0 B12R1.114 C#Cc1ccc(c(c1)C)NC=O d3994d7a0876a564dc29f53ad07cfe33 [0,1,0,0,0,0|2,0,1]=4 1 B12R1.114 C#Cc1ccc(c(c1)Cl)NC=O eeed724dd50abc143d94643272dc27bc [0,1,0,0,0,0|2,0,1]=4 2 B12R1.114 C#Cc1ccc(c(c1)F)NC=O 5ec3c8904ac5ee894bb6e28f8064cb5d [0,1,0,0,0,0|2,0,1]=4 3 B12R1.114 CCNc1ccc(cc1Br)OC b1e147cacfa4a7f9c53768bb6193a555 [0,1,0,0,0,0|2,0,1]=4 4 B12R1.114 CCNc1ccc(cc1C)OC acbed43b8715c8ac6d98756bc2119fe3 [0,1,0,0,0,0|2,0,1]=4 5 B12R1.114 CCNc1ccc(cc1Cl)OC 2517d95b395e626f3bae70fe424ceffc [0,1,0,0,0,0|2,0,1]=4 6 B12R1.114 CCNc1ccc(cc1F)OC eff752696436e3c15cc1f0787fd9adf0 [0,1,0,0,0,0|2,0,1]=4 7 B12R1.114 CCNc1ccc(cc1I)OC ec8d456a49a196c741c38e76b5454eec [0,1,0,0,0,0|2,0,1]=4 8 B12R1.114 CCNc1ccc(cc1S)OC fa0f649ddc93154983b39d71cdb45845 [0,1,0,0,0,0|1,1,1]=4 9 B12R1.114 CCOc1ccc(cc1Br)OC dc86003f9d22430c6adb36465be33115 [0,1,0,0,0,0|2,0,1]=4 10 B12R1.114 CCOc1ccc(cc1C)OC 59795038146e64bc9fe83fb43ffe9bd0 [0,1,0,0,0,0|2,0,1]=4 11 B12R1.114 CCOc1ccc(cc1Cl)OC 07ae7103ee76cfd76cd580510d01c1aa [0,1,0,0,0,0|2,0,1]=4 12 B12R1.114 CCOc1ccc(cc1F)OC f590a84ebc2e54af410e056abdea8ea4 [0,1,0,0,0,0|2,0,1]=4 13 B12R1.114 CCOc1ccc(cc1I)OC 6a50611d1d13b3ad8aaf5692c2e7e8a1 [0,1,0,0,0,0|2,0,1]=4 14 B12R1.114 CCc1ccc(c(c1)Br)NC=O bb626aee8574821c1920417c64f7e044 [0,1,0,0,0,0|2,0,0]=3 15 B12R1.114 CCc1ccc(c(c1)C)NC=O 94ee0583a187e98b9a2ab55c2aa723f2 [0,1,0,0,0,0|2,0,0]=3 16 B12R1.114 CCc1ccc(c(c1)Cl)NC=O c8a0372f4ef0df3f415ee74757233034 [0,1,0,0,0,0|2,0,0]=3 17 B12R1.114 CCc1ccc(c(c1)F)NC=O 608a28a60e7afbbdaf447efa61a62591 [0,1,0,0,0,0|2,0,0]=3 18 B12R1.114 CCc1ccc(c(c1)I)NC=O 86edc075f5ad9fb86be5c5a1785c069e [0,1,0,0,0,0|2,0,0]=3 19 B12R1.114 CCc1ccc(c(c1)O)NC=O 2abe6308f2821186ef6d59c4e362e9e9 [0,1,0,0,0,0|1,0,0]=2 20 B12R1.114 COc1cc(c(cn1)NC=O)C 9db76da73cd2beea4c9cb1178685141f [0,1,0,0,0,0|2,0,0]=3 21 B12R1.114 COc1cc(c(nn1)NC=O)C 93feb095290cb63bc18396f738098355 [0,1,0,0,0,0|3,0,0]=4 22 B12R1.114 COc1ccc(c(c1)Br)NC=O ddfae5424e591c9a4271562dad39b55c [0,1,0,0,0,0|1,0,0]=2 23 B12R1.114 COc1ccc(c(c1)Br)NCF fdccd1497ef2aabc9890d2720369044e [0,1,0,0,0,0|2,0,1]=4 24 B12R1.114 COc1ccc(c(c1)Br)NCO ef70c6e887ba1318f7f4697952c821cb [0,1,0,0,0,0|1,0,2]=4 25 B12R1.114 COc1ccc(c(c1)Br)OCF eeff112fb2ae406f9d7796fc5fffdcae [0,1,0,0,0,0|2,0,1]=4 26 B12R1.114 COc1ccc(c(c1)C)NC=O 98ed649e3c6a6beea83c3f234c39afbc [0,1,0,0,0,0|1,0,0]=2 27 B12R1.114 COc1ccc(c(c1)C)NCF d5325628d6484beb037e292b365d87a9 [0,1,0,0,0,0|2,0,1]=4 28 B12R1.114 COc1ccc(c(c1)C)NCO b91ee632467a69529e270081ce572433 [0,1,0,0,0,0|1,0,2]=4 29 B12R1.114 COc1ccc(c(c1)C)OCF e3e9959552877c2fcfd1ed08e204afd3 [0,1,0,0,0,0|2,0,1]=4 30 B12R1.114 COc1ccc(c(c1)Cl)NC=O 2f163d7a323be911d6187a35c0d31531 [0,1,0,0,0,0|1,0,0]=2 31 B12R1.114 COc1ccc(c(c1)Cl)NCF eb7c4d969c2f9de5e667efba2d77db23 [0,1,0,0,0,0|2,0,1]=4 32 B12R1.114 COc1ccc(c(c1)Cl)NCO e7649e69ec1e43d992cc20e0ed8c6a44 [0,1,0,0,0,0|1,0,2]=4 33 B12R1.114 COc1ccc(c(c1)Cl)OCF 6628664446baeb74dfae3e71babf1ca9 [0,1,0,0,0,0|2,0,1]=4 34 B12R1.114 COc1ccc(c(c1)F)NC=O 0f17e1ed21050e32656f4ab79ca4efc0 [0,1,0,0,0,0|1,0,0]=2 35 B12R1.114 COc1ccc(c(c1)F)NCF ba40e0ddbbcb876427ccc41c83395fe5 [0,1,0,0,0,0|2,0,1]=4 36 B12R1.114 COc1ccc(c(c1)F)NCO dbca4f7a87f77f9e8f601ca14a3e70d1 [0,1,0,0,0,0|1,0,2]=4 37 B12R1.114 COc1ccc(c(c1)F)OCF 7e9573d9258a629bb1d2266727f9fa4d [0,1,0,0,0,0|2,0,1]=4 38 B12R1.114 COc1ccc(c(c1)I)NC=O 2967a843e5dc03d505dbf287f0d6bc5d [0,1,0,0,0,0|1,0,0]=2 39 B12R1.114 COc1ccc(c(c1)I)NCF a2f9e7610d8db5731cfe964ed1bb7e35 [0,1,0,0,0,0|2,0,1]=4 40 B12R1.114 COc1ccc(c(c1)I)NCO 461c7e37f7b9aa1070131418e06bf864 [0,1,0,0,0,0|1,0,2]=4 41 B12R1.114 COc1ccc(c(c1)I)OCF 1a0b1c8b8ef14484fd79addade72f1ea [0,1,0,0,0,0|2,0,1]=4 42 B12R1.114 COc1ccc(c(c1)O)NC=O 233025286c1dac51b30196669450cf92 [0,1,0,0,0,0|0,0,0]=1 43 B12R1.114 COc1ccc(c(c1)S)NC=O eba7f1b809452b9198b40b862ca33149 [0,1,0,0,0,0|0,1,0]=2 44 B12R1.114 COc1ccc(c(c1)S)NCF aa1457a19054efb2d6a570d0cd701ce5 [0,1,0,0,0,0|1,1,1]=4 45 B12R1.114 COc1ccc(c(c1)S)NCO 442db8b050ce84584bffdaf8b207e17b [0,1,0,0,0,0|0,1,2]=4 46 B12R1.114 COc1ccc(c(n1)C)NC=O 4a12a717667e42744f6cb1d1f624bda7 [0,1,0,0,0,0|2,0,0]=3 47 B12R1.114 COc1ccc(c(n1)F)NC=O 8a6951ed91f2d3e97009b1963a1e33a1 [0,1,0,0,0,0|2,0,0]=3 48 B12R1.114 COc1cnc(c(c1)C)NC=O bbbe27af149c37a6197ee93b01b6976f [0,1,0,0,0,0|2,0,0]=3 49 B12R1.114 COc1cnc(c(c1)F)NC=O 1b7969dce01250dcc59b5ddd189defd4 [0,1,0,0,0,0|2,0,0]=3 50 B12R1.114 COc1ncc(c(n1)C)NC=O 491747f302895feb5de40e9c3ce0d763 [0,1,0,0,0,0|3,0,0]=4 51 B12R1.114 CSc1ccc(c(c1)C)NC=O 9a48d57394962e5bd02eb8767c1d8906 [0,1,0,0,0,0|1,1,0]=3 52 B12R1.114 CSc1ccc(c(c1)F)NC=O 3e5df1557c540d35270d1ac332a5fa8a [0,1,0,0,0,0|1,1,0]=3 53 B12R1.114 Cc1cc(ccc1NC=O)C#N 4e3a7c2565bbbcb754fe6258d0f2c706 [0,1,0,0,0,0|3,0,0]=4 54 B12R1.114 Cc1cc(ccc1NC=O)CO 1eda6d0a1c8db0a37801584a8075b1c2 [0,1,0,0,0,0|3,0,0]=4 55 B12R1.114 N#Cc1ccc(c(c1)Cl)NC=O 30a2da7a8b7f56bfe40d4bfb7723d6fb [0,1,0,0,0,0|3,0,0]=4 56 B12R1.114 N#Cc1ccc(c(c1)F)NC=O e52a346aec1fdacb958841dcac825386 [0,1,0,0,0,0|3,0,0]=4 57 B12R1.114 N#Cc1ccc(c(c1)I)NC=O 57cf478dda5f5beb7b9f1f39ce7f708a [0,1,0,0,0,0|3,0,0]=4 58 B12R1.114 O=CNc1ccc(cc1F)CO 53ec808293e8a892dc7d2ea6cb922367 [0,1,0,0,0,0|3,0,0]=4 59 B12R1.114 O=CNc1ccc(cc1I)CO 8ad5090b8c96903fc66dba1ef7fd642e [0,1,0,0,0,0|3,0,0]=4 60 B12R1.288 CCNc1ccc(c(c1)Br)C=O 453bfa34686a671bdab29003e2c4cec1 [0,1,0,0,0,0|2,0,0]=3 61 B12R1.288 CCNc1ccc(c(c1)Cl)C=O 1e58c995af2ed33eb148058b09c81fa8 [0,1,0,0,0,0|2,0,0]=3 62 B12R1.288 CCNc1ccc(c(c1)F)C=O 71fcbba248cbaacf38d87632f1239d49 [0,1,0,0,0,0|2,0,0]=3 63 B12R1.288 CCNc1ccc(c(n1)C)C=O 0fdab1966e064682d64bc1efd93a6e5e [0,1,0,0,0,0|3,0,0]=4 64 B12R1.288 CCOc1ccc(c(c1)Br)C#N a9f95230211e9240ac3a7e17aa95c0d6 [0,1,0,0,0,0|2,0,1]=4 65 B12R1.288 CCOc1ccc(c(c1)Br)C=O 2b1f24fade03fde71f80ba0e00389b3c [0,1,0,0,0,0|1,0,0]=2 66 B12R1.288 CCOc1ccc(c(c1)Br)CC 0599b6f3a186e3146a3c2faba5fd31a2 [0,1,0,0,0,0|2,0,1]=4 67 B12R1.288 CCOc1ccc(c(c1)Br)OC eb16c24b24c083bcaf5993d2501889d4 [0,1,0,0,0,0|3,0,0]=4 68 B12R1.288 CCOc1ccc(c(c1)C)C#N ca762e80bbf87768c52478c2b6df201c [0,1,0,0,0,0|2,0,1]=4 69 B12R1.288 CCOc1ccc(c(c1)C)C=O 9263f779ce60fda3ccf45ae44ec66185 [0,1,0,0,0,0|1,0,0]=2 70 B12R1.288 CCOc1ccc(c(c1)C)OC f971b9cac535e9e0fda2d524a5fae79d [0,1,0,0,0,0|3,0,0]=4 71 B12R1.288 CCOc1ccc(c(c1)C)SC 252c2c72e59ee2005a95a8e0003145af [0,1,0,0,0,0|3,0,0]=4 72 B12R1.288 CCOc1ccc(c(c1)Cl)C#N a2f619a1fec578b1f29afeec5f466360 [0,1,0,0,0,0|2,0,1]=4 73 B12R1.288 CCOc1ccc(c(c1)Cl)C=O 3cf78651626f3c17868c313afa6977ff [0,1,0,0,0,0|1,0,0]=2 74 B12R1.288 CCOc1ccc(c(c1)Cl)CC 47e969f863ce2ff770fe9bada1f606ac [0,1,0,0,0,0|2,0,1]=4 75 B12R1.288 CCOc1ccc(c(c1)Cl)OC 7c8d7fd4fe679eba974f97a0e07c291e [0,1,0,0,0,0|3,0,0]=4 76 B12R1.288 CCOc1ccc(c(c1)Cl)SC 102022007a76eab0c17e7ebebaaf4210 [0,1,0,0,0,0|3,0,0]=4 77 B12R1.288 CCOc1ccc(c(c1)F)C#N dfaa100664cac194210285e5b099cd26 [0,1,0,0,0,0|2,0,1]=4 78 B12R1.288 CCOc1ccc(c(c1)F)C=O 84906cc1f5a65aef3afc68446f39b7de [0,1,0,0,0,0|1,0,0]=2 79 B12R1.288 CCOc1ccc(c(c1)F)CC 582e827343e6e7e19cb2383c9ee0e209 [0,1,0,0,0,0|2,0,1]=4 80 B12R1.288 CCOc1ccc(c(c1)F)OC 707405be96b592f1043d3c2b907dd1f0 [0,1,0,0,0,0|3,0,0]=4 81 B12R1.288 CCOc1ccc(c(c1)F)SC 96b5caa783b465630eb5b13c4458e66d [0,1,0,0,0,0|3,0,0]=4 82 B12R1.288 CCOc1ccc(c(c1)I)C#N e8b19f58e5497ed45c642d89deb693f4 [0,1,0,0,0,0|2,0,1]=4 83 B12R1.288 CCOc1ccc(c(c1)I)C=O b6ba9b839a779b2f60d5dfa6145a5e72 [0,1,0,0,0,0|1,0,0]=2 84 B12R1.288 CCOc1ccc(c(c1)I)OC 16096f6739c9be9148f00d7d9077f5a3 [0,1,0,0,0,0|3,0,0]=4 85 B12R1.288 CCOc1cnc(c(c1)Cl)C=O 096edc7352f69b5c826080a0812e9382 [0,1,0,0,0,0|2,0,0]=3 86 B12R1.288 CCOc1cnc(c(c1)F)C=O 9dba18d811627b02b06856be88ea113b [0,1,0,0,0,0|2,0,0]=3 87 B12R1.288 CCc1ccc(cc1Br)OCF 0da854d84c5b3e09844d7067c3bfb36b [0,1,0,0,0,0|2,0,1]=4 88 B12R1.288 CCc1ccc(cc1Cl)OCF 3562445da8ab2aeced884ab6d2910200 [0,1,0,0,0,0|2,0,1]=4 89 B12R1.288 CCc1ccc(cc1F)OCF 6b6984cc921868cc2fd314ef8f38415e [0,1,0,0,0,0|2,0,1]=4 90 B12R1.288 COc1ccc(cc1Br)OCF a80d9cd3f97f0030a28147826a207e60 [0,1,0,0,0,0|3,0,0]=4 91 B12R1.288 COc1ccc(cc1C)OCF 9ff5b7ad6a8dc967133e6849b5c3d122 [0,1,0,0,0,0|3,0,0]=4 92 B12R1.288 COc1ccc(cc1Cl)OCF 81f62b41b0ede62978c0e281a880b4c3 [0,1,0,0,0,0|3,0,0]=4 93 B12R1.288 COc1ccc(cc1F)OCF 0e4cf4e58aaa38211af367f09a504b63 [0,1,0,0,0,0|3,0,0]=4 94 B12R1.288 COc1ccc(cc1I)OCF 4a59de0e97e9a9c47b8bd7f1837f96cb [0,1,0,0,0,0|3,0,0]=4 95 B12R1.288 CSc1ccc(cc1C)OCF de5647de2ed679d5b60ae8b7e174d82f [0,1,0,0,0,0|3,0,0]=4 96 B12R1.288 CSc1ccc(cc1Cl)OCF 160ca7b23d41c189d6f10c6dcbd5b445 [0,1,0,0,0,0|3,0,0]=4 97 B12R1.288 CSc1ccc(cc1F)OCF 441065bb0df910e50d1a45982dde46d7 [0,1,0,0,0,0|3,0,0]=4 98 B12R1.288 Cc1cc(ccc1C#N)OCF 4214c38ddd7f9ae017d08afa4473599b [0,1,0,0,0,0|2,0,1]=4 99 B12R1.288 Cc1cc(ccc1C=O)OCF 51d0f9c153ccc96248191a75c10d9a1a [0,1,0,0,0,0|1,0,0]=2 100 B12R1.288 Cc1nc(ccc1C=O)NCF 7a30533163d6c80cd65a1bc7b4f246de [0,1,0,0,0,0|3,0,0]=4 101 B12R1.288 Cc1nc(ccc1C=O)NCO 0f0b4729512f52a304bb1804c8fc7062 [0,1,0,0,0,0|3,0,0]=4 102 B12R1.288 N#Cc1ccc(cc1Br)OCF 66c5503bdf851e56aadb7bf1719bbe4c [0,1,0,0,0,0|2,0,1]=4 103 B12R1.288 N#Cc1ccc(cc1Cl)OCF 78e589ae1a57af1f76de0689fa0612a2 [0,1,0,0,0,0|2,0,1]=4 104 B12R1.288 N#Cc1ccc(cc1F)OCF c2a6005db82f3b6d7e29ba862f4daab7 [0,1,0,0,0,0|2,0,1]=4 105 B12R1.288 N#Cc1ccc(cc1I)OCF 11678c84055d9a6bd656c4390478c01b [0,1,0,0,0,0|2,0,1]=4 106 B12R1.288 O=CNc1ccc(c(c1)F)C=O d2c0fe4b075d11e5453938fd4438906c [0,1,0,0,0,0|2,0,1]=4 107 B12R1.288 O=Cc1ccc(cc1Br)NCF c948c3387474719215b79914f86a7f25 [0,1,0,0,0,0|2,0,0]=3 108 B12R1.288 O=Cc1ccc(cc1Br)NCO 104719d02cc1055c909c12c983734a27 [0,1,0,0,0,0|2,0,0]=3 109 B12R1.288 O=Cc1ccc(cc1Br)OCF 3d205eb00e05a01d947374e81f763eed [0,1,0,0,0,0|1,0,0]=2 110 B12R1.288 O=Cc1ccc(cc1Cl)NCF 335cb56735f871343bed76b26980ff38 [0,1,0,0,0,0|2,0,0]=3 111 B12R1.288 O=Cc1ccc(cc1Cl)NCO 0c0a187c54caaf006a051f8f9c79f860 [0,1,0,0,0,0|2,0,0]=3 112 B12R1.288 O=Cc1ccc(cc1Cl)OCF 8abc73d2f8637da08ad8210c9830113b [0,1,0,0,0,0|1,0,0]=2 113 B12R1.288 O=Cc1ccc(cc1F)NCF a054c642773b198722ecf11cba4f6512 [0,1,0,0,0,0|2,0,0]=3 114 B12R1.288 O=Cc1ccc(cc1F)NCO 4143d5ef18237b7b28b317cacfdd1ebb [0,1,0,0,0,0|2,0,0]=3 115 B12R1.288 O=Cc1ccc(cc1F)OCF 1bebfdcc48ec6573bf9f43c14a472d1d [0,1,0,0,0,0|1,0,0]=2 116 B12R1.288 O=Cc1ccc(cc1I)OCF 7312be805fb7914b36249cb62fad5288 [0,1,0,0,0,0|1,0,0]=2 117 B12R1.288 O=Cc1ncc(cc1Cl)OCF 1b12f01c879db55d570e48ce93877216 [0,1,0,0,0,0|2,0,0]=3 118 B12R1.288 O=Cc1ncc(cc1F)OCF 9fd69bc9d5fb864ac80e89b03d171ea4 [0,1,0,0,0,0|2,0,0]=3 119 B9R0.24 C=C(C=O)OCC(=C)OC 98831279f5e088d70f197796d78f1ec1 [1,0,1,0,0,0|1,0,1]=4 120 B11R1.83 C#Cc1ccc(cc1)NC=O 95370e205b84943a487b32541a22dd96 [1,1,0,0,0,0|1,0,1]=4 121 B11R1.83 C#Cc1ccc(cc1)OCC 7605fc1756b7b37617def1215e5772aa [1,1,0,0,0,0|1,0,1]=4 122 B11R1.83 C#Cc1ccc(cc1)OCF aee315f803dafc5530067ae9183b1e0d [1,1,0,0,0,0|1,0,1]=4 123 B11R1.83 C=Cc1ccc(cc1)NCC 817ec74810f825a0e36709628dff4396 [1,1,0,0,0,0|2,0,0]=4 124 B11R1.83 C=Cc1ccc(cc1)NCF 0a4b6dd3c2bcc6ff056575d646b45479 [1,1,0,0,0,0|2,0,0]=4 125 B11R1.83 C=Cc1ccc(cc1)NCO 38b24d34161eea2db824a391ffef5464 [1,1,0,0,0,0|2,0,0]=4 126 B11R1.83 C=Cc1ccc(cc1)OCC 2dfc252e05f2c69f9afd57ad07934f94 [1,1,0,0,0,0|1,0,0]=3 127 B11R1.83 C=Cc1ccc(cc1)OCF 1caa6521b77ee34492a62573e025620c [1,1,0,0,0,0|1,0,0]=3 128 B11R1.83 CCNc1ccc(cc1)C=O 5b1da36ecdd403f54386923bf3cd85f6 [1,1,0,0,0,0|1,0,0]=3 129 B11R1.83 CCNc1ccc(cc1)OC a4b97f177bf546e094eec7eb3e7f66dd [1,1,0,0,0,0|1,0,1]=4 130 B11R1.83 CCNc1ccc(cn1)C=O dd4312795d8088c2d75d58fa4a7fbc09 [1,1,0,0,0,0|2,0,0]=4 131 B11R1.83 CCNc1ccc(nc1)C=O e9ae26db13ed7f812a2c4aa039ca3f6c [1,1,0,0,0,0|2,0,0]=4 132 B11R1.83 CCOc1ccc(cc1)C#N 9b013ab74d3621a0af682769151817d3 [1,1,0,0,0,0|1,0,1]=4 133 B11R1.83 CCOc1ccc(cc1)C=O a91e11e6046c836fde6a9c8c50bcee5f [1,1,0,0,0,0|0,0,0]=2 134 B11R1.83 CCOc1ccc(cc1)CC 130be86bb5623a5d2837998dae082a29 [1,1,0,0,0,0|1,0,1]=4 135 B11R1.83 CCOc1ccc(cc1)N=O 225b842c68d4b1757d171cfe2fef0d02 [1,1,0,0,0,0|1,0,0]=3 136 B11R1.83 CCOc1ccc(cc1)OC 78aacf22e7f5ffe52b6720f42ae387fa [1,1,0,0,0,0|1,0,1]=4 137 B11R1.83 CCOc1ccc(cc1)SC 5d7f5467819db3ffd93e8fef63951787 [1,1,0,0,0,0|2,0,0]=4 138 B11R1.83 CCOc1ccc(cn1)C=O 3b8b64fa974f689fe9a33594fdaa0596 [1,1,0,0,0,0|1,0,0]=3 139 B11R1.83 CCOc1ccc(nc1)C=O 202597c6655fff3a69ca3db66d69956a [1,1,0,0,0,0|1,0,0]=3 140 B11R1.83 CCOc1ccc(nn1)C=O 4e29dcecb02e5059f2afcc4239a5eefc [1,1,0,0,0,0|2,0,0]=4 141 B11R1.83 CCOc1ncc(cn1)C=O 41202a4922bca945b17b16afac38237d [1,1,0,0,0,0|2,0,0]=4 142 B11R1.83 CCc1ccc(cc1)NC=O 3e8610d99c2c76fe0a620af2485f9af7 [1,1,0,0,0,0|1,0,0]=3 143 B11R1.83 CCc1ccc(cc1)OCF 7fda0752555f0e54fed3e99d547f54fb [1,1,0,0,0,0|1,0,1]=4 144 B11R1.83 CCc1ccc(cn1)NC=O 27d6453a5d8b728429751b40bd51b8df [1,1,0,0,0,0|2,0,0]=4 145 B11R1.83 CCc1ccc(nc1)NC=O 18bf2d8c4741781967fd58d448623b4c [1,1,0,0,0,0|2,0,0]=4 146 B11R1.83 COc1ccc(cc1)NC=O ac87369c17c8363b04f17408dd3a8237 [1,1,0,0,0,0|0,0,0]=2 147 B11R1.83 COc1ccc(cc1)NCF d45382bc213abd913ca6658bada7be75 [1,1,0,0,0,0|1,0,1]=4 148 B11R1.83 COc1ccc(cc1)NCO d05625bdde7ec9fe93b3548602d63490 [1,1,0,0,0,0|0,0,2]=4 149 B11R1.83 COc1ccc(cc1)OCF c57197c0057f1929b85da0b4d46da439 [1,1,0,0,0,0|1,0,1]=4 150 B11R1.83 COc1ccc(cn1)NC=O d82d033ac2ee0dd752f2c90ad770ea29 [1,1,0,0,0,0|1,0,0]=3 151 B11R1.83 COc1ccc(nc1)NC=O bf678dc9ba2fd7220284555df5bbb75b [1,1,0,0,0,0|1,0,0]=3 152 B11R1.83 COc1ccc(nn1)NC=O d57c50af40efbef5fe028e399ecea178 [1,1,0,0,0,0|2,0,0]=4 153 B11R1.83 COc1cnc(cn1)NC=O 18dcf3661b6cc15273eda845f3605595 [1,1,0,0,0,0|2,0,0]=4 154 B11R1.83 CSc1ccc(cc1)NC=O 9ba6c9bfa858e9ab1b1e9ea1b6cf97ce [1,1,0,0,0,0|0,1,0]=3 155 B11R1.83 CSc1ccc(cc1)OCF e48244d1e7ba47db5989fabc9a3a04ba [1,1,0,0,0,0|2,0,0]=4 156 B11R1.83 CSc1ccc(cn1)NC=O 0995d7efa9e1a7f8f39f3d0d10cb504d [1,1,0,0,0,0|1,1,0]=4 157 B11R1.83 N#Cc1ccc(cc1)OCF bcd0ae2cb5810bd40e4bba884acde04f [1,1,0,0,0,0|1,0,1]=4 158 B11R1.83 O=CNc1ccc(cc1)CO 02da734ee2802902e3cce3607911d666 [1,1,0,0,0,0|2,0,0]=4 159 B11R1.83 O=Cc1ccc(cc1)NCF 6e9507808f661692c4995ce01d7149d7 [1,1,0,0,0,0|1,0,0]=3 160 B11R1.83 O=Cc1ccc(cc1)NCO 5d1b19988396e75b9401946c178d10c0 [1,1,0,0,0,0|1,0,0]=3 161 B11R1.83 O=Cc1ccc(cc1)OCF 1650bb97f47d4d35a5c8149a03d0d3f8 [1,1,0,0,0,0|0,0,0]=2 162 B11R1.83 O=Cc1ccc(cn1)NCF 72bc126bbd4bfcffb3b226662f3e38c0 [1,1,0,0,0,0|2,0,0]=4 163 B11R1.83 O=Cc1ccc(cn1)NCO 788d6f4633f44c97a001f4d759d59a7c [1,1,0,0,0,0|2,0,0]=4 164 B11R1.83 O=Cc1ccc(cn1)OCF c94a6b209178c693c56e3e32144380b4 [1,1,0,0,0,0|1,0,0]=3 165 B11R1.83 O=Cc1ccc(nc1)NCF f1bfde05b648245a2d8978d1a14a3f7a [1,1,0,0,0,0|2,0,0]=4 166 B11R1.83 O=Cc1ccc(nc1)NCO 7224f6f28fcf8d6ba77bb1da54e1ed73 [1,1,0,0,0,0|2,0,0]=4 167 B11R1.83 O=Cc1ccc(nc1)OCF 10cafffee4c0f03191e10584fbcd9110 [1,1,0,0,0,0|1,0,0]=3 168 B11R1.83 O=Cc1ccc(nn1)OCF 8023d036d6e772af3543aa1f2257f039 [1,1,0,0,0,0|2,0,0]=4 169 B11R1.83 O=Cc1cnc(nc1)OCF cea295a9d67048c5cfc9951328f365b5 [1,1,0,0,0,0|2,0,0]=4 170 B11R1.83 O=Nc1ccc(cc1)OCF 4703797660d3f0cf5ebd83d127a70814 [1,1,0,0,0,0|1,0,0]=3 171 B11R1.81 Cc1cc(c(cn1)NC=O)C aa559f65cc3b04bda398c762c5a16ae0 [1,1,0,0,0,0|2,0,0]=4 172 B11R1.81 Cc1cc(ccc1NC=O)Br a14c8f63c02869bdefa30389334bcad0 [1,1,0,0,0,0|2,0,0]=4 173 B11R1.81 Cc1cc(ccc1NC=O)Cl 4d05bf92999ccd30d51cff03ca62b414 [1,1,0,0,0,0|2,0,0]=4 174 B11R1.81 Cc1cc(ccc1NC=O)F b01ac417cb369e62beaff6a510b377b2 [1,1,0,0,0,0|2,0,0]=4 175 B11R1.81 Cc1cc(ccc1NC=O)I 4ab2bff99ec869eb81321f0901f309a7 [1,1,0,0,0,0|2,0,0]=4 176 B11R1.81 Cc1cc(ccc1NC=O)O b1b23157ed1fe99a4c2eda65412ec059 [1,1,0,0,0,0|1,0,0]=3 177 B11R1.81 Cc1ccc(c(c1)C)NC=O b6de18d6a5af664cf7380b594d55222f [1,1,0,0,0,0|1,0,0]=3 178 B11R1.81 Cc1ccc(c(c1)F)NC=O 69fcfd4caa06192a19152662c4d96683 [1,1,0,0,0,0|1,0,0]=3 179 B11R1.81 Cc1ccc(c(c1)I)NC=O 1fffdd066788e8f79f9621c7bc8c55f9 [1,1,0,0,0,0|1,0,0]=3 180 B11R1.81 Cc1ccc(c(c1)S)NC=O dc1b5e412e375e54febfa038f02f3bd5 [1,1,0,0,0,0|0,1,0]=3 181 B11R1.81 