,0,0,0,2|2,0,0]=4 1449 B12R1.252 CC(=O)CCOc1ccncc1 1ac74c4f9261a84ccdad1c4e049e9ece [0,0,0,0,0,2|2,0,0]=4 1450 B12R1.252 CC(=O)CCOc1cnccn1 470130b5fcbc6995e03cec6409a7e88f [0,0,0,0,0,2|2,0,0]=4 1451 B12R1.252 CC(=O)CCOc1ncccn1 cb317663dda387ed6c769a3c84b9ec4a [0,0,0,0,0,2|2,0,0]=4 1452 B12R1.252 CC(=O)CNCc1ccccc1 5e4599c3af112643425e1a35238a896f [0,0,0,0,0,2|2,0,0]=4 1453 B12R1.252 CC(=O)CNCc1ccccn1 6857f6976c347e411d9abdd48f8982fb [0,0,0,0,0,2|2,0,0]=4 1454 B12R1.252 CC(=O)CNCc1cccnc1 39d89333d7252b4434a1fdfd17a4d718 [0,0,0,0,0,2|2,0,0]=4 1455 B12R1.252 CC(=O)CNCc1cccnn1 69a4573b28e6734fdd6ea189d6e37041 [0,0,0,0,0,2|2,0,0]=4 1456 B12R1.252 CC(=O)CNCc1ccncn1 9280fb5fc212f0e227894d5f435d42d3 [0,0,0,0,0,2|2,0,0]=4 1457 B12R1.252 CC(=O)CNCc1ncccn1 ebcbf993e63f54e2a531cc36cbf3d20b [0,0,0,0,0,2|2,0,0]=4 1458 B12R1.252 CC(=O)COCc1ccccc1 18daaa7c0d669a182de591929c861cbe [0,0,0,0,0,2|1,1,0]=4 1459 B12R1.252 CC(=O)COCc1ccccn1 f8ed3ffb815bee7f1737eacfe042d64f [0,0,0,0,0,2|1,1,0]=4 1460 B12R1.252 CC(=O)COCc1cccnc1 36638c01e0a61511be9d007508b97b48 [0,0,0,0,0,2|1,1,0]=4 1461 B12R1.252 CC(=O)COCc1cccnn1 e5ce14b0f3485754a3b54e412cf985cc [0,0,0,0,0,2|1,1,0]=4 1462 B12R1.252 CC(=O)COCc1ccncn1 0d85e9f224c2952d6d7e3faef841c4cd [0,0,0,0,0,2|1,1,0]=4 1463 B12R1.252 CC(=O)COCc1ncccn1 b330e3f5176d6d50393a8f323d76eb16 [0,0,0,0,0,2|1,1,0]=4 1464 B12R1.252 CC(=O)NCCc1ccccc1 1052e9521fedb3e85cab4ef571c55982 [0,0,0,0,0,2|2,0,0]=4 1465 B12R1.252 CC(=O)NCCc1ccccn1 3ad8e2876430ef8ccd3cbeba8ed6119f [0,0,0,0,0,2|2,0,0]=4 1466 B12R1.252 CC(=O)NCCc1cccnc1 3962e9654ba13e9ef1bdd3c037e7deff [0,0,0,0,0,2|2,0,0]=4 1467 B12R1.252 CC(=O)NCCc1ccncc1 56311f224412b2ab7d4e3e56f79fd239 [0,0,0,0,0,2|2,0,0]=4 1468 B12R1.252 CC(=O)NCCc1ccncn1 fab966eb0085b8e36cdf3d0657da7143 [0,0,0,0,0,2|2,0,0]=4 1469 B12R1.252 CC(=O)NCCc1cnccn1 1cf21aa316ea8133ba87ed31740cb5a0 [0,0,0,0,0,2|2,0,0]=4 1470 B12R1.252 CC(=O)NCCc1ncccn1 6cea7b81fd8f7f4399691623e3b09425 [0,0,0,0,0,2|2,0,0]=4 1471 B12R1.252 CC(=O)OCNc1ccccc1 6887be863fb786ec7dd333ad6d1f93a1 [0,0,0,0,0,2|1,1,0]=4 1472 B12R1.252 CC(=O)OCNc1ccccn1 