Cc1ccc(c(n1)C)NC=O 5b8bac8a227c0e36b9312b997cfd0930 [1,1,0,0,0,0|2,0,0]=4 182 B11R1.81 Cc1ccc(c(n1)F)NC=O 8a18c7cec5e43a3093bc9678f6bb1b6f [1,1,0,0,0,0|2,0,0]=4 183 B11R1.81 Cc1ccc(c(n1)I)NC=O 2d4df375451a39906922bc63e8aa198f [1,1,0,0,0,0|2,0,0]=4 184 B11R1.81 Cc1cnc(c(c1)C)NC=O 35148d112061a6a7d0f84521a8336acf [1,1,0,0,0,0|2,0,0]=4 185 B11R1.81 Cc1cnc(c(c1)I)NC=O a4d8c7a2f573cee070a5e05f446bd68a [1,1,0,0,0,0|2,0,0]=4 186 B11R1.81 O=CNc1ccc(cc1Br)F 313eaeb5ac4dc8568341739df0de2d9b [1,1,0,0,0,0|2,0,0]=4 187 B11R1.81 O=CNc1ccc(cc1Cl)F 8579f70a3f97f97113b326a2628e39af [1,1,0,0,0,0|2,0,0]=4 188 B11R1.81 O=CNc1ccc(cc1F)Br fa18699bbca32e20a6dd2f24fb56cb5e [1,1,0,0,0,0|2,0,0]=4 189 B11R1.81 O=CNc1ccc(cc1F)Cl b0c30aa833402fa64daba1bdf41512b3 [1,1,0,0,0,0|2,0,0]=4 190 B11R1.81 O=CNc1ccc(cc1F)F 316d04d0fa316125e1a04f62019182f0 [1,1,0,0,0,0|2,0,0]=4 191 B11R1.81 O=CNc1ccc(cc1F)I 391219c33e81c98e1671f27e5e226a8c [1,1,0,0,0,0|2,0,0]=4 192 B11R1.81 O=CNc1ccc(cc1F)O 04e5c7b376bfb362c264ab1bfa3bb083 [1,1,0,0,0,0|1,0,0]=3 193 B11R1.81 O=CNc1ccc(cc1F)S 82a11c278ccf10668fe2abc4e055c6ce [1,1,0,0,0,0|1,1,0]=4 194 B11R1.81 O=CNc1ccc(cc1I)Br 4b3c3242e23ef6a1e8fb2ba8362bb2ce [1,1,0,0,0,0|2,0,0]=4 195 B11R1.81 O=CNc1ccc(cc1I)Cl b1f558f34df55b4c6408d6c2bffd833c [1,1,0,0,0,0|2,0,0]=4 196 B11R1.81 O=CNc1ccc(cc1I)F 1be581b076b70460377cd8aa49172c8c [1,1,0,0,0,0|2,0,0]=4 197 B11R1.81 O=CNc1ccc(cc1I)I 770895b646852a2840e8c8ac01a74f30 [1,1,0,0,0,0|2,0,0]=4 198 B11R1.81 O=CNc1ccc(cc1I)O 2dfd90a41cfbe025b74df96f76a333fc [1,1,0,0,0,0|1,0,0]=3 199 B11R1.81 O=CNc1ccc(cc1S)Cl f101ddc6a1ab9ad9fa139eaaed37c01a [1,1,0,0,0,0|1,1,0]=4 200 B11R1.81 O=CNc1ccc(cc1S)F 98473b8e805f79a94d1e29da62a2a9f4 [1,1,0,0,0,0|1,1,0]=4 201 B11R1.192 CCOc1ccc(=O)n(c1)C a59f758da331db52f57c6e627d57a90d [1,1,0,0,0,0|2,0,0]=4 202 B11R1.192 CCOc1ccc(c(c1)Br)C c3fa0783af9069842b29e34011d9eedf [1,1,0,0,0,0|1,0,1]=4 203 B11R1.192 CCOc1ccc(c(c1)Br)Cl 4f0ed120a1ee615029f12cbea4548666 [1,1,0,0,0,0|2,0,0]=4 204 B11R1.192 CCOc1ccc(c(c1)Br)F 8317d8ea93a771cf8540cce81252fc34 [1,1,0,0,0,0|2,0,0]=4 205 B11R1.192 CCOc1ccc(c(c1)Br)I 3638452f604979a63bdbbb3f47c7bce6 [1,1,0,0,0,0|2,0,0]=4 206 B11R1.192 CCOc1ccc(c(c1)C)Br 2f8760d774c221ba0b75202a149df4a7 [1,1,0,0,0,0|2,0,0]=4 207 B11R1.192 CCOc1ccc(c(c1)C)C 7c13671d5cf41e9521a3f6c1c086f138 [1,1,0,0,0,0|1,0,1]=4 208 B11R1.192 CCOc1ccc(c(c1)C)Cl 7346f6124d85dbd041e5b5350d182eea [1,1,0,0,0,0|2,0,0]=4 209 B11R1.192 CCOc1ccc(c(c1)C)F 6cd22ed088f5f11a14ea789326e0325e [1,1,0,0,0,0|2,0,0]=4 210 B11R1.192 CCOc1ccc(c(c1)C)I a03a60fe749aeffceb2c403c998cb192 [1,1,0,0,0,0|2,0,0]=4 211 B11R1.192 CCOc1ccc(c(c1)Cl)Br c809194834464760f77edc97f5de3566 [1,1,0,0,0,0|2,0,0]=4 212 B11R1.192 CCOc1ccc(c(c1)Cl)C b9c6c330e241f9f510a1f16392209827 [1,1,0,0,0,0|1,0,1]=4 213 B11R1.192 CCOc1ccc(c(c1)Cl)Cl 2798272357dad9b212e6d8b7d4379471 [1,1,0,0,0,0|2,0,0]=4 214 B11R1.192 CCOc1ccc(c(c1)Cl)F 13b1e52752cbecc6dcaae6e7ab50e34b [1,1,0,0,0,0|2,0,0]=4 215 B11R1.192 CCOc1ccc(c(c1)Cl)I fe8fc6e558656d33644e2803f8575fc7 [1,1,0,0,0,0|2,0,0]=4 216 B11R1.192 CCOc1ccc(c(c1)F)Br 018c0efa52a1229f5067ca1a49239d76 [1,1,0,0,0,0|2,0,0]=4 217 B11R1.192 CCOc1ccc(c(c1)F)C 129ed8ddceee4b9535caa3063c04873c [1,1,0,0,0,0|1,0,1]=4 218 B11R1.192 CCOc1ccc(c(c1)F)Cl 8d00421ccb733d77332174a0dd4ef20b [1,1,0,0,0,0|2,0,0]=4 219 B11R1.192 CCOc1ccc(c(c1)F)F 61c3c27deb4a70da8e4ccbb37f501a6a [1,1,0,0,0,0|2,0,0]=4 220 B11R1.192 CCOc1ccc(c(c1)F)I 3a13a2aea8562ef037eb2187d189e311 [1,1,0,0,0,0|2,0,0]=4 221 B11R1.192 CCOc1ccc(c(c1)I)Br 47389b67a67965e45a09650518635b0a [1,1,0,0,0,0|2,0,0]=4 222 B11R1.192 CCOc1ccc(c(c1)I)C 5a5d331dbfa5df8a5cc3e002f1549f7c [1,1,0,0,0,0|1,0,1]=4 223 B11R1.192 CCOc1ccc(c(c1)I)Cl f89058fe7b979c7def89cf4fa173aa78 [1,1,0,0,0,0|2,0,0]=4 224 B11R1.192 CCOc1ccc(c(c1)I)F 761d3a707ffa85c5b5b8f5c4680e6ec2 [1,1,0,0,0,0|2,0,0]=4 225 B11R1.192 Cc1cc(ccc1Br)OCF 42d348dc28c750e8392a3f3c6346fe4a [1,1,0,0,0,0|2,0,0]=4 226 B11R1.192 Cc1cc(ccc1Cl)OCF 7ad2292d4f475137ba2729be0a68d16b [1,1,0,0,0,0|2,0,0]=4 227 B11R1.192 Cc1cc(ccc1F)OCF 767ee4e3654f5f9073e70307c4b29cb2 [1,1,0,0,0,0|2,0,0]=4 228 B11R1.192 Cc1cc(ccc1I)OCF 5b9bf26be79690fc521cf935b98eb974 [1,1,0,0,0,0|2,0,0]=4 229 B11R1.192 Cc1ccc(cc1Br)OCF c5d1d06e767ad00e4abf57bd0e190090 [1,1,0,0,0,0|1,0,1]=4 230 B11R1.192 Cc1ccc(cc1C)OCF ee1f69fdab5d44bf2b0982521e0bf5a5 [1,1,0,0,0,0|1,0,1]=4 231 B11R1.192 Cc1ccc(cc1Cl)OCF f9e4c182b29f2c6bc7b0c123ab3402de [1,1,0,0,0,0|1,0,1]=4 232 B11R1.192 Cc1ccc(cc1F)OCF 3c15af622ffb6507f2d5c144b91e4053 [1,1,0,0,0,0|1,0,1]=4 233 B11R1.192 Cc1ccc(cc1I)OCF b4951cea89d09c03399ed8c3ba816946 [1,1,0,0,0,0|1,0,1]=4 234 B11R1.192 Cn1cc(ccc1=O)OCF cfd574f133fe5bb70e3f98b676f9e480 [1,1,0,0,0,0|2,0,0]=4 235 B11R1.192 FCOc1ccc(c(c1)Br)Br 0d088565d8cedfe01b2562d33766b319 [1,1,0,0,0,0|2,0,0]=4 236 B11R1.192 FCOc1ccc(c(c1)Br)Cl e093d0a27048d0e8f3bdc4fb0fd8cf69 [1,1,0,0,0,0|2,0,0]=4 237 B11R1.192 FCOc1ccc(c(c1)Br)F 8e8d906d51f1f08c48f8fa5c3a88a9bf [1,1,0,0,0,0|2,0,0]=4 238 B11R1.192 FCOc1ccc(c(c1)Br)I f81d5f4059e0aef3f4bb3acad049e7b2 [1,1,0,0,0,0|2,0,0]=4 239 B11R1.192 FCOc1ccc(c(c1)Cl)Br 11fa98e92fc3b0afc3bc1f075f16c806 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.192 FCOc1ccc(c(c1)Cl)Cl e18c6f057ea999c31ba04f3f26b9ad12 [1,1,0,0,0,0|2,0,0]=4 241 B11R1.192 FCOc1ccc(c(c1)Cl)F 2d11504198f1edfd2b4a4c10da7e872b [1,1,0,0,0,0|2,0,0]=4 242 B11R1.192 FCOc1ccc(c(c1)Cl)I 06a5c57eb992e79d4115e12356306f77 [1,1,0,0,0,0|2,0,0]=4 243 B11R1.192 FCOc1ccc(c(c1)F)Br 557bdd2051d5a50c687f79c03910e2e3 [1,1,0,0,0,0|2,0,0]=4 244 B11R1.192 FCOc1ccc(c(c1)F)Cl 1eaedc5314a211b3ab3bfb339b05d8d4 [1,1,0,0,0,0|2,0,0]=4 245 B11R1.192 FCOc1ccc(c(c1)F)F 14f11b9990ddf987fac6e777c89182f4 [1,1,0,0,0,0|2,0,0]=4 246 B11R1.192 FCOc1ccc(c(c1)F)I 8543be26079c3f0f9399d5a89a1f8cbd [1,1,0,0,0,0|2,0,0]=4 247 B11R1.192 FCOc1ccc(c(c1)I)Br 1a99517c56a7dade9ddd7d53a856206e [1,1,0,0,0,0|2,0,0]=4 248 B11R1.192 FCOc1ccc(c(c1)I)Cl 94a7002f329c2655a54f1a8c864e512e [1,1,0,0,0,0|2,0,0]=4 249 B11R1.192 FCOc1ccc(c(c1)I)F 5597a9bf6b5ebb3c8e4b2b7c0601d2ed [1,1,0,0,0,0|2,0,0]=4 250 B13R1.144 CC(=O)c1ccc(c(c1)Br)NC=O 058e0462431a9d750567ab4fafe70cc3 [0,2,0,0,0,0|2,0,0]=4 251 B13R1.144 CC(=O)c1ccc(c(c1)C)NC=O 15819ba50f3656c937ca5f77d00b5436 [0,2,0,0,0,0|2,0,0]=4 252 B13R1.144 CC(=O)c1ccc(c(c1)Cl)NC=O 0bfee33320ae06e0fdf7800ac21dd3f1 [0,2,0,0,0,0|2,0,0]=4 253 B13R1.144 CC(=O)c1ccc(c(c1)F)NC=O 4364940e766b80001652a9f193f115c1 [0,2,0,0,0,0|2,0,0]=4 254 B13R1.144 CC(=O)c1ccc(c(c1)I)NC=O 3947d66582eb7204bef08aab1d321824 [0,2,0,0,0,0|2,0,0]=4 255 B13R1.144 CC(=O)c1ccc(c(c1)O)NC=O ac8d9c4a6a24147306d572b92ee5eaa5 [0,2,0,0,0,0|1,0,0]=3 256 B13R1.144 CC(C)c1ccc(c(c1)Br)NC=O 74d37f998e9340a7b86af2604d1e4134 [0,2,0,0,0,0|2,0,0]=4 257 B13R1.144 CC(C)c1ccc(c(c1)Cl)NC=O 2e822b1492175e846721ea5d8f00a148 [0,2,0,0,0,0|2,0,0]=4 258 B13R1.144 CC(C)c1ccc(c(c1)F)NC=O 960ddeaf45b427cfa7ae8559da99cabd [0,2,0,0,0,0|2,0,0]=4 259 B13R1.144 CC(C)c1ccc(c(c1)I)NC=O ae3197695d41ddff9426f9220c914a3f [0,2,0,0,0,0|2,0,0]=4 260 B13R1.144 CC(C)c1ccc(c(c1)O)NC=O 4a8c771fe793d582f9bfa701f8b60f35 [0,2,0,0,0,0|1,0,0]=3 261 B13R1.144 CN(C)c1ccc(c(c1)Br)NC=O 63d907d032e5246893aaf09870f64e10 [0,2,0,0,0,0|2,0,0]=4 262 B13R1.144 CN(C)c1ccc(c(c1)F)NC=O c6527797b538698dbeea79e682023bd4 [0,2,0,0,0,0|2,0,0]=4 263 B13R1.355 CCNc1cc(ccc1C=O)OC b079b4e458bce577da769211c03f9333 [0,2,0,0,0,0|1,0,0]=3 264 B13R1.355 CCNc1nc(ccc1C=O)OC 47e5593d31c48211c9d1c8d3b0a29be4 [0,2,0,0,0,0|2,0,0]=4 265 B13R1.355 CCOc1cc(ccc1C#N)OC 1f70d8341b5b9f4fc6766dee0f5a7562 [0,2,0,0,0,0|1,0,1]=4 266 B13R1.355 CCOc1cc(ccc1C=O)C#N d5d14aa8634c7bdcf8d14fdfbffc3f58 [0,2,0,0,0,0|2,0,0]=4 267 B13R1.355 CCOc1cc(ccc1C=O)C=O b1108d415860f8c5a5a43a26a00d6a70 [0,2,0,0,0,0|2,0,0]=4 268 B13R1.355 CCOc1cc(ccc1C=O)CC 53c4a6475c85fac0dab77a0bdc9570ae [0,2,0,0,0,0|1,0,0]=3 269 B13R1.355 CCOc1cc(ccc1C=O)OC 3081fed86a6cf50c8284d51164b486a5 [0,2,0,0,0,0|0,0,0]=2 270 B13R1.355 CCOc1cc(ccc1CC)OC 73bb3c161abb9aa45f3f9b2c2db7c178 [0,2,0,0,0,0|1,0,1]=4 271 B13R1.355 CCOc1cc(ccc1N=O)OC 573988fdd6a5dc2ad16e4a1d9764fcc3 [0,2,0,0,0,0|1,0,0]=3 272 B13R1.355 CCOc1cc(ccc1OC)OC e94c407ea1ef17ce579ebd08526c7a04 [0,2,0,0,0,0|2,0,0]=4 273 B13R1.355 CCc1ccc(c(c1)OCF)C=O 78e2ccbf7d17d941fd79ff32f6f2e402 [0,2,0,0,0,0|1,0,0]=3 274 B13R1.355 CCc1ccc(cc1NCO)OC cec582c714ef4747c45fb1051057c605 [0,2,0,0,0,0|1,0,1]=4 275 B13R1.355 CCc1ccc(cc1OCF)OC 3ef49268137b8996e91b85916df6c522 [0,2,0,0,0,0|1,0,1]=4 276 B13R1.355 COc1ccc(c(c1)NCF)C=O 51fad26e8b8ce36af519df91c9df3b17 [0,2,0,0,0,0|1,0,0]=3 277 B13R1.355 COc1ccc(c(c1)NCO)C#N 5260c2f3eee06b259cbd6576c6d55714 [0,2,0,0,0,0|1,0,1]=4 278 B13R1.355 COc1ccc(c(c1)NCO)C=O 92ff47699931c60585739816c7aea470 [0,2,0,0,0,0|0,0,0]=2 279 B13R1.355 COc1ccc(c(c1)NCO)CO d9ea0aa864ee540bb4b4cfa26c9a1c98 [0,2,0,0,0,0|0,0,2]=4 280 B13R1.355 COc1ccc(c(c1)NCO)OC 779b11b8d8915d136e5a8647bf014fcd [0,2,0,0,0,0|2,0,0]=4 281 B13R1.355 COc1ccc(c(c1)OCF)C#N 16633ad9a6fd125b9296a6cee8d10380 [0,2,0,0,0,0|1,0,1]=4 282 B13R1.355 COc1ccc(c(c1)OCF)C=O 3f94a7c2d1e873c72cbf77f227cc1b9d [0,2,0,0,0,0|0,0,0]=2 283 B13R1.355 COc1ccc(c(c1)OCF)N=O aec6ec45a751030fd2181d197dc59dc5 [0,2,0,0,0,0|1,0,0]=3 284 B13R1.355 COc1ccc(c(c1)OCF)OC 149c50acd73462f0722c8c015460397e [0,2,0,0,0,0|2,0,0]=4 285 B13R1.355 COc1ccc(c(n1)NC=O)C=O f1503aebff6a5405dbd683f3e0833c17 [0,2,0,0,0,0|1,0,1]=4 286 B13R1.355 COc1ccc(c(n1)NCF)C=O 72f4c574fe7a4d5f8b7c5b7e6ee3b875 [0,2,0,0,0,0|2,0,0]=4 287 B13R1.355 COc1ccc(c(n1)NCO)C=O a24b9e50a2c6831856f400b907d8720f [0,2,0,0,0,0|1,0,0]=3 288 B13R1.355 COc1ncc(c(n1)NCO)C=O 92885a47b2fb66a97bfb7ccbee57867e [0,2,0,0,0,0|2,0,0]=4 289 B13R1.355 N#Cc1ccc(c(c1)OCF)C=O 64876183a7e29031639f07b40b705d8a [0,2,0,0,0,0|2,0,0]=4 290 B13R1.355 O=Cc1ccc(c(c1)OCF)C=O a434b92a4280abecc196d350ba0ae41d [0,2,0,0,0,0|2,0,0]=4 291 B13R1.386 C#Cc1ccc(cc1OC)OCC cf56e5cc0ce6c347b3fc1a9a1ba60907 [0,2,0,0,0,0|1,0,1]=4 292 B13R1.386 C#Cc1ccc(cc1OC)OCF 9c82262f6919f49336b3bce5cfa1d525 [0,2,0,0,0,0|1,0,1]=4 293 B13R1.386 CCNc1ccc(c(c1)OC)C=O e1cdf7402b505d38161923ae590b7ff9 [0,2,0,0,0,0|1,0,0]=3 294 B13R1.386 CCOc1ccc(c(c1)C=O)C=O 1b32a426b032dad2298d05da34edfe88 [0,2,0,0,0,0|0,0,1]=3 295 B13R1.386 CCOc1ccc(c(c1)OC)C#N 03cbf55c1e134ca7e8712d55f5621600 [0,2,0,0,0,0|1,0,1]=4 296 B13R1.386 CCOc1ccc(c(c1)OC)C=O 22f90f5e8450e6fc1809ab5dd73eee65 [0,2,0,0,0,0|0,0,0]=2 297 B13R1.386 CCOc1ccc(c(c1)OC)OC 6c73ed6ffafed6354ae8d7226fe80afa [0,2,0,0,0,0|2,0,0]=4 298 B13R1.386 COc1cc(ccc1C#N)OCF ad2117fb155e40fa24cde53b9f21df0c [0,2,0,0,0,0|1,0,1]=4 299 B13R1.386 COc1cc(ccc1C=O)NCF 43a3166edd19c385b1e718c4e5498273 [0,2,0,0,0,0|1,0,0]=3 300 B13R1.386 COc1cc(ccc1C=O)NCO b0c6ebf11a90bf40b3a7e05d90bda86b [0,2,0,0,0,0|1,0,0]=3 301 B13R1.386 COc1cc(ccc1C=O)OCF 4db40c5720c6876a89dab7978c04c104 [0,2,0,0,0,0|0,0,0]=2 302 B13R1.386 COc1ccc(cc1OC)OCF 4f4bf9dcbab53167ab02d620affea61b [0,2,0,0,0,0|2,0,0]=4 303 B13R1.386 O=Cc1ccc(cc1C=O)OCF 2d58ae50531ec6ae3be8de0127915b97 [0,2,0,0,0,0|0,0,1]=3 304 B13R1.1249 C#Cc1cc(ccc1NC=O)OC 1a5225ca232260a45ab9cee0bf97de96 [0,2,0,0,0,0|1,0,0]=3 305 B13R1.1249 C=Cc1cc(ccc1NC=O)OC 25b34920a265dd044781d72b86ea6671 [0,2,0,0,0,0|1,0,0]=3 306 B13R1.1249 CCNc1ccc(cc1CO)OC 935e780a2e5516c3054a7addf8753e45 [0,2,0,0,0,0|1,0,1]=4 307 B13R1.1249 CCNc1ccc(cc1OC)OC f64b97b027636d5172ee22e0739ab06d [0,2,0,0,0,0|1,0,1]=4 308 B13R1.1249 CCOc1ccc(cc1OC)OC b35a9fe74ae0c00519195c1ff739e09d [0,2,0,0,0,0|1,0,1]=4 309 B13R1.1249 CCc1ccc(c(c1)C#N)NC=O e6616c9fcbf65a8d71eca111fa6d7bac [0,2,0,0,0,0|2,0,0]=4 310 B13R1.1249 CCc1ccc(c(c1)CC)NC=O 9c1139f7107f301807a6178843383eca [0,2,0,0,0,0|2,0,0]=4 311 B13R1.1249 CCc1nc(ccc1NC=O)OC 6afb79e87bc32a092a7da3de1c9dc7fb [0,2,0,0,0,0|2,0,0]=4 312 B13R1.1249 COc1cc(c(cn1)NC=O)C=O 0fbda99b113535b09236db6dccb8975b [0,2,0,0,0,0|1,0,1]=4 313 B13R1.1249 COc1cc(ccc1NC=O)CO be28ef5e50d5f8f81378f93703c42849 [0,2,0,0,0,0|2,0,0]=4 314 B13R1.1249 COc1ccc(c(c1)C#N)NC=O 2255d27d8ba15a13acf3debd51bb9a70 [0,2,0,0,0,0|1,0,0]=3 315 B13R1.1249 COc1ccc(c(c1)CO)NC=O 49d18cc7b3473266db8cab99dba93298 [0,2,0,0,0,0|0,0,0]=2 316 B13R1.1249 COc1ccc(c(c1)CO)NCF fcc07986ec1757f109ed101e88dc66d8 [0,2,0,0,0,0|1,0,1]=4 317 B13R1.1249 COc1ccc(c(c1)CO)NCO ef452b38d7e2f4ab510f303889233e0f [0,2,0,0,0,0|0,0,2]=4 318 B13R1.1249 COc1ccc(c(c1)OC)NC=O e58b957e4e08f533b7cf315edc423ea7 [0,2,0,0,0,0|0,0,0]=2 319 B13R1.1249 COc1ccc(c(c1)OC)NCF da0afdc1d2cc3cadfc5cfeaaecbbcbca [0,2,0,0,0,0|1,0,1]=4 320 B13R1.1249 COc1ccc(c(c1)OC)NCO 46a824a95dcd23f9496c2e7b15da8d73 [0,2,0,0,0,0|0,0,2]=4 321 B13R1.1249 COc1ccc(c(c1)OC)OCF 36a3515cb9e24ea25627062b676e23d8 [0,2,0,0,0,0|1,0,1]=4 322 B13R1.1249 COc1cnc(c(c1)OC)NC=O 51c4874737cb30000c0760382f8d8faa [0,2,0,0,0,0|1,0,0]=3 323 B13R1.75 C=CCNc1ccc(cc1Br)OC 57ef9279161f1b8daccd578a9ccb22f6 [0,2,0,0,0,0|2,0,0]=4 324 B13R1.75 C=CCNc1ccc(cc1C)OC 109869949a1ba7f1b4d30e0e903c56a7 [0,2,0,0,0,0|2,0,0]=4 325 B13R1.75 C=CCNc1ccc(cc1Cl)OC 2f60c72066d72a512a60a0f5feeeeb97 [0,2,0,0,0,0|2,0,0]=4 326 B13R1.75 C=CCNc1ccc(cc1F)OC c541b9006381bdf3565a8ff7f71b4f49 [0,2,0,0,0,0|2,0,0]=4 327 B13R1.75 C=CCNc1ccc(cc1I)OC 218b3a93d2c540cdf88d9ddaa3f63739 [0,2,0,0,0,0|2,0,0]=4 328 B13R1.75 C=CCNc1ccc(cc1S)OC d2794346ad8cee40feef65ffd08766e6 [0,2,0,0,0,0|1,1,0]=4 329 B13R1.75 C=CCOc1ccc(cc1Br)OC e1e25fb3bf16b59e1728b2423cd01438 [0,2,0,0,0,0|2,0,0]=4 330 B13R1.75 C=CCOc1ccc(cc1C)OC e156677e87516f921bdacd72e1d28efa [0,2,0,0,0,0|2,0,0]=4 331 B13R1.75 C=CCOc1ccc(cc1Cl)OC a93f8f5e8417b3918e1432f722a5f9ea [0,2,0,0,0,0|2,0,0]=4 332 B13R1.75 C=CCOc1ccc(cc1F)OC 9ed9a2487529917ac232b827945541a5 [0,2,0,0,0,0|2,0,0]=4 333 B13R1.75 C=CCOc1ccc(cc1I)OC a4305903993c79898dcda9b494ecb7b6 [0,2,0,0,0,0|2,0,0]=4 334 B13R1.75 CCc1ccc(c(c1)Br)NCC=O f44cc25ab9481e03ba77c483257294e3 [0,2,0,0,0,0|2,0,0]=4 335 B13R1.75 CCc1ccc(c(c1)Br)OCC=O 2fd3f98a5cc7a71072abb7593614a017 [0,2,0,0,0,0|2,0,0]=4 336 B13R1.75 CCc1ccc(c(c1)C)NCC=O 1148244457a059552f136e2742dc5ca4 [0,2,0,0,0,0|2,0,0]=4 337 B13R1.75 CCc1ccc(c(c1)C)OCC=O da02c3cdabdfba478e59c015085cf426 [0,2,0,0,0,0|2,0,0]=4 338 B13R1.75 CCc1ccc(c(c1)Cl)NCC=O e10aa69d26b69a566fb50090aa320a87 [0,2,0,0,0,0|2,0,0]=4 339 B13R1.75 CCc1ccc(c(c1)Cl)OCC=O a0776e811489e9deb5646e6d5162a89c [0,2,0,0,0,0|2,0,0]=4 340 B13R1.75 CCc1ccc(c(c1)F)NCC=O d637829a1256799e22e6fedf50093c73 [0,2,0,0,0,0|2,0,0]=4 341 B13R1.75 CCc1ccc(c(c1)I)NCC=O fd8176cdf2ed588c1aa0056ff029f51b [0,2,0,0,0,0|2,0,0]=4 342 B13R1.75 COc1cc(c(cn1)NCC=O)C 1294d2d37000d2507e0b19f5d9a2ab8b [0,2,0,0,0,0|2,0,0]=4 343 B13R1.75 COc1cc(c(cn1)NCC=O)Cl 29e5527a7dbb048032e9575d2aa5c89c [0,2,0,0,0,0|2,0,0]=4 344 B13R1.75 COc1cc(c(cn1)OCC=O)C 77ff3e8aba60272319fab2f8b9f4e18a [0,2,0,0,0,0|2,0,0]=4 345 B13R1.75 COc1cc(c(cn1)OCC=O)I c5672dd68059cf1956c90eecc53f696e [0,2,0,0,0,0|2,0,0]=4 346 B13R1.75 COc1ccc(c(c1)Br)NCC=O b51e2653d22fa8eebd6a3f4149bea767 [0,2,0,0,0,0|1,0,0]=3 347 B13R1.75 COc1ccc(c(c1)Br)OCC=O 76c61018b89695cb8ce62a867c7678d4 [0,2,0,0,0,0|1,0,0]=3 348 B13R1.75 COc1ccc(c(c1)C)CNC=O 56ec7cb188702beb88358a5b67c335dc [0,2,0,0,0,0|1,0,0]=3 349 B13R1.75 COc1ccc(c(c1)C)NCC=O 7d0dbf78d8e2ef1e6dd395ace88d3287 [0,2,0,0,0,0|1,0,0]=3 350 B13R1.75 COc1ccc(c(c1)C)OCC=O 0c92794a1a0cc966d24e08bbee1395c7 [0,2,0,0,0,0|1,0,0]=3 351 B13R1.75 COc1ccc(c(c1)Cl)CNC=O 80f435d2e4cf6bcdb41b9d580d78642a [0,2,0,0,0,0|1,0,0]=3 352 B13R1.75 COc1ccc(c(c1)Cl)NCC=O b24c60e0820510028ee08e3ec614451c [0,2,0,0,0,0|1,0,0]=3 353 B13R1.75 COc1ccc(c(c1)Cl)OCC=O 130c3fb65a0d0e4ed333aad03cfac55c [0,2,0,0,0,0|1,0,0]=3 354 B13R1.75 COc1ccc(c(c1)F)CNC=O 62dc3714cc58664c6612e69510b834b9 [0,2,0,0,0,0|1,0,0]=3 355 B13R1.75 COc1ccc(c(c1)F)NCC=O c0cd10392b0a089d3c628a72ec6a0c38 [0,2,0,0,0,0|1,0,0]=3 356 B13R1.75 COc1ccc(c(c1)F)OCC=O ffeda06e22807f2ef9bb8829a364a8fc [0,2,0,0,0,0|1,0,0]=3 357 B13R1.75 COc1ccc(c(c1)I)NCC=O c36ab9a14e07cddedb54cb88810118dc [0,2,0,0,0,0|1,0,0]=3 358 