a41f1b71ededa97eb4355e9af8654026 [0,0,0,0,0,2|1,1,0]=4 1473 B12R1.252 CC(=O)OCNc1cccnc1 4178bffb832b0edcfc9121cf9bba84c2 [0,0,0,0,0,2|1,1,0]=4 1474 B12R1.252 CC(=O)OCNc1cccnn1 8c98d445e1e0cc487041b61de0ea911c [0,0,0,0,0,2|1,1,0]=4 1475 B12R1.252 CC(=O)OCNc1ccncc1 108d237aa1f6f8444cb5b9cf1463791c [0,0,0,0,0,2|1,1,0]=4 1476 B12R1.252 CC(=O)OCNc1ccncn1 bf20837dfac7b7bae382ad769a09b6f4 [0,0,0,0,0,2|1,1,0]=4 1477 B12R1.252 CC(=O)OCNc1cnccn1 bdb0ee3fc5470597e07f96ab12fbc213 [0,0,0,0,0,2|1,1,0]=4 1478 B12R1.252 CC(=O)OCNc1ncccn1 906e0b59248f23fb7691c6448550e547 [0,0,0,0,0,2|1,1,0]=4 1479 B12R1.252 CC(=O)OCOc1ccccn1 86abcd8d807149e2e6ef73302de6ba90 [0,0,0,0,0,2|1,1,0]=4 1480 B12R1.252 CC(=O)OCOc1cccnc1 276102d131e97a552c86e2e9163e6724 [0,0,0,0,0,2|1,1,0]=4 1481 B12R1.252 CC(=O)OCOc1ccncc1 cfb5cc299f2c001f2ecc804da49cda8d [0,0,0,0,0,2|1,1,0]=4 1482 B12R1.252 CC(=O)OCOc1cnccn1 7137929c8a41977d22d81b105aca6c2e [0,0,0,0,0,2|1,1,0]=4 1483 B12R1.252 CC(=O)OCOc1ncccn1 8b175a52d1a3c6c8bd19153f2e2293d7 [0,0,0,0,0,2|1,1,0]=4 1484 B12R1.252 NC(=O)SCNc1ccccc1 04fee35ff8f9c889431229dba8f9753f [0,0,0,0,0,2|2,0,0]=4 1485 B12R1.252 NC(=O)SCNc1ccccn1 9f527f03a77ec47343887a49f737f445 [0,0,0,0,0,2|2,0,0]=4 1486 B12R1.252 NC(=O)SCNc1cccnc1 21908f4213de8cdd1a147da4de7d897b [0,0,0,0,0,2|2,0,0]=4 1487 B12R1.252 NC(=O)SCNc1cccnn1 e0ab0d5b03904df02856d6a2ac41cedb [0,0,0,0,0,2|2,0,0]=4 1488 B12R1.252 NC(=O)SCNc1ccncc1 aff411b6d8fa6b0b923a6798d6b54c72 [0,0,0,0,0,2|2,0,0]=4 1489 B12R1.252 NC(=O)SCNc1ccncn1 2cf8da09de9a049a37eba3f8cc8b4009 [0,0,0,0,0,2|2,0,0]=4 1490 B12R1.252 NC(=O)SCNc1cnccn1 7a4e211bbf00d5eb80ce98b5d1dafd5e [0,0,0,0,0,2|2,0,0]=4 1491 B12R1.252 NC(=O)SCNc1ncccn1 83c80dc09b34df418a0f337cc7372438 [0,0,0,0,0,2|2,0,0]=4 1492 B12R1.252 NC(=O)SCOc1ccccn1 a7c03ec46fb8c0626c8f63c3955a07da [0,0,0,0,0,2|2,0,0]=4 1493 B12R1.252 NC(=O)SCOc1cccnc1 d018f902b677a1f9dedb88e315d7a055 [0,0,0,0,0,2|2,0,0]=4 1494 B12R1.252 NC(=O)SCOc1ccncc1 95e815057013fa30722e3b1a9bc58d06 [0,0,0,0,0,2|2,0,0]=4 1495 B12R1.252 NC(=O)SCOc1cnccn1 c2ab38f8db5eaa995d12378bff0d9b2e [0,0,0,0,0,2|2,0,0]=4 1496 B12R1.252 