B13R1.75 COc1ccc(c(c1)I)OCC=O 02a50b1d293bf8bdb1928ec8b2f41dde [0,2,0,0,0,0|1,0,0]=3 359 B13R1.75 COc1ccc(c(c1)S)NCC=O d25d0d2f6387c4bef9e29325ea0c91ef [0,2,0,0,0,0|0,1,0]=3 360 B13R1.75 COc1ccc(c(n1)Br)CNC=O b30426fe8df2ed3ce99716ea16aaabf7 [0,2,0,0,0,0|2,0,0]=4 361 B13R1.75 COc1ccc(c(n1)Br)NCC=O 6c505e1def38b6e5e8e26718cee7ba0a [0,2,0,0,0,0|2,0,0]=4 362 B13R1.75 COc1ccc(c(n1)Br)OCC=O bda644d029e08b7e08347613ebbffde8 [0,2,0,0,0,0|2,0,0]=4 363 B13R1.75 COc1ccc(c(n1)C)CNC=O 0f5f975057abf44e482c1a1e5f253786 [0,2,0,0,0,0|2,0,0]=4 364 B13R1.75 COc1ccc(c(n1)C)NCC=O d709211d471fbc70bf30151a8bdaf30b [0,2,0,0,0,0|2,0,0]=4 365 B13R1.75 COc1ccc(c(n1)C)OCC=O 1d3042173e773a7fc35b84d08184e41a [0,2,0,0,0,0|2,0,0]=4 366 B13R1.75 COc1ccc(c(n1)Cl)NCC=O 5842503311f1a48ebbccbd5345de2f04 [0,2,0,0,0,0|2,0,0]=4 367 B13R1.75 COc1ccc(c(n1)Cl)OCC=O 380d0b10321e6228ef4fe3657ee22a29 [0,2,0,0,0,0|2,0,0]=4 368 B13R1.75 COc1ccc(c(n1)F)NCC=O 61e5f467942847b0d1d5b6b47d491f78 [0,2,0,0,0,0|2,0,0]=4 369 B13R1.75 COc1cnc(c(c1)Br)NCC=O 38894354d7ebd1547714cc101c4f6b73 [0,2,0,0,0,0|2,0,0]=4 370 B13R1.75 COc1cnc(c(c1)C)CNC=O 8a6c4e1e7ff53a4b1e292cea50a878a7 [0,2,0,0,0,0|2,0,0]=4 371 B13R1.75 COc1cnc(c(c1)C)NCC=O 82286be26f2f9cd0356e8492ae5aeb57 [0,2,0,0,0,0|2,0,0]=4 372 B13R1.75 COc1cnc(c(c1)Cl)OCC=O aa623c833ec1f6fe6ceda51ea5b55f7d [0,2,0,0,0,0|2,0,0]=4 373 B13R1.75 COc1cnc(c(c1)F)NCC=O 7859f7f147c8f3412e6c436deec7e1f2 [0,2,0,0,0,0|2,0,0]=4 374 B13R1.75 CSc1ccc(c(c1)Br)OCC=O bd0793990ea2d736cf41e3de50468006 [0,2,0,0,0,0|1,1,0]=4 375 B13R1.75 CSc1ccc(c(c1)C)NCC=O 6996ce5e6c475b944b9459a997a26f9f [0,2,0,0,0,0|1,1,0]=4 376 B13R1.75 CSc1ccc(c(c1)C)OCC=O 4c30e2cc27a38233142c04e293ca0421 [0,2,0,0,0,0|1,1,0]=4 377 B13R1.75 CSc1ccc(c(c1)F)NCC=O 1deecf728f2373155517321e1dce9cf7 [0,2,0,0,0,0|1,1,0]=4 378 B13R1.388 CCOc1cc(c(cn1)NC=O)C 631facb346fbc05a9d573b22c3b7c880 [0,2,0,0,0,0|2,0,0]=4 379 B13R1.388 CCOc1ccc(c(c1)Br)NC=O d49a12da71dfad897f9c7aef5d6fd734 [0,2,0,0,0,0|1,0,0]=3 380 B13R1.388 CCOc1ccc(c(c1)C)NC=O 6e7a53619602827ba983d896ee97159e [0,2,0,0,0,0|1,0,0]=3 381 B13R1.388 CCOc1ccc(c(c1)Cl)NC=O a7df5038cd7f9f2a436f5b3c9cae5f6f [0,2,0,0,0,0|1,0,0]=3 382 B13R1.388 CCOc1ccc(c(c1)F)NC=O 5d31c847e17c1a8d7efe5850f3d99906 [0,2,0,0,0,0|1,0,0]=3 383 B13R1.388 CCOc1ccc(c(c1)O)NC=O e84cfcd2970760b00c30fa973edb8fd5 [0,2,0,0,0,0|0,0,0]=2 384 B13R1.388 CCOc1ccc(c(n1)C)NC=O 511e618da18e7229f92aa671d16e135a [0,2,0,0,0,0|2,0,0]=4 385 B13R1.388 O=CNc1ccc(cc1Br)CCO d030cc08040b062a0321c73171163888 [0,2,0,0,0,0|2,0,0]=4 386 B13R1.653 CC(=O)Nc1ccc(cc1O)CO bc836a9bb9ff92c90d38b318f83b341f [0,2,0,0,0,0|2,0,0]=4 387 B13R1.653 CCc1ccc(c(c1)Br)NC(=O)C 574644c4313129a0c733f3928cdec6f0 [0,2,0,0,0,0|2,0,0]=4 388 B13R1.653 CCc1ccc(c(c1)C)NC(=O)C 063009308fcdff906122b9689af241f5 [0,2,0,0,0,0|2,0,0]=4 389 B13R1.653 CCc1ccc(c(c1)Cl)NC(=O)C 380a09469c322e675b7430a4de4b8d41 [0,2,0,0,0,0|2,0,0]=4 390 B13R1.653 CCc1ccc(c(c1)F)NC(=O)C 21d519050aa49354cf6105633162f601 [0,2,0,0,0,0|2,0,0]=4 391 B13R1.653 CCc1ccc(c(c1)I)NC(=O)C 58612dafbe99a651fbb1210625b60d37 [0,2,0,0,0,0|2,0,0]=4 392 B13R1.653 CCc1ccc(c(c1)O)NC(=O)C d782d1d64ad0625c440725467d7d92d8 [0,2,0,0,0,0|1,0,0]=3 393 B13R1.653 COc1ccc(c(c1)Br)NC(=O)C 96b72a58a5b5497df1a42bfd2ba68a1b [0,2,0,0,0,0|1,0,0]=3 394 B13R1.653 COc1ccc(c(c1)C)NC(=O)C 90b0cacdcf4b06ee2d4df8016971434d [0,2,0,0,0,0|1,0,0]=3 395 B13R1.653 COc1ccc(c(c1)Cl)NC(=O)C 8e281b347dbd1df8119bc78f2a9262e2 [0,2,0,0,0,0|1,0,0]=3 396 B13R1.653 COc1ccc(c(c1)F)NC(=O)C 748bbdd0efb73e4b803ccaac8f688290 [0,2,0,0,0,0|1,0,0]=3 397 B13R1.653 COc1ccc(c(c1)I)NC(=O)C f4fb26487031e5f7602349064b2e5b00 [0,2,0,0,0,0|1,0,0]=3 398 B13R1.653 COc1ccc(c(c1)O)NC(=O)C b85b0dfcba0f6b91fd4f842ed915624e [0,2,0,0,0,0|0,0,0]=2 399 B13R1.653 COc1ccc(c(c1)S)NC(=O)C aed963e0e9c0d47f9b85df51fd70b499 [0,2,0,0,0,0|0,1,0]=3 400 B13R1.653 COc1ccc(c(n1)C)NC(=O)C ec19001e1691729f4cd986aefcc593c0 [0,2,0,0,0,0|2,0,0]=4 401 B13R1.653 COc1ccc(c(n1)F)NC(=O)C c8ffb6468cafe60815c4118afdff8727 [0,2,0,0,0,0|2,0,0]=4 402 B13R1.653 CSc1ccc(c(c1)F)NC(=O)C 075b1c968e91f2e2eeb698290295455a [0,2,0,0,0,0|1,1,0]=4 403 B13R1.1254 CCNc1ccc(c(c1F)Cl)C=O 8525874f672e4b50119b5e4e011a9805 [0,2,0,0,0,0|2,0,0]=4 404 B13R1.1254 CCOc1ccc(c(c1C)C)C=O 0a5633fcf3be8e6188e475a338e7c85b [0,2,0,0,0,0|1,0,0]=3 405 B13R1.1254 CCOc1ccc(c(c1C)Cl)C=O b4b19e80df2ed0de5e1bafe280f4879d [0,2,0,0,0,0|1,0,0]=3 406 B13R1.1254 CCOc1ccc(c(c1C)F)C=O 71aef72f47e02c639a03c9d7c7702c64 [0,2,0,0,0,0|1,0,0]=3 407 B13R1.1254 CCOc1ccc(c(c1Cl)Cl)C=O 43fce3b4b59253ddab131d1965da89a8 [0,2,0,0,0,0|1,0,0]=3 408 B13R1.1254 CCOc1ccc(c(c1Cl)F)C=O f0fe2beb6a3b25d0c4b9da8a09af4a35 [0,2,0,0,0,0|1,0,0]=3 409 B13R1.1254 CCOc1ccc(c(c1F)C)C=O 999e85f605d5282e28b3fc2f20957dbb [0,2,0,0,0,0|1,0,0]=3 410 B13R1.1254 CCOc1ccc(c(c1F)F)C=O a272140f23a2b44fab96c6bfcb734552 [0,2,0,0,0,0|1,0,0]=3 411 B13R1.1254 COc1ccc(c(c1Br)F)NC=O ebd208a5dfbdf485e3a7126b297de21e [0,2,0,0,0,0|1,0,0]=3 412 B13R1.1254 COc1ccc(c(c1C)Cl)NC=O 5dbe530d540fb37166ac7448fbb6cbd2 [0,2,0,0,0,0|1,0,0]=3 413 B13R1.1254 COc1ccc(c(c1Cl)F)NC=O 73c6f0eb8e42594773a185fc31b276d0 [0,2,0,0,0,0|1,0,0]=3 414 B13R1.1254 COc1ccc(c(c1F)Br)NC=O 19d429600b7e67c13a17087f6352c974 [0,2,0,0,0,0|1,0,0]=3 415 B13R1.1254 COc1ccc(c(c1F)C)NC=O 325137ca2ec6fae57824f6a5367d33ef [0,2,0,0,0,0|1,0,0]=3 416 B13R1.1254 COc1ccc(c(c1F)F)NC=O e43fc7f6c8727e78609d52394ed892c2 [0,2,0,0,0,0|1,0,0]=3 417 B13R1.1254 COc1ccc(c(c1F)I)NC=O 095ffffecb9431b045236bd20f900598 [0,2,0,0,0,0|1,0,0]=3 418 B13R1.1254 Cc1c(ccc(c1C)OCF)C=O 2d55cd87479d607b00d3dd4864fd3056 [0,2,0,0,0,0|1,0,0]=3 419 B13R1.1254 Cc1c(ccc(c1Cl)C=O)OCF ebfaa91e730e1c0bb467e7eeb5a77e44 [0,2,0,0,0,0|1,0,0]=3 420 B13R1.1254 Cc1c(ccc(c1F)C=O)OCF 33532fcdbd6c41a531c743440ee8d279 [0,2,0,0,0,0|1,0,0]=3 421 B13R1.1254 Cc1c(ccc(c1F)OCF)C=O 59f591df2381f75e0dd1e38e602002db [0,2,0,0,0,0|1,0,0]=3 422 B13R1.1254 O=Cc1ccc(c(c1Cl)Cl)OCF 82d9d1bbd63ca1e9c1af0b23aee9fcda [0,2,0,0,0,0|1,0,0]=3 423 B13R1.1254 O=Cc1ccc(c(c1Cl)F)NCF ac992c61a9b2841afe38a9f6abfe1ecb [0,2,0,0,0,0|2,0,0]=4 424 B13R1.1254 O=Cc1ccc(c(c1Cl)F)NCO 59ed4221386035cea638a376a070e9ca [0,2,0,0,0,0|2,0,0]=4 425 B13R1.1254 O=Cc1ccc(c(c1F)Cl)OCF 210332a92a2e0d3ae3207fa182630399 [0,2,0,0,0,0|1,0,0]=3 426 B13R1.1254 O=Cc1ccc(c(c1F)F)OCF 8469026eda25f03b92b3a8f43662c59f [0,2,0,0,0,0|1,0,0]=3 427 B13R1.2901 CCNc1cc(c(cc1Br)C=O)Cl dcc26ce3038e7c60936f148ab04186b2 [0,2,0,0,0,0|2,0,0]=4 428 B13R1.2901 CCOc1cc(c(cc1Br)C=O)Cl edabd614dbafbd97993365af311e6053 [0,2,0,0,0,0|1,0,0]=3 429 B13R1.2901 CCOc1cc(c(cc1Br)C=O)F e747bc2fc4e77a15979992a8152ee247 [0,2,0,0,0,0|1,0,0]=3 430 B13R1.2901 CCOc1cc(c(cc1C)C=O)C df6a0af3cbbba6fc92a7d11b2635e7e1 [0,2,0,0,0,0|1,0,0]=3 431 B13R1.2901 CCOc1cc(c(cc1C)C=O)F f7e6e5fbcfea9af5295b43ab2f68692f [0,2,0,0,0,0|1,0,0]=3 432 B13R1.2901 CCOc1cc(c(cc1Cl)C=O)C 76bad3b32fa053cf153128f591e74127 [0,2,0,0,0,0|1,0,0]=3 433 B13R1.2901 CCOc1cc(c(cc1Cl)C=O)Cl 84b6afc7148350541ea61a31234a376a [0,2,0,0,0,0|1,0,0]=3 434 B13R1.2901 CCOc1cc(c(cc1Cl)C=O)F ef80a02bf9fae46b5475f636785dd72c [0,2,0,0,0,0|1,0,0]=3 435 B13R1.2901 CCOc1cc(c(cc1F)C=O)Br 7798077db56d9853aaf4dcb3a1e4b7e3 [0,2,0,0,0,0|1,0,0]=3 436 B13R1.2901 CCOc1cc(c(cc1F)C=O)C 807c03a2b8f931b606f3e588cc763f10 [0,2,0,0,0,0|1,0,0]=3 437 B13R1.2901 CCOc1cc(c(cc1F)C=O)F c85104087ada38969da2a42f3e57cc67 [0,2,0,0,0,0|1,0,0]=3 438 B13R1.2901 CCOc1cc(c(cc1I)C=O)F 84e952926623541312adb6237a9f8a50 [0,2,0,0,0,0|1,0,0]=3 439 B13R1.2901 COc1cc(c(cc1C)NC=O)C 3cefd103c18c5c77bd11123f4c0221d0 [0,2,0,0,0,0|1,0,0]=3 440 B13R1.2901 COc1cc(c(cc1C)NC=O)Cl 1f8c3a73eeacb7797f83a7ab38c1daf7 [0,2,0,0,0,0|1,0,0]=3 441 B13R1.2901 COc1cc(c(cc1Cl)NC=O)Cl ad6a38f20546048211682c2ed82a1841 [0,2,0,0,0,0|1,0,0]=3 442 B13R1.2901 COc1cc(c(cc1F)NC=O)Cl 29106a60830453319e305ca0a3fcaf85 [0,2,0,0,0,0|1,0,0]=3 443 B13R1.2901 COc1cc(c(cc1F)NC=O)F 42bf6488feff05914e06bb2f9b7a59af [0,2,0,0,0,0|1,0,0]=3 444 B13R1.2901 Cc1cc(c(cc1C=O)C)OCF f224a2e5be017856558b299b4db16a7b [0,2,0,0,0,0|1,0,0]=3 445 B13R1.2901 Cc1cc(c(cc1C=O)Cl)OCF d4fe2027da7dcd2637f0242a20894ea7 [0,2,0,0,0,0|1,0,0]=3 446 B13R1.2901 Cc1cc(c(cc1C=O)F)OCF aa79ebcd35614c52cc923147c971a528 [0,2,0,0,0,0|1,0,0]=3 447 B13R1.2901 Cc1cc(c(cc1OCF)F)C=O bd08bf1108d268546ff6bc85ffcdde09 [0,2,0,0,0,0|1,0,0]=3 448 B13R1.2901 O=Cc1cc(c(cc1Br)OCF)F 880534eba0636f6c31aee9c9733fb987 [0,2,0,0,0,0|1,0,0]=3 449 B13R1.2901 O=Cc1cc(c(cc1Cl)NCF)Br df0be86e56134b0fc88aa0fa2a1171e7 [0,2,0,0,0,0|2,0,0]=4 450 B13R1.2901 O=Cc1cc(c(cc1Cl)NCO)Br 26cae93bb5629859c9ed72368b826c46 [0,2,0,0,0,0|2,0,0]=4 451 B13R1.2901 O=Cc1cc(c(cc1Cl)OCF)Br ae991c16b8594c84a819dbd9e3b98aff [0,2,0,0,0,0|1,0,0]=3 452 B13R1.2901 O=Cc1cc(c(cc1Cl)OCF)Cl 1bd7f700139ca47f809ed9cb3d1e72cf [0,2,0,0,0,0|1,0,0]=3 453 B13R1.2901 O=Cc1cc(c(cc1F)OCF)Br b0bae64d70ef1ec537aadc3589cb6a7b [0,2,0,0,0,0|1,0,0]=3 454 B13R1.2901 O=Cc1cc(c(cc1F)OCF)Cl ffb0e4d04ff3f1ef457d0fb75e6749a7 [0,2,0,0,0,0|1,0,0]=3 455 B13R1.2901 O=Cc1cc(c(cc1F)OCF)F 3fc57b795c7ebed848fbddea0b0a3db2 [0,2,0,0,0,0|1,0,0]=3 456 B13R1.2901 O=Cc1cc(c(cc1F)OCF)I 97c708e73ae1dd02578c274f8a18fb00 [0,2,0,0,0,0|1,0,0]=3 457 B13R1.3945 CCc1cc(c(c(c1)Br)NC=O)Br f9c09dc4625f457d8f7cf85ee31ede83 [0,2,0,0,0,0|2,0,0]=4 458 B13R1.3945 COc1cc(c(c(c1)Br)NC=O)Br 10d3bc08b86f5e4ca800d15d8fb2cc4b [0,2,0,0,0,0|1,0,0]=3 459 B13R1.3945 COc1cc(c(c(c1)Br)NC=O)C cf4bce5e9303b5af388adf14ff9dc446 [0,2,0,0,0,0|1,0,0]=3 460 B13R1.3945 COc1cc(c(c(c1)Br)NC=O)F 331f211e87f0b0cec7b4d6d26e8cc870 [0,2,0,0,0,0|1,0,0]=3 461 B13R1.3945 COc1cc(c(c(c1)F)NC=O)F 4c9469fb56fe50afd33663f4a7263960 [0,2,0,0,0,0|1,0,0]=3 462 B13R1.3945 CSc1cc(c(c(c1)F)NC=O)F 11321d0c634c67d221398bd5753dc667 [0,2,0,0,0,0|1,1,0]=4 463 B13R1.35 CC(=O)Nc1ccc(c(c1)Br)C=O 82c8816081d8ea774c76eaadc199c244 [0,2,0,0,0,0|2,0,0]=4 464 B13R1.35 CC(=O)Nc1ccc(c(c1)Cl)C=O 13aa830758485864ad16cd7aabed5f4c [0,2,0,0,0,0|2,0,0]=4 465 B13R1.35 CC(=O)Nc1ccc(c(c1)F)C=O cc7d64d1e15e2590ee2a637e7edda450 [0,2,0,0,0,0|2,0,0]=4 466 B13R1.35 CC(=O)Nc1ccc(c(c1)O)C=O 6a43d93005b092f54f6b16da316a64e6 [0,2,0,0,0,0|1,0,0]=3 467 B13R1.35 CC(C)Nc1ccc(c(c1)Br)C=O a69f249489f691bbffc38761a13b2473 [0,2,0,0,0,0|2,0,0]=4 468 B13R1.35 CC(C)Nc1ccc(c(c1)Cl)C=O e4e23402a6135a41cc824293c11a14d3 [0,2,0,0,0,0|2,0,0]=4 469 B13R1.35 CC(C)Nc1ccc(c(c1)F)C=O 38090b9fcedf66bb2d617d1ae6387ee7 [0,2,0,0,0,0|2,0,0]=4 470 B13R1.35 CC(C)Oc1ccc(c(c1)Br)C=O e51e74b89dfb55029db396b67562c0bf [0,2,0,0,0,0|1,0,0]=3 471 B13R1.35 CC(C)Oc1ccc(c(c1)Cl)C=O 9fdd1dab7c1c6459411982c7e183b122 [0,2,0,0,0,0|1,0,0]=3 472 B13R1.35 CC(C)Oc1ccc(c(c1)F)C=O b00531201679ce19e9505d4432789f84 [0,2,0,0,0,0|1,0,0]=3 473 B13R1.35 CC(C)Oc1ccc(c(c1)I)C=O d9c903ac8f2abf2f5fc00c6af4444a2c [0,2,0,0,0,0|1,0,0]=3 474 B13R1.35 CC(C)Oc1cnc(c(c1)Cl)C=O deffc2b409f64282c17d4a2b4d4628d3 [0,2,0,0,0,0|2,0,0]=4 475 B13R1.35 CC(C)Oc1cnc(c(c1)F)C=O 8133a2b6df1cf536c55c1fe98bef9c0d [0,2,0,0,0,0|2,0,0]=4 476 B13R1.35 Cc1cc(ccc1C=O)OC(C)C cf6b6d9f68b680c6f011df2b61d640e2 [0,2,0,0,0,0|1,0,0]=3 477 B13R1.385 CC(=O)c1ccc(cc1Br)NCF 1f3fa30260e07b51cde98dc182a6b8e3 [0,2,0,0,0,0|2,0,0]=4 478 B13R1.385 CC(=O)c1ccc(cc1Br)NCO 144386dac7f0e905bb26d68d05b309c3 [0,2,0,0,0,0|2,0,0]=4 479 B13R1.385 CC(=O)c1ccc(cc1Br)OCF 97e268ee207565e3cdfde3bc8b79d1b1 [0,2,0,0,0,0|1,0,0]=3 480 B13R1.385 CC(=O)c1ccc(cc1C)OCF 0a023cdc96b7f933cb70d3ca74d629e0 [0,2,0,0,0,0|1,0,0]=3 481 B13R1.385 CC(=O)c1ccc(cc1Cl)NCF 91757c9943c7c9bc8be2635bbd38463f [0,2,0,0,0,0|2,0,0]=4 482 B13R1.385 CC(=O)c1ccc(cc1Cl)NCO af96987dff3e359ee482cda91bd5257f [0,2,0,0,0,0|2,0,0]=4 483 B13R1.385 CC(=O)c1ccc(cc1Cl)OCF ae1839df9f62302487b9317f426b3b5d [0,2,0,0,0,0|1,0,0]=3 484 B13R1.385 CC(=O)c1ccc(cc1F)NCF e624d50a099cfa0789f9fd9369ce6862 [0,2,0,0,0,0|2,0,0]=4 485 B13R1.385 CC(=O)c1ccc(cc1F)NCO c9a33cb3db5237eb7f42be4583b39f80 [0,2,0,0,0,0|2,0,0]=4 486 B13R1.385 CC(=O)c1ccc(cc1F)OCF eb7d0d7176f114109891bcaeb215b925 [0,2,0,0,0,0|1,0,0]=3 487 B13R1.385 CC(=O)c1ccc(cc1O)NC#N 13155783e21eec0d754cfe2991176fad [0,2,0,0,0,0|1,0,1]=4 488 B13R1.385 CC(=O)c1ccc(cc1O)NC=O 3ba462f2223883f50fa72a396dbb74ab [0,2,0,0,0,0|1,0,1]=4 489 B13R1.385 CCNc1ccc(c(c1)Br)C(=O)C dfb1faf5d2bcd02e49d2b521b74a02ad [0,2,0,0,0,0|2,0,0]=4 490 B13R1.385 CCNc1ccc(c(c1)Br)C(=O)O 63088c3336cd12edfc76da88e77cfaa0 [0,2,0,0,0,0|2,0,0]=4 491 B13R1.385 CCNc1ccc(c(c1)C)C(=O)N b6bb4e53879c1ce4b66c45fb0a6b0a8d [0,2,0,0,0,0|2,0,0]=4 492 B13R1.385 CCNc1ccc(c(c1)C)C(=O)O b68af022ab0616ee44747e6fc26cc8b6 [0,2,0,0,0,0|2,0,0]=4 493 B13R1.385 CCNc1ccc(c(c1)Cl)C(=O)C e6618ca881cecdb3563284234cbca2c4 [0,2,0,0,0,0|2,0,0]=4 494 B13R1.385 CCNc1ccc(c(c1)Cl)C(=O)N 48400afc8fc3fc47fca61f5870055b0c [0,2,0,0,0,0|2,0,0]=4 495 B13R1.385 CCNc1ccc(c(c1)Cl)C(=O)O 3c335b7b1565b4e33b1adb27aa1f3b96 [0,2,0,0,0,0|2,0,0]=4 496 B13R1.385 CCNc1ccc(c(c1)F)C(=O)C c486860c438b28db29d54f392fefe6df [0,2,0,0,0,0|2,0,0]=4 497 B13R1.385 CCNc1ccc(c(c1)F)C(=O)N 87dd4f68dea0dd0b9cfab9b36287f465 [0,2,0,0,0,0|2,0,0]=4 498 B13R1.385 CCNc1ccc(c(c1)F)C(=O)O efd3a4c16bfbed07c65985e7315afbfe [0,2,0,0,0,0|2,0,0]=4 499 B13R1.385 CCNc1ccc(c(c1)I)C(=O)O 72ee957beaeee162de82d3121e6495bb [0,2,0,0,0,0|2,0,0]=4 500 B13R1.385 CCOc1cc(c(cn1)C(=O)O)Br 871b77e6b3fe5e0c49cdf18b38e4ff29 [0,2,0,0,0,0|2,0,0]=4 501 B13R1.385 CCOc1cc(c(cn1)C(=O)O)C 65781072e0597dab36e5035f993180ab [0,2,0,0,0,0|2,0,0]=4 502 B13R1.385 CCOc1cc(c(cn1)C(=O)O)Cl 7999ac27225c8e08330ec3bf4fd7b5d6 [0,2,0,0,0,0|2,0,0]=4 503 B13R1.385 CCOc1ccc(c(c1)Br)C(=O)C ca2a0d63b31af9df2d6905fa8623fdec [0,2,0,0,0,0|1,0,0]=3 504 B13R1.385 CCOc1ccc(c(c1)Br)C(=O)O f22587f9ff61a1e497ddef02dd4884d4 [0,2,0,0,0,0|1,0,0]=3 505 B13R1.385 CCOc1ccc(c(c1)Br)[N+](=O)[O-] d076a6f55c8889fe7138c2d9f982723c [0,2,0,0,0,0|2,0,0]=4 506 B13R1.385 CCOc1ccc(c(c1)C)C(=O)C 60c7fe0085581cce2ec5c907a42d063e [0,2,0,0,0,0|1,0,0]=3 507 B13R1.385 CCOc1ccc(c(c1)C)C(=O)N fbf4f47dc3d349669d68c7ebc505ed0e [0,2,0,0,0,0|1,0,0]=3 508 B13R1.385 CCOc1ccc(c(c1)C)C(=O)O 09e2e50315f11f8d88ffd75122e8c66a [0,2,0,0,0,0|1,0,0]=3 509 B13R1.385 CCOc1ccc(c(c1)C)[N+](=O)[O-] 3905d45434211918343889e64db7df50 [0,2,0,0,0,0|2,0,0]=4 510 B13R1.385 CCOc1ccc(c(c1)Cl)C(=O)C 3a9d97af6eac4fcb103ebf982142af36 [0,2,0,0,0,0|1,0,0]=3 511 B13R1.385 CCOc1ccc(c(c1)Cl)C(=O)N 8ae6a1e9c52784ced6741fa06b14ac5b [0,2,0,0,0,0|1,0,0]=3 512 B13R1.385 CCOc1ccc(c(c1)Cl)C(=O)O 8b3e4223c495d01534683bb9ae33a989 [0,2,0,0,0,0|1,0,0]=3 513 B13R1.385 CCOc1ccc(c(c1)Cl)[N+](=O)[O-] feae077716ac0cc1c6b03aad684c6e06 [0,2,0,0,0,0|2,0,0]=4 514 B13R1.385 CCOc1ccc(c(c1)F)C(=O)C 840acfbc16700abda3d55ad837d74103 [0,2,0,0,0,0|1,0,0]=3 515 B13R1.385 CCOc1ccc(c(c1)F)C(=O)N 7638c47abad21336d2b1ab2ffbcf2981 [0,2,0,0,0,0|1,0,0]=3 516 B13R1.385 CCOc1ccc(c(c1)F)C(=O)O f0e6d31fc97b1e5152fc77c43d0e54f7 [0,2,0,0,0,0|1,0,0]=3 517 B13R1.385 CCOc1ccc(c(c1)F)[N+](=O)[O-] 8b746a7e0397883e275139e4cff0ae72 [0,2,0,0,0,0|2,0,0]=4 518 B13R1.385 CCOc1ccc(c(c1)I)[N+](=O)[O-] 8c0b1739ab9a7a321b934ea0e57a1eae [0,2,0,0,0,0|2,0,0]=4 519 B13R1.385 CCOc1ccc(c(n1)C)C(=O)O 92b7ee2822becd90a31ad2745c77976a [0,2,0,0,0,0|2,0,0]=4 520 B13R1.385 CCOc1ccc(c(n1)Cl)C(=O)O 9826439344d7121242c34eb9209b644b [0,2,0,0,0,0|2,0,0]=4 521 B13R1.385 CCOc1cnc(c(c1)F)C(=O)O 027ac6924f58386fe370fc4785ba35d9 [0,2,0,0,0,0|2,0,0]=4 522 B13R1.385 Cc1cc(ccc1C(=O)N)NCF 53da1219707d70c756bc7e512177df54 [0,2,0,0,0,0|2,0,0]=4 523 B13R1.385 Cc1cc(ccc1C(=O)N)NCO 65f91ffcf57e1574f9db5b418526a914 [0,2,0,0,0,0|2,0,0]=4 524 B13R1.385 Cc1cc(ccc1C(=O)N)OCF 9c67f3c92cb5fe7da1f88839950cdae2 [0,2,0,0,0,0|1,0,0]=3 525 B13R1.385 Cc1cc(ccc1C(=O)O)NCF 41db4fe9a5a92737d488f32c7cb558ac [0,2,0,0,0,0|2,0,0]=4 526 B13R1.385 Cc1cc(ccc1C(=O)O)NCO c8246581ce1520b4acd9eceb58c84381 [0,2,0,0,0,0|2,0,0]=4 527 B13R1.385 Cc1cc(ccc1C(=O)O)OCF 89841c87229033a1aa645090295ea9ec [0,2,0,0,0,0|1,0,0]=3 528 B13R1.385 Cc1cc(ccc1[N+](=O)[O-])OCF b03b0165e96189c60c2f69657458391b [0,2,0,0,0,0|2,0,0]=4 