NC(=O)SCOc1ncccn1 973b78d30f5fab1c122307e05a81c728 [0,0,0,0,0,2|2,0,0]=4 1497 B12R1.255 C/C(=C/CNCc1ccco1)/I 7ed6efbed42e184951e05ee7c4d3ed5a [0,0,0,0,0,2|2,0,0]=4 1498 B12R1.255 C/C(=C/COCc1ccco1)/Cl 1bf0425aca5d165e0863987788c55bbc [0,0,0,0,0,2|1,1,0]=4 1499 B12R1.255 C/C(=C/COCc1ccco1)/I 6ca611aa8289ade8f590408b30f8aa22 [0,0,0,0,0,2|1,1,0]=4 1500 B12R1.255 C/C(=C\CNCc1ccco1)/Cl 0911584d404d599bd9b0b0926d4d6622 [0,0,0,0,0,2|2,0,0]=4 1501 B12R1.255 C/C(=C\COCc1ccco1)/Cl 643dee1770142a62f26d1689e4ceec2a [0,0,0,0,0,2|1,1,0]=4 1502 B12R1.255 C=C(C)CCCOc1ccco1 8c9da3099592bbe67258ecb0e10136ae [0,0,0,0,0,2|2,0,0]=4 1503 B12R1.255 C=C(C)CCNCc1ccco1 aa2bbc7838299ef6a87dc40a41ba6abd [0,0,0,0,0,2|2,0,0]=4 1504 B12R1.255 C=C(C)CCOCc1ccco1 172c290673ebb58285947b21506e0ed9 [0,0,0,0,0,2|1,1,0]=4 1505 B12R1.255 C=C(C)CNCCc1ccco1 e71ed1eb849ed6ebe64b9b0571b3c248 [0,0,0,0,0,2|2,0,0]=4 1506 B12R1.255 C=C(C)COCCc1ccco1 907540e8bf74f821ffe60c1e7504c1b9 [0,0,0,0,0,2|1,1,0]=4 1507 B12R1.255 CC(=CCCOc1ccco1)C 6bc62b84b251ae427a2fb85cebcca816 [0,0,0,0,0,2|2,0,0]=4 1508 B12R1.255 CC(=CCNCc1ccco1)C c2b4f727cd04084867c30b306b19d217 [0,0,0,0,0,2|2,0,0]=4 1509 B12R1.255 CC(=CCNCc1ccco1)Cl 5adaf9ed26618a5289f0b7751996ec42 [0,0,0,0,0,2|2,0,0]=4 1510 B12R1.255 CC(=CCNCc1ccco1)I a471fbd65e53e5c33f15d2d2d0cb98eb [0,0,0,0,0,2|2,0,0]=4 1511 B12R1.255 CC(=CCOCc1ccco1)C d5ab72e91e9438027749c00e393aac05 [0,0,0,0,0,2|1,1,0]=4 1512 B12R1.255 CC(=CCOCc1ccco1)Cl c08ad4bb3f2337969e5b86520b0a3cec [0,0,0,0,0,2|1,1,0]=4 1513 B12R1.255 CC(=CCOCc1ccco1)I 2705d8b90bdba8103f0a3dac07f0344f [0,0,0,0,0,2|1,1,0]=4 1514 B12R1.255 CC(=O)CCCNc1cccs1 3533038623349dc11f21a8b98ed58548 [0,0,0,0,0,2|1,1,0]=4 1515 B12R1.255 CC(=O)CCCNc1ccno1 d90977814d3386f2a722ea1b6a2dd6fa [0,0,0,0,0,2|2,0,0]=4 1516 B12R1.255 CC(=O)CCCNc1ncco1 140205b69a990a5c669394310fb9d71c [0,0,0,0,0,2|2,0,0]=4 1517 B12R1.255 CC(=O)CCCOc1ccco1 f00e61f445dc6ee381836d29a67abaed [0,0,0,0,0,2|1,0,0]=3 1518 B12R1.255 CC(=O)CCCOc1cccs1 fdbe6c6ac6d7cc74ad5226a55e50b681 [0,0,0,0,0,2|1,1,0]=4 1519 B12R1.255 CC(=O)CCNCc1ccc[nH]1 9b5627f8ee979e3cb705edcf1121d22b [0,0,0,0,0,2|2,0,0]=4 1520 B12R1.255 CC(=O)CCNCc1ccco1 88fb4b8d3b60021a60c70d858800ba28 [0,0,0,0,0,2|1,0,0]=3 1521 B12R1.255 CC(=O)CCNCc1cccs1 434fcc6d3b3186d12b3fd048a811c33a [0,0,0,0,0,2|1,1,0]=4 1522 B12R1.255 CC(=O)CCNCc1ccno1 c410d1594efe47d1abed6e0247487d72 [0,0,0,0,0,2|2,0,0]=4 1523 B12R1.255 CC(=O)CCNCc1cnco1 92a9a7e0777b7bee0d224228f33b19d0 [0,0,0,0,0,2|2,0,0]=4 1524 B12R1.255 CC(=O)CCNCc1ncco1 bc4fc3302009666aacf55aa22ad007fb [0,0,0,0,0,2|2,0,0]=4 1525 B12R1.255 CC(=O)CCOCc1ccc[nH]1 7c081328c3e3b08c6b1076a30ffe4717 [0,0,0,0,0,2|1,1,0]=4 1526 B12R1.255 CC(=O)CCOCc1ccco1 8c882a70fc6ceb65186f83d1f22dd2e7 [0,0,0,0,0,2|0,1,0]=3 1527 B12R1.255 CC(=O)CCOCc1cccs1 f16401d6798282ad4782e7afe706d353 [0,0,0,0,0,2|0,2,0]=4 1528 B12R1.255 CC(=O)CCOCc1ccno1 507da36c33af30c1f34f5c29ed017d7f [0,0,0,0,0,2|1,1,0]=4 1529 B12R1.255 CC(=O)CCOCc1cnco1 f8b19a4ebfa304050e17334f691dcc5a [0,0,0,0,0,2|1,1,0]=4 1530 B12R1.255 CC(=O)CCOCc1ncco1 8a3958338e4d53bac1c6546aaeee1dbf [0,0,0,0,0,2|1,1,0]=4 1531 B12R1.255 CC(=O)CNCCc1cccs1 28b073b661eeda62f9d1e15484e88d1d [0,0,0,0,0,2|1,1,0]=4 1532 B12R1.255 CC(=O)COCCc1cccs1 1429fcea1ed51e0c2471b3e0c0959bfd [0,0,0,0,0,2|0,2,0]=4 1533 B12R1.255 CC(=O)NCCCc1ccco1 e1aa4320962591f5a687835bb172466e [0,0,0,0,0,2|1,0,0]=3 1534 B12R1.255 CC(=O)NCCCc1cccs1 917fd69e3534cdf219a2d9a26477a872 [0,0,0,0,0,2|1,1,0]=4 1535 B12R1.255 CC(=O)NCCNc1ccco1 02d7c9de06ca612458e46496608e10cd [0,0,0,0,0,2|1,0,0]=3 1536 B12R1.255 CC(=O)NCCNc1cccs1 2521f2a8f803be736c1d1fa5bf67eb80 [0,0,0,0,0,2|1,1,0]=4 1537 B12R1.255 CC(=O)NCCNc1ccno1 9faa9e61ad821504ce5acd8739c41265 [0,0,0,0,0,2|2,0,0]=4 1538 B12R1.255 CC(=O)NCCNc1ncco1 ba9b48e8f94f54139f4c543f62fd7d6f [0,0,0,0,0,2|2,0,0]=4 1539 B12R1.255 CC(=O)NCCOc1ccco1 6bb64cc5c3c8c0629b7d67f0d9b5b754 [0,0,0,0,0,2|1,0,0]=3 1540 B12R1.255 CC(=O)NCCOc1cccs1 0352caf0d8868c165ffebe393229173e [0,0,0,0,0,2|1,1,0]=4 1541 B12R1.255 CC(=O)NCOCc1ccco1 10c99e6a3e71803ab2933516b8c03932 [0,0,0,0,0,2|0,1,0]=3 1542 B12R1.255 CC(=O)NCOCc1cccs1 8801ae8ae3fe9f550173b61a2e88b077 [0,0,0,0,0,2|0,2,0]=4 1543 B12R1.255 