529 B13R1.385 Cc1cc(ncc1C(=O)O)OCF 37671a9b49e9338475fbf7ea74f55912 [0,2,0,0,0,0|2,0,0]=4 530 B13R1.385 Cc1nc(ccc1C(=O)O)OCF 32c91fc91a4cd84b7341eefe8e24b261 [0,2,0,0,0,0|2,0,0]=4 531 B13R1.385 NC(=O)c1ccc(cc1Cl)NCF e960691bf0d11f812e13563ef3af63d3 [0,2,0,0,0,0|2,0,0]=4 532 B13R1.385 NC(=O)c1ccc(cc1Cl)NCO 0f5c21c14efa7556f0568db75a98ee0c [0,2,0,0,0,0|2,0,0]=4 533 B13R1.385 NC(=O)c1ccc(cc1Cl)OCF 7bdbd2f888b99154c191fc15db825f01 [0,2,0,0,0,0|1,0,0]=3 534 B13R1.385 NC(=O)c1ccc(cc1F)NCF f1178e57d0a45fbef1d6e3ffcc0a2f4d [0,2,0,0,0,0|2,0,0]=4 535 B13R1.385 NC(=O)c1ccc(cc1F)NCO 9461a02cd39f9771f42cd1140cd942bc [0,2,0,0,0,0|2,0,0]=4 536 B13R1.385 NC(=O)c1ccc(cc1F)OCF 5fbded5cf0523cb234a3465d92f61da3 [0,2,0,0,0,0|1,0,0]=3 537 B13R1.385 NC(=O)c1ccc(cc1O)NC=O b82fa832cc7e4c36b98f0a1e9fcef66f [0,2,0,0,0,0|1,0,1]=4 538 B13R1.385 O=C(O)c1ccc(cc1Br)NCF 3dc308f009e8eff15844fac3306e8d8e [0,2,0,0,0,0|2,0,0]=4 539 B13R1.385 O=C(O)c1ccc(cc1Br)NCO 9f6d474f0038232f8402e2b5b2257071 [0,2,0,0,0,0|2,0,0]=4 540 B13R1.385 O=C(O)c1ccc(cc1Br)OCF 9905c2182583002677d0b3f51f2f8704 [0,2,0,0,0,0|1,0,0]=3 541 B13R1.385 O=C(O)c1ccc(cc1Cl)NCF c1892eb9930db7398e9bcbae0fd8e566 [0,2,0,0,0,0|2,0,0]=4 542 B13R1.385 O=C(O)c1ccc(cc1Cl)NCO 0ae443d71c19a2c6d5b00e7934350288 [0,2,0,0,0,0|2,0,0]=4 543 B13R1.385 O=C(O)c1ccc(cc1Cl)OCF e83c05b248a74014304cb36b815c1373 [0,2,0,0,0,0|1,0,0]=3 544 B13R1.385 O=C(O)c1ccc(cc1F)NCF a14ca8dd74a24321544879f9eb8244ff [0,2,0,0,0,0|2,0,0]=4 545 B13R1.385 O=C(O)c1ccc(cc1F)NCO 08f9c84cb7f1f82d1612f144f4039b1e [0,2,0,0,0,0|2,0,0]=4 546 B13R1.385 O=C(O)c1ccc(cc1F)OCF d327aaf236eb4e2e791f63c33ec7ec6e [0,2,0,0,0,0|1,0,0]=3 547 B13R1.385 O=C(O)c1ccc(cc1I)NCF 269d659c67e1f7924c8805b90facde70 [0,2,0,0,0,0|2,0,0]=4 548 B13R1.385 O=C(O)c1ccc(cc1I)NCO 005c9a76951465662c711d3a14f233ec [0,2,0,0,0,0|2,0,0]=4 549 B13R1.385 O=C(O)c1ccc(nc1Cl)OCF 24972157cfd568b1f2fbd4ad114e8e6e [0,2,0,0,0,0|2,0,0]=4 550 B13R1.385 O=C(O)c1cnc(cc1Br)OCF ded94eec41856057538e3d46ba790c16 [0,2,0,0,0,0|2,0,0]=4 551 B13R1.385 O=C(O)c1cnc(cc1Cl)OCF beca938e5ecf7f6dacd13a9cb9cd9411 [0,2,0,0,0,0|2,0,0]=4 552 B13R1.385 O=C(O)c1ncc(cc1F)OCF 342ac3d2319cc90a686b5426accba701 [0,2,0,0,0,0|2,0,0]=4 553 B13R1.385 O=[N+]([O-])c1ccc(cc1Br)OCF b567d7cd7b6096e6d94427f603db8970 [0,2,0,0,0,0|2,0,0]=4 554 B13R1.385 O=[N+]([O-])c1ccc(cc1Cl)OCF 7c84e5b259bea8ec3b6b85733f6de569 [0,2,0,0,0,0|2,0,0]=4 555 B13R1.385 O=[N+]([O-])c1ccc(cc1F)OCF 711056390d919421b019da5265b61e72 [0,2,0,0,0,0|2,0,0]=4 556 B13R1.385 O=[N+]([O-])c1ccc(cc1I)OCF ebe330e22bf9b0314e42f4e4986c7b9e [0,2,0,0,0,0|2,0,0]=4 557 B13R1.577 C#CCNc1ccc(c(c1)Br)C=O 1ca7ea9e583238427adab4f1faca772c [0,2,0,0,0,0|2,0,0]=4 558 B13R1.577 C#CCNc1ccc(c(c1)Cl)C=O a7f1f48d05299c52c8d0b3f491c8f86f [0,2,0,0,0,0|2,0,0]=4 559 B13R1.577 C#CCNc1ccc(c(c1)F)C=O 9059fb7e5678d1892f1d8df5045452f0 [0,2,0,0,0,0|2,0,0]=4 560 B13R1.577 C#CCOc1ccc(c(c1)Br)C=O a2b3e09ecd2979285195eabaa91f074a [0,2,0,0,0,0|1,0,0]=3 561 B13R1.577 C#CCOc1ccc(c(c1)C)C=O 5f14c52e777875ab3e6f70c7cd119c87 [0,2,0,0,0,0|1,0,0]=3 562 B13R1.577 C#CCOc1ccc(c(c1)Cl)C=O 5bfd53d9740795ac58802a368a954986 [0,2,0,0,0,0|1,0,0]=3 563 B13R1.577 C#CCOc1ccc(c(c1)F)C=O 16cbee26bec89070d8527de10af7d88c [0,2,0,0,0,0|1,0,0]=3 564 B13R1.577 C#CCOc1ccc(c(c1)I)C=O 9c1a54eb912a3b212514f3de240b165e [0,2,0,0,0,0|1,0,0]=3 565 B13R1.577 C#CCOc1cnc(c(c1)Cl)C=O 671e41f1538a990616542485005ed97d [0,2,0,0,0,0|2,0,0]=4 566 B13R1.577 C#CCOc1cnc(c(c1)F)C=O 38f564a242781a1f4e9508231b0465b1 [0,2,0,0,0,0|2,0,0]=4 567 B13R1.577 C=CCNc1ccc(c(c1)Br)C=O d33adfad55cd70f3a8135ea6f2d65da9 [0,2,0,0,0,0|2,0,0]=4 568 B13R1.577 C=CCNc1ccc(c(c1)Cl)C=O a6d12ae3766ccebf6c28cc1c0721217d [0,2,0,0,0,0|2,0,0]=4 569 B13R1.577 C=CCNc1ccc(c(c1)F)C=O 7fb00ed2f3924471a2b27c9504511a84 [0,2,0,0,0,0|2,0,0]=4 570 B13R1.577 C=CCOc1ccc(c(c1)Br)C=O cee6ff85143e3f7c50cedfea17b813e6 [0,2,0,0,0,0|1,0,0]=3 571 B13R1.577 C=CCOc1ccc(c(c1)C)C=O fbf4bd1bf84722bdc2fa31e6f95629a4 [0,2,0,0,0,0|1,0,0]=3 572 B13R1.577 C=CCOc1ccc(c(c1)Cl)C=O 07b5151f9577be574a250179e0d7786d [0,2,0,0,0,0|1,0,0]=3 573 B13R1.577 C=CCOc1ccc(c(c1)F)C=O d427957f33a6dadf6ec9db5b5e6f2273 [0,2,0,0,0,0|1,0,0]=3 574 B13R1.577 C=CCOc1ccc(c(c1)I)C=O c83f043653d541e235962c49a179b1d5 [0,2,0,0,0,0|1,0,0]=3 575 B13R1.577 C=CCOc1cnc(c(c1)Cl)C=O 57436225fa97749020231d1edb0a545b [0,2,0,0,0,0|2,0,0]=4 576 B13R1.577 C=CCOc1cnc(c(c1)F)C=O a9484a320b744b86208b1098d5e72d3e [0,2,0,0,0,0|2,0,0]=4 577 B13R1.577 C=Cc1ccc(cc1O)NCCBr 6980550f4c860df24c9928d95f4aad66 [0,2,0,0,0,0|2,0,0]=4 578 B13R1.577 C=Cc1ccc(cc1O)NCCC a69e2428827c6428790912279b17af2d [0,2,0,0,0,0|2,0,0]=4 579 B13R1.577 C=Cc1ccc(cc1O)NCCI f8d552e7a5764f8e1ad8de970032db71 [0,2,0,0,0,0|2,0,0]=4 580 B13R1.577 C=Cc1ccc(cc1O)NCCO 0a0e4979f4f435ecd02ba46d2657dc75 [0,2,0,0,0,0|2,0,0]=4 581 B13R1.577 C=Cc1ccc(cc1O)NCCS 55ccfd2ca462ba5b7f003d7c4df5313b [0,2,0,0,0,0|2,0,0]=4 582 B13R1.577 CCCNc1ccc(c(c1)Br)C=O 3e67d97abac8a654fdc5c60295ea0d0e [0,2,0,0,0,0|2,0,0]=4 583 B13R1.577 CCCNc1ccc(c(c1)C)C=O 3218d55012ff8f49195ef879a5da1a6c [0,2,0,0,0,0|2,0,0]=4 584 B13R1.577 CCCNc1ccc(c(c1)Cl)C=O e2bc446d8513eb1204d8ebcbb1697ab8 [0,2,0,0,0,0|2,0,0]=4 585 B13R1.577 CCCNc1ccc(c(c1)F)C=O 6f2512064d5a3e02c2c41abe9dee1a47 [0,2,0,0,0,0|2,0,0]=4 586 B13R1.577 CCCOc1ccc(c(c1)Br)C=O 8e9f4ce66fa4b405b36f467a2d02e3f7 [0,2,0,0,0,0|1,0,0]=3 587 B13R1.577 CCCOc1ccc(c(c1)C)C=O a577c6a9728af0e42bb6c8686d46336a [0,2,0,0,0,0|1,0,0]=3 588 B13R1.577 CCCOc1ccc(c(c1)Cl)C=O 5b45b90bb448669435ba17a46da55081 [0,2,0,0,0,0|1,0,0]=3 589 B13R1.577 CCCOc1ccc(c(c1)F)C=O 9581737faf3da34ce82e3f825f6a5427 [0,2,0,0,0,0|1,0,0]=3 590 B13R1.577 CCCOc1ccc(c(c1)I)C=O aea2214f91ec8c4ae9e5538655ce5067 [0,2,0,0,0,0|1,0,0]=3 591 B13R1.577 CCCOc1cnc(c(c1)Cl)C=O 35f8c372b2f3b4ec31f26587712f469f [0,2,0,0,0,0|2,0,0]=4 592 B13R1.577 CCCOc1cnc(c(c1)F)C=O 3557db08448639849fd877470ee0f867 [0,2,0,0,0,0|2,0,0]=4 593 B13R1.577 CCOCc1ccc(c(c1)Br)C=O 7dca1a07ecc4cc9357644d657c85b60e [0,2,0,0,0,0|1,0,0]=3 594 B13R1.577 CCOCc1ccc(c(c1)C)C=O 108c14b2ceee715210f8e97aa7125537 [0,2,0,0,0,0|1,0,0]=3 595 B13R1.577 COCNc1ccc(c(c1)Br)C=O 11bdcdee303120f63529b0a50e2136cd [0,2,0,0,0,0|1,0,0]=3 596 B13R1.577 COCNc1ccc(c(c1)Cl)C=O f68b33605f2bebebb914816a4a8b393f [0,2,0,0,0,0|1,0,0]=3 597 B13R1.577 COCNc1ccc(c(c1)F)C=O a17797a6c37ea10e57e75008946ee761 [0,2,0,0,0,0|1,0,0]=3 598 B13R1.577 COCNc1ccc(c(n1)C)C=O 6d69fd9f0fabd9b2d28bd2df963bd11c [0,2,0,0,0,0|2,0,0]=4 599 B13R1.577 COCOc1ccc(c(c1)Br)C=O 589aa3023a9a7c9bd0b2993d6d03c3d5 [0,2,0,0,0,0|1,0,0]=3 600 B13R1.577 COCOc1ccc(c(c1)C)C=O 95723b11ba14cef60d96a45d6454cf3e [0,2,0,0,0,0|1,0,0]=3 601 B13R1.577 COCOc1ccc(c(c1)Cl)C=O 9e709bf6ebeef123b63b1174960e0513 [0,2,0,0,0,0|1,0,0]=3 602 B13R1.577 COCOc1ccc(c(c1)F)C=O 4319fa1a3329619d8f857cd6c7b9a248 [0,2,0,0,0,0|1,0,0]=3 603 B13R1.577 COCOc1ccc(c(c1)I)C=O 9015a5f6989bad0f61ebf98ac3fb44a6 [0,2,0,0,0,0|1,0,0]=3 604 B13R1.577 COCOc1cnc(c(c1)Cl)C=O 16c09231f84a50db77af2266a9f3f251 [0,2,0,0,0,0|2,0,0]=4 605 B13R1.577 COCOc1cnc(c(c1)F)C=O cebd5372a0072da6117a6e4d8dbc56cd [0,2,0,0,0,0|2,0,0]=4 606 B13R1.577 CSCNc1ccc(c(c1)Br)C=O 308b8dd5d1f78b8d4be9e7bd3f8875d5 [0,2,0,0,0,0|1,1,0]=4 607 B13R1.577 CSCNc1ccc(c(c1)Cl)C=O 3cf6096534ae5f553f73df237634ad9c [0,2,0,0,0,0|1,1,0]=4 608 B13R1.577 CSCNc1ccc(c(c1)F)C=O c2ba59dc8b176c2aab871690fe8a55a9 [0,2,0,0,0,0|1,1,0]=4 609 B13R1.577 CSCOc1ccc(c(c1)Br)C=O 85db93c43df634db5e7181537bfde9ac [0,2,0,0,0,0|1,0,0]=3 610 B13R1.577 CSCOc1ccc(c(c1)C)C=O 0e425f4f7c8989678222dac10ccdec8e [0,2,0,0,0,0|1,0,0]=3 611 B13R1.577 CSCOc1ccc(c(c1)Cl)C=O 955ae57b5339ce6b6b2fc7daf90a4227 [0,2,0,0,0,0|1,0,0]=3 612 B13R1.577 CSCOc1ccc(c(c1)F)C=O 004c891e30b530dd2309d8514d27830c [0,2,0,0,0,0|1,0,0]=3 613 B13R1.577 CSCOc1ccc(c(c1)I)C=O d0622ee02b1a1495b490171b047d909c [0,2,0,0,0,0|1,0,0]=3 614 B13R1.577 CSCOc1cnc(c(c1)Cl)C=O be4811e72436137173dfa6a204b37332 [0,2,0,0,0,0|2,0,0]=4 615 B13R1.577 CSCOc1cnc(c(c1)F)C=O 