CC(=O)NCOCc1ccno1 170b210256575eb149ba65f2ee8cc533 [0,0,0,0,0,2|1,1,0]=4 1544 B12R1.255 CC(=O)NCOCc1ncco1 e311cb9d26c42c0f25b713f7ef157684 [0,0,0,0,0,2|1,1,0]=4 1545 B12R1.255 CC(=O)OCCNc1cccs1 fe698497c2f5a7b4634f770efc9fbbd5 [0,0,0,0,0,2|0,2,0]=4 1546 B12R1.255 CC(=O)OCCNc1ccno1 73aa7dd9f2e35b34088a13ee167d2ef1 [0,0,0,0,0,2|1,1,0]=4 1547 B12R1.255 CC(=O)OCCNc1ncco1 e9dfbe49593d08788d35f7e204f8eb83 [0,0,0,0,0,2|1,1,0]=4 1548 B12R1.255 CC(=O)OCCOc1ccco1 8c68d713ece66b6ffb83b011b9d2449f [0,0,0,0,0,2|0,1,0]=3 1549 B12R1.255 CC(=O)OCCOc1cccs1 169b1d0f25fc492249ecd6050e668ba0 [0,0,0,0,0,2|0,2,0]=4 1550 B12R1.255 CC(=O)OCNCc1ccc[nH]1 aff1fefb10670d83920c7fb35b6e4b8b [0,0,0,0,0,2|1,1,0]=4 1551 B12R1.255 CC(=O)OCNCc1ccco1 dc3bad65438da0ec925d64c99fc4dd0b [0,0,0,0,0,2|0,1,0]=3 1552 B12R1.255 CC(=O)OCNCc1cccs1 6187085c5e41f58018c5b643b59dabfe [0,0,0,0,0,2|0,2,0]=4 1553 B12R1.255 CC(=O)OCNCc1ccno1 83919a9efaae26cfb138b0fbb0f22b52 [0,0,0,0,0,2|1,1,0]=4 1554 B12R1.255 CC(=O)OCNCc1cnco1 7375b242e22de0efbd943461563bf1f4 [0,0,0,0,0,2|1,1,0]=4 1555 B12R1.255 CC(=O)OCNCc1ncco1 c7cd7e4ad44da595349937e6560ecc86 [0,0,0,0,0,2|1,1,0]=4 1556 B12R1.255 CC(=O)OCOCc1ccc[nH]1 7c6d5af61c4ae9052635c09455fa5cb6 [0,0,0,0,0,2|1,1,0]=4 1557 B12R1.255 CC(=O)OCOCc1ccco1 b4c1e1e90975e5a59f904fb08792cf48 [0,0,0,0,0,2|0,1,0]=3 1558 B12R1.255 CC(=O)OCOCc1cccs1 d0a768db9043c08159530735f4d00ce4 [0,0,0,0,0,2|0,2,0]=4 1559 B12R1.255 CC(=O)OCOCc1ccno1 3f50e4f8c00c52b37c9b02f2be73fc12 [0,0,0,0,0,2|1,1,0]=4 1560 B12R1.255 CC(=O)OCOCc1cnco1 574d971a01c2b24758bb2f7b198c9bf9 [0,0,0,0,0,2|1,1,0]=4 1561 B12R1.255 CC(=O)OCOCc1ncco1 77d7cff900511ef0eb94d4b2346d905b [0,0,0,0,0,2|1,1,0]=4 1562 B12R1.255 CC(=O)SCCNc1cc[nH]n1 4240df493eb683e474ce2b57a51e550d [0,0,0,0,0,2|2,0,0]=4 1563 B12R1.255 CC(=O)SCCNc1cccs1 57567ee9fe3ccfe39354f36f5ccc582b [0,0,0,0,0,2|0,1,0]=3 1564 B12R1.255 CC(=O)SCCNc1ccno1 ce7f99d07340a46ec6df389a561b0a06 [0,0,0,0,0,2|1,0,0]=3 1565 B12R1.255 CC(=O)SCCNc1ccns1 38a596eeff86cd141eb4f8914a23133a [0,0,0,0,0,2|1,1,0]=4 1566 B12R1.255 CC(=O)SCCNc1ccon1 57c9c3a3664eed1743f52fc0470ef73f [0,0,0,0,0,2|2,0,0]=4 1567 B12R1.255 CC(=O)SCCNc1ccsc1 f04a323e8d817d6055c289d7d6b683db [0,0,0,0,0,2|2,0,0]=4 1568 B12R1.255 CC(=O)SCCNc1cncs1 5599d3aafca3c3284b98a807f03a668c [0,0,0,0,0,2|1,1,0]=4 1569 B12R1.255 CC(=O)SCCNc1cocn1 f8dbda12c0cfe746c1ea685f2b21d7d8 [0,0,0,0,0,2|2,0,0]=4 1570 B12R1.255 CC(=O)SCCNc1cscn1 f595ebe899d29e984262dfb8ac1eb03f [0,0,0,0,0,2|2,0,0]=4 1571 B12R1.255 CC(=O)SCCNc1ncc[nH]1 d27ad31c0e2986d91046f149879d6242 [0,0,0,0,0,2|2,0,0]=4 1572 B12R1.255 CC(=O)SCCNc1ncco1 1c3fb2d914400c50d798fd40e860cabf [0,0,0,0,0,2|1,0,0]=3 1573 B12R1.255 CC(=O)SCCNc1nccs1 b948761104704e349b9aeebed80f662d [0,0,0,0,0,2|1,1,0]=4 1574 B12R1.255 CC(=O)SCCNc1nnco1 13187dd285f3868518e4720cff787a6e [0,0,0,0,0,2|2,0,0]=4 1575 B12R1.255 CC(=O)SCCOc1c[nH]cn1 8bcd60922d60eb71808063db9772ec2f [0,0,0,0,0,2|2,0,0]=4 1576 B12R1.255 CC(=O)SCCOc1ccco1 1b65e07bf700c69aaf49b8c86dac647c [0,0,0,0,0,2|0,0,0]=2 1577 B12R1.255 CC(=O)SCCOc1cccs1 5821f5d023d9347fee830d2270c1abc4 [0,0,0,0,0,2|0,1,0]=3 1578 B12R1.255 CC(=O)SCCOc1ccn[nH]1 ab9fe5c4967246c749d85927646b478f [0,0,0,0,0,2|2,0,0]=4 1579 B12R1.255 CC(=O)SCCOc1ccsc1 d36683d2b6faf4bda72fa48f8f9a7bd8 [0,0,0,0,0,2|2,0,0]=4 1580 B12R1.255 CC(=O)SCCOc1nccs1 0b041ca071a4a4b7de809ed9629e37dd [0,0,0,0,0,2|1,1,0]=4 1581 B12R1.255 CC(=O)SCCOn1cccn1 9c15d15e903cd533d950eb98fff2b22b [0,0,0,0,0,2|2,0,0]=4 1582 B12R1.255 CC(C)SCCOc1ccco1 ad4927df1b1d1feb434ab48186f731f9 [0,0,0,0,0,2|1,0,1]=4 1583 B12R1.255 CS(=O)CCCNc1ccco1 19bfd1f328cc14e59da1d89ef4b3da42 [0,0,0,0,0,2|2,0,0]=4 1584 B12R1.255 CS(=O)CCNCc1ccco1 b737497c8697f0ad0e3ca42a3d2a992f [0,0,0,0,0,2|2,0,0]=4 1585 B12R1.255 CS(=O)CCOCc1ccco1 02ab9022b0992dd6022fc561b068d5bb [0,0,0,0,0,2|1,1,0]=4 1586 B12R1.255 NC(=O)CCCNc1ccco1 d84b09fa6976aee43832de9f84197dd9 [0,0,0,0,0,2|2,0,0]=4 1587 B12R1.255 NC(=O)CCCOc1ccco1 be41c46089666e90a9f44a08f40e4106 [0,0,0,0,0,2|2,0,0]=4 1588 B12R1.255 NC(=O)CCNCc1ccco1 bee65c52841635f84a969050dc7f5716 [0,0,0,0,0,2|2,0,0]=4 1589 B12R1.255 NC(=O)CCOCc1ccco1 397d619d2cb4dc72797733ce85744f41 [0,0,0,0,0,2|1,1,0]=4 1590 B12R1.255 NC(=O)CNCCc1ccco1 2386bc25c1b740c7b496e40a490c4751 [0,0,0,0,0,2|2,0,0]=4 1591 B12R1.255 NC(=O)COCCc1ccco1 8e492066101a0c94b4a65dc01bc09c74 [0,0,0,0,0,2|1,1,0]=4 1592 B12R1.255 NC(=O)NCCOc1ccco1 bc5c6fa4693dea19c767ad0f8c325bea [0,0,0,0,0,2|2,0,0]=4 1593 B12R1.255 NC(=O)NCOCc1ccco1 84230926f3768909b55827f3243e90d6 [0,0,0,0,0,2|1,1,0]=4 1594 B12R1.255 NC(=O)SCNCc1ccc[nH]1 4c47e4fbac6250060f87cebf1cf27250 [0,0,0,0,0,2|2,0,0]=4 1595 B12R1.255 NC(=O)SCNCc1ccco1 0cba9211bd548f770b2a3801b5cb30e3 [0,0,0,0,0,2|1,0,0]=3 1596 B12R1.255 NC(=O)SCNCc1cccs1 6a46f17abf7b034f8aa8bb5b624fd416 [0,0,0,0,0,2|1,1,0]=4 1597 B12R1.255 NC(=O)SCNCc1ccno1 018ca422c0939b43bbfcfdc2ebc8e3c7 [0,0,0,0,0,2|2,0,0]=4 1598 B12R1.255 NC(=O)SCNCc1cnco1 bcf55b856c0a4f8cba895d9cec6eedac [0,0,0,0,0,2|2,0,0]=4 1599 B12R1.255 NC(=O)SCNCc1ncco1 51c65c12a42b0f72fa119ee16dced1a1 [0,0,0,0,0,2|2,0,0]=4 1600 B12R1.255 NC(=O)SCOCc1ccc[nH]1 f92ccb0e8aeb83a79b6bbcd470c77814 [0,0,0,0,0,2|2,0,0]=4 1601 B12R1.255 NC(=O)SCOCc1ccco1 7c26efba372911407d5cb52e5dac426f [0,0,0,0,0,2|1,0,0]=3 1602 B12R1.255 NC(=O)SCOCc1ccno1 01d9bb81f576be70ade14262375964a8 [0,0,0,0,0,2|2,0,0]=4 1603 B12R1.255 NC(=O)SCOCc1cnco1 3aeccd5d3c3a6bc9970fa846ee0e94f2 [0,0,0,0,0,2|2,0,0]=4 1604 B12R1.255 NC(=O)SCOCc1ncco1 2b64c9413dae0b9e5698b315e833458d [0,0,0,0,0,2|2,0,0]=4 1605 B12R1.255 O=C(O)/C=C/CNc1ccco1 794c0da286be14f31f34f8ade05364e8 [0,0,0,0,0,2|2,0,0]=4 1606 B12R1.255 O=C(O)/C=C/COc1ccco1 6d9949f1ea9b9647c046f9c0a6931206 [0,0,0,0,0,2|2,0,0]=4 1607 B12R1.255 O=C(O)C=CCNc1ccco1 8309aa62a33cd307763bbb3db08e63f2 [0,0,0,0,0,2|2,0,0]=4 1608 B12R1.255 O=C(O)C=CCOc1ccco1 a93476cd3abeb104354bb5d6da890562 [0,0,0,0,0,2|2,0,0]=4 1609 B12R1.255 O=C(O)CCCNc1ccco1 995ff1a97334958a77d2ee3a19db3675 [0,0,0,0,0,2|2,0,0]=4 1610 B12R1.255 O=C(O)CCNCc1ccco1 89dcc1ed80fd55a3e3c97ab7f636d98b [0,0,0,0,0,2|2,0,0]=4 1611 B12R1.255 O=C(O)CCOCc1ccco1 7243f80b0fccc8a9962867c7b8d09265 [0,0,0,0,0,2|1,1,0]=4 1612 B12R1.255 O=C(O)CNCCc1ccco1 b120de61f4d3984fe919620d8a506603 [0,0,0,0,0,2|2,0,0]=4 1613 B12R1.255 O=C(O)COCCc1ccco1 130df2e9052ca471804d7f84477f7c34 [0,0,0,0,0,2|1,1,0]=4