12f361ff05475aad1fa38dde21c723fe [0,2,0,0,0,0|2,0,0]=4 616 B13R1.577 Cc1cc(ccc1C=O)COCF 8f1f2be98a8f997d8c6b01faa059c83e [0,2,0,0,0,0|1,0,0]=3 617 B13R1.577 Cc1cc(ccc1C=O)NCCO ef4abc71da62328364c90f8e056021d6 [0,2,0,0,0,0|2,0,0]=4 618 B13R1.577 Cc1cc(ccc1C=O)NCCS c43e575e25b6c32a0f0aaddd6b66689c [0,2,0,0,0,0|2,0,0]=4 619 B13R1.577 Cc1cc(ccc1C=O)OCC#N cb2e8442eaac03b51c33f3b1e3720cf5 [0,2,0,0,0,0|1,0,0]=3 620 B13R1.577 Cc1cc(ccc1C=O)OCC=O 513ae3e9222b8921ba412cd7c6e0bf39 [0,2,0,0,0,0|1,0,0]=3 621 B13R1.577 Cc1cc(ccc1C=O)OCCF d1326544068b75f9426a92d2a54d0ff0 [0,2,0,0,0,0|1,0,0]=3 622 B13R1.577 Cc1cc(ccc1C=O)OCCS c67cde01af4021b0eb06ffaef51b4628 [0,2,0,0,0,0|1,0,0]=3 623 B13R1.577 N#CCNc1ccc(c(c1)Br)C=O e656f1779faf9c8b40bc1fd4de57e72e [0,2,0,0,0,0|2,0,0]=4 624 B13R1.577 N#CCNc1ccc(c(c1)Cl)C=O 022ebc71368cd6c067298d1d083052a5 [0,2,0,0,0,0|2,0,0]=4 625 B13R1.577 N#CCNc1ccc(c(c1)F)C=O 9e2ac3fb3810e39a102c57d19837ce2a [0,2,0,0,0,0|2,0,0]=4 626 B13R1.577 N#CCOc1ccc(c(c1)Br)C=O 1cb7237249991fb64530b46081e0e056 [0,2,0,0,0,0|1,0,0]=3 627 B13R1.577 N#CCOc1ccc(c(c1)Cl)C=O c80456ba6ac9d0189e71b3c1aa3062e7 [0,2,0,0,0,0|1,0,0]=3 628 B13R1.577 N#CCOc1ccc(c(c1)F)C=O 210a02837f20c79cb86e84554c160aa6 [0,2,0,0,0,0|1,0,0]=3 629 B13R1.577 N#CCOc1ccc(c(c1)I)C=O b11db065b78f11c35b339b32389caba2 [0,2,0,0,0,0|1,0,0]=3 630 B13R1.577 N#CCOc1cnc(c(c1)Cl)C=O 37bbcbb03345bd04c59dbafa9e8e2675 [0,2,0,0,0,0|2,0,0]=4 631 B13R1.577 N#CCOc1cnc(c(c1)F)C=O 39e4f5712f517441a0f46f7e04b999f7 [0,2,0,0,0,0|2,0,0]=4 632 B13R1.577 O=CCNc1ccc(c(c1)Br)C=O 6ebe2021c0e9f671735a75cd06c59ab4 [0,2,0,0,0,0|2,0,0]=4 633 B13R1.577 O=CCNc1ccc(c(c1)Cl)C=O 040a4e4290ec794cc963eac542cb242f [0,2,0,0,0,0|2,0,0]=4 634 B13R1.577 O=CCNc1ccc(c(c1)F)C=O a9e5b12ee0c28cc2b9d54ab932714c6e [0,2,0,0,0,0|2,0,0]=4 635 B13R1.577 O=CCOc1ccc(c(c1)Br)C=O b3b77b92e567ac92b0d1f2c0dd5976b2 [0,2,0,0,0,0|1,0,0]=3 636 B13R1.577 O=CCOc1ccc(c(c1)Cl)C=O aae0005433b62d3863fa97c53747edf0 [0,2,0,0,0,0|1,0,0]=3 637 B13R1.577 O=CCOc1ccc(c(c1)F)C=O 3755809cabdf6640f380574e36cb45cd [0,2,0,0,0,0|1,0,0]=3 638 B13R1.577 O=CCOc1ccc(c(c1)I)C=O df80f5032472e49b500359c70a07a2c6 [0,2,0,0,0,0|1,0,0]=3 639 B13R1.577 O=CCOc1cnc(c(c1)Cl)C=O 6789d764da78057a0d6ac91e2b0f8ada [0,2,0,0,0,0|2,0,0]=4 640 B13R1.577 O=CCOc1cnc(c(c1)F)C=O 2cdc72f3a2f8d7b3db94173a93f2094e [0,2,0,0,0,0|2,0,0]=4 641 B13R1.577 O=Cc1ccc(cc1Br)COCF 35f37ea65d8b8ad91b914afbd8c1df0c [0,2,0,0,0,0|1,0,0]=3 642 B13R1.577 O=Cc1ccc(cc1Br)NCCF d015c573a8d2d804ca3a5ef42b0f88cd [0,2,0,0,0,0|2,0,0]=4 643 B13R1.577 O=Cc1ccc(cc1Br)NCCO 49d179103b5916a0b534a669cd0002c2 [0,2,0,0,0,0|2,0,0]=4 644 B13R1.577 O=Cc1ccc(cc1Br)NCCS cf7fffecef66852fadfda341fa0efeff [0,2,0,0,0,0|2,0,0]=4 645 B13R1.577 O=Cc1ccc(cc1Br)OCCF 3d2377188a3e9fa82fd9f2aa0905e345 [0,2,0,0,0,0|1,0,0]=3 646 B13R1.577 O=Cc1ccc(cc1Br)OCCS 0f1efea139e5f51be42d0bdb637b28cd [0,2,0,0,0,0|1,0,0]=3 647 B13R1.577 O=Cc1ccc(cc1Cl)NCCF ebdd8e3a7db78c00a65172b72d6e1f50 [0,2,0,0,0,0|2,0,0]=4 648 B13R1.577 O=Cc1ccc(cc1Cl)NCCO dcc89adb3c248abdf65cd7ad45460a86 [0,2,0,0,0,0|2,0,0]=4 649 B13R1.577 O=Cc1ccc(cc1Cl)NCCS 001ce918ea6bf8734deb9ea2040309b7 [0,2,0,0,0,0|2,0,0]=4 650 B13R1.577 O=Cc1ccc(cc1Cl)OCCF 49b9b895cd35d68c99173d70abde678d [0,2,0,0,0,0|1,0,0]=3 651 B13R1.577 O=Cc1ccc(cc1Cl)OCCS 26a260938f64862d97beb8b290d21390 [0,2,0,0,0,0|1,0,0]=3 652 B13R1.577 O=Cc1ccc(cc1F)NCCBr b08c4ac13248131f6e5cdfc5d7994e73 [0,2,0,0,0,0|2,0,0]=4 653 B13R1.577 O=Cc1ccc(cc1F)NCCF c0b91049f464335eeaf73007ed5ec50b [0,2,0,0,0,0|2,0,0]=4 654 B13R1.577 O=Cc1ccc(cc1F)NCCI 55c392b5dca68a6c5a01b2b227066b9a [0,2,0,0,0,0|2,0,0]=4 655 B13R1.577 O=Cc1ccc(cc1F)NCCO ff124be17b5ad982b12dc089b7a2a4d2 [0,2,0,0,0,0|2,0,0]=4 656 B13R1.577 O=Cc1ccc(cc1F)NCCS 0a3ea01304a9000220fa08bc3c2ace03 [0,2,0,0,0,0|2,0,0]=4 657 B13R1.577 O=Cc1ccc(cc1F)OCCF 5e80e4a3cbf819504b10084f74e2267f [0,2,0,0,0,0|1,0,0]=3 658 B13R1.577 O=Cc1ccc(cc1F)OCCS 20ee585d4011b82fbaac2f26ef96b077 [0,2,0,0,0,0|1,0,0]=3 659 B13R1.577 O=Cc1ccc(cc1I)OCCF 54158f4df1cd0670bad7aa5246e7fc9c [0,2,0,0,0,0|1,0,0]=3 660 B13R1.577 O=Cc1ccc(cc1I)OCCS a25faef19731ff38798c63e974a7aac2 [0,2,0,0,0,0|1,0,0]=3 661 B13R1.577 O=Cc1ccc(cc1O)NCCS 4efed9f276097a288733764eb0e95cbb [0,2,0,0,0,0|1,0,0]=3 662 B13R1.577 O=Cc1ncc(cc1Cl)OCCF 5eda77c330a4dd66c655c6f9eaf17bbf [0,2,0,0,0,0|2,0,0]=4 663 B13R1.577 O=Cc1ncc(cc1Cl)OCCS dcd773ffc609b937cc3bb73e69f78d2a [0,2,0,0,0,0|2,0,0]=4 664 B13R1.577 O=Cc1ncc(cc1F)OCCF 2f4a6ec65857b39fd280c420965bab4b [0,2,0,0,0,0|2,0,0]=4 665 B13R1.577 O=Cc1ncc(cc1F)OCCS 57a78432fa3ed901b8ed21585524c8d3 [0,2,0,0,0,0|2,0,0]=4 666 B13R1.577 O=Cc1ncc(cc1O)NCCS d540780edddc4decc430a65ba9395eb6 [0,2,0,0,0,0|2,0,0]=4 667 B13R1.4031 CCNc1cc(c(c(c1)F)C=O)F 16a561c3e4915e3bc3db7eedba449f36 [0,2,0,0,0,0|2,0,0]=4 668 B13R1.4031 CCOc1cc(c(c(c1)Br)C=O)C fd71dad8d5ce4f294f3330ceb639389d [0,2,0,0,0,0|1,0,0]=3 669 B13R1.4031 CCOc1cc(c(c(c1)Br)C=O)F ef3db4ab6401c11109d6cedbc25100d6 [0,2,0,0,0,0|1,0,0]=3 670 B13R1.4031 CCOc1cc(c(c(c1)C)C=O)C 259c2ab77eb7693a31bd9f766d3a71b9 [0,2,0,0,0,0|1,0,0]=3 671 B13R1.4031 CCOc1cc(c(c(c1)C)N=O)C 552c3e5363bb62d61f64c9a0669108dc [0,2,0,0,0,0|2,0,0]=4 672 B13R1.4031 CCOc1cc(c(c(c1)Cl)C=O)Cl 8cad96efd1eed4970e1c0b115d5fba3e [0,2,0,0,0,0|1,0,0]=3 673 B13R1.4031 CCOc1cc(c(c(c1)F)C=O)F 188e110177fb5e938f0685f40356e05f [0,2,0,0,0,0|1,0,0]=3 674 B13R1.4031 Cc1cc(cc(c1C=O)Br)OCF 2a59b2f51f29c4dbfbbbd7f765c96880 [0,2,0,0,0,0|1,0,0]=3 675 B13R1.4031 Cc1cc(cc(c1C=O)C)OCF 7ac8558634ad62736014067e76d34183 [0,2,0,0,0,0|1,0,0]=3 676 B13R1.4031 Cc1cc(cc(c1N=O)C)OCF 60ce18af08b474cc262905e54094469d [0,2,0,0,0,0|2,0,0]=4 677 B13R1.4031 O=Cc1c(cc(cc1Br)OCF)F 5be649c9776d3f036ec9d05301021cbb [0,2,0,0,0,0|1,0,0]=3 678 B13R1.4031 O=Cc1c(cc(cc1Cl)OCF)Cl 5ef2e02a33cc5a7baba5cd0c6ab13e71 [0,2,0,0,0,0|1,0,0]=3 679 B13R1.4031 O=Cc1c(cc(cc1F)NCF)F 3396c6b7f91fae18f12596f189a507ce [0,2,0,0,0,0|2,0,0]=4 680 B13R1.4031 O=Cc1c(cc(cc1F)NCO)F e0f7642e24cac5d38259fd04455cdfc4 [0,2,0,0,0,0|2,0,0]=4 681 B13R1.4031 O=Cc1c(cc(cc1F)OCF)F 97fc3357767811b68d425214df276f09 [0,2,0,0,0,0|1,0,0]=3 682 B11R1.189 COc1cccc(c1)NC=O 88669f238af47faaa49b5152af83bc5c [0,0,1,1,0,0|2,0,0]=4 683 B13R2.449 CCNc1ccc2ccoc2c1 8b3840efc8ab22395d48a3049cc2e02a [0,1,0,1,0,0|2,0,0]=4 684 B13R2.449 CCNc1ccc2cnoc2c1 d48eacc0b5186da10849cd46cd218153 [0,1,0,1,0,0|2,0,0]=4 685 B13R2.449 CCOc1ccc2c(c1)OCC2 e3c3f04f1a53e0497e593e6e112acfdf [0,1,0,1,0,0|1,0,1]=4 686 B13R2.449 CCOc1ccc2cc[nH]c2c1 405530241ab481cd5bf7307bc1a4ab7e [0,1,0,1,0,0|2,0,0]=4 687 B13R2.449 CCOc1ccc2ccoc2c1 3277c7c95e7c109f63078887cad4dcdc [0,1,0,1,0,0|1,0,0]=3 688 B13R2.449 CCOc1ccc2ccsc2c1 24ed0fcb626085f9909c2219fae6a841 [0,1,0,1,0,0|1,1,0]=4 689 B13R2.449 CCOc1ccc2cn[nH]c2c1 029562f5e227580da1c366009438e441 [0,1,0,1,0,0|2,0,0]=4 690 B13R2.449 CCOc1ccc2cnoc2c1 a7a1c18bd9cf536ee3131466cefc8c19 [0,1,0,1,0,0|1,0,0]=3 691 B13R2.449 CCOc1ccc2ncoc2c1 bd34a2e98aa71acf0d835675354a175c [0,1,0,1,0,0|2,0,0]=4 692 B13R2.449 FCNc1ccc2ccoc2c1 c478c52f366aba0a379a1115bff41c69 [0,1,0,1,0,0|2,0,0]=4 693 B13R2.449 FCNc1ccc2cnoc2c1 543c7097b2809e20972babf0d2989944 [0,1,0,1,0,0|2,0,0]=4 694 B13R2.449 FCOc1ccc2c(c1)OCC2 9ef7cec2c299612b1026904918057cce [0,1,0,1,0,0|1,0,1]=4 695 B13R2.449 FCOc1ccc2cc[nH]c2c1 76c4e03d140f564451d0afeef5b86fa9 [0,1,0,1,0,0|2,0,0]=4 696 B13R2.449 FCOc1ccc2ccoc2c1 bc97838e09b8ed9e62b107a38ecdd210 [0,1,0,1,0,0|1,0,0]=3 697 B13R2.449 FCOc1ccc2ccsc2c1 4b2bd3963a8d7deb078b5b4e68e6672b [0,1,0,1,0,0|1,1,0]=4 698 B13R2.449 FCOc1ccc2cn[nH]c2c1 84a2ea116050013c883e2599d223f48c [0,1,0,1,0,0|2,0,0]=4 699 B13R2.449 FCOc1ccc2cnoc2c1 9ca979b2376d86060236d0625bed4dad [0,1,0,1,0,0|1,0,0]=3 700 B13R2.449 FCOc1ccc2ncoc2c1 e0de7a66f79275c571ec30862a1ccbdb [0,1,0,1,0,0|2,0,0]=4 701 B13R2.449 OCNc1ccc2ccoc2c1 f830df90116ee0e0ac17d7747390e663 [0,1,0,1,0,0|2,0,0]=4 702 B13R2.449 OCNc1ccc2cnoc2c1 47d330194825f77e27ad8b9affa7cea4 [0,1,0,1,0,0|2,0,0]=4