0 B19R2.132323 COc1cccc2c1oc(=O)c(c2)C(=O)NC#N 3f39584c154290ccf39afec419c053ea [0,0,0,0,0,0|2,0,1]=3 1 B18R2.82072 Cc1cccc2c1oc(=O)c(c2)C(=O)NC#N 651ab5585d21a41554002ccb56cc83eb [1,0,0,0,0,0|2,0,1]=4 2 B18R2.82072 N#CNC(=O)c1cc2cccc(c2oc1=O)O dc3ac5ba90b8fbe1aa396693edcc3d15 [1,0,0,0,0,0|2,0,1]=4 3 B20R2.318997 C#CCNC(=O)c1cc2cccc(c2oc1=O)OC ee38927aa2a18645a3331e271cbb5e56 [0,1,0,0,0,0|1,0,1]=3 4 B20R2.318997 CCCNC(=O)c1cc2cccc(c2nc1Cl)OC 5f2e2ef77713d653b87108049d349478 [0,1,0,0,0,0|3,0,0]=4 5 B20R2.318997 CCCNC(=O)c1cc2cccc(c2oc1=O)OC 19c175ca0390fcaa539d1350bb24695d [0,1,0,0,0,0|1,0,0]=2 6 B20R2.318997 COc1cccc2c1nc(c(c2)C(=O)NCCBr)Cl 36faa76e3e7dd2e9fc0159c1ab4c9d42 [0,1,0,0,0,0|3,0,0]=4 7 B20R2.318997 COc1cccc2c1nc(c(c2)C(=O)NCCF)Cl 6d6c7cc867e9124e30ec9af7bcf79d71 [0,1,0,0,0,0|3,0,0]=4 8 B20R2.318997 COc1cccc2c1nc(c(c2)C(=O)NCCI)Cl eb4a6d4a7e49dfda0ff796cd600c1c19 [0,1,0,0,0,0|3,0,0]=4 9 B20R2.318997 COc1cccc2c1nc(c(c2)C(=O)NCCO)Cl 6e3d00c66370e9a1256fe49093a1b485 [0,1,0,0,0,0|3,0,0]=4 10 B20R2.318997 COc1cccc2c1nc(c(c2)C(=O)NCCS)Cl 08fb342cf22e00aa4db64f9d2dbb04fd [0,1,0,0,0,0|3,0,0]=4 11 B20R2.318997 COc1cccc2c1oc(=O)c(c2)C(=O)NCC#N 20d0fd30c063594a601a92bb64d3f7eb [0,1,0,0,0,0|1,0,1]=3 12 B20R2.318997 COc1cccc2c1oc(=O)c(c2)C(=O)NCCBr f3bd27b98a9c51502200ec4868fce8c5 [0,1,0,0,0,0|1,0,0]=2 13 B20R2.318997 COc1cccc2c1oc(=O)c(c2)C(=O)NCCF 9964279897db2da52f2018350898f154 [0,1,0,0,0,0|1,0,0]=2 14 B20R2.318997 COc1cccc2c1oc(=O)c(c2)C(=O)NCCI 76bf3b224ffe1f03e82e3a7e2310502d [0,1,0,0,0,0|1,0,0]=2 15 B20R2.318997 COc1cccc2c1oc(=O)c(c2)C(=O)NCCO b1bf3f1d6acf0c80f3e914aaf55c761d [0,1,0,0,0,0|1,0,0]=2 16 B20R2.318997 COc1cccc2c1oc(=O)c(c2)C(=O)NCCS c12fbc237626480358011baada93c392 [0,1,0,0,0,0|1,0,0]=2 17 B20R2.9383536 CCOc1cccc2c1oc(=O)c(c2)C(=O)NC#N 37300706f17c1aa6b930c9deee597e46 [0,1,0,0,0,0|2,0,1]=4 18 B20R2.11770447 COc1cc(cc2c1oc(=O)c(c2)C(=O)NC#N)Br 79abb52e5780e392fc58e7bee6768490 [0,1,0,0,0,0|2,0,1]=4 19 B20R2.14616149 CCN(C)C(=O)c1cc2cccc(c2nc1Cl)OC 9d6976f48d162479735640f79dabee22 [0,1,0,0,0,0|3,0,0]=4 20 B20R2.14616149 CCN(C)C(=O)c1cc2cccc(c2oc1=O)OC c6695edf5dcd49e01c1ffca9e84794fb [0,1,0,0,0,0|1,0,0]=2 21 B18R1.24244 CCOC(=O)C(Nc1cccc(c1)OC)C(=O)C dcb2dcf021c76e25ea30d7049cae06b5 [0,0,1,0,0,0|2,0,1]=4 22 B18R1.24244 CCOC(=O)C(Oc1cccc(c1)OC)C(=O)C 2d4cea8424e68ea58bc91bdde06fa870 [0,0,1,0,0,0|2,0,1]=4 23 B18R1.25575 CCOC(=O)C(C=O)Nc1cccc(c1Br)OC 1a011f5cae33b5a1e6e4f1bf1e3732d1 [0,0,1,0,0,0|2,0,1]=4 24 B18R1.25575 CCOC(=O)C(C=O)Nc1cccc(c1C)OC ac6aa23ae539063a2608354d44e626d1 [0,0,1,0,0,0|2,0,1]=4 25 B18R1.25575 CCOC(=O)C(C=O)Nc1cccc(c1Cl)OC 8689aab17fd307273b9f582746785553 [0,0,1,0,0,0|2,0,1]=4 26 B18R1.25575 CCOC(=O)C(C=O)Nc1cccc(c1F)OC d8f5551a09c6482d1653b5dfd6423899 [0,0,1,0,0,0|2,0,1]=4 27 B18R1.25575 CCOC(=O)C(C=O)Oc1cccc(c1Br)OC 05504bf963e01501383c372298b58355 [0,0,1,0,0,0|2,0,1]=4 28 B18R1.25575 CCOC(=O)C(C=O)Oc1cccc(c1C)OC 9feb8c02d3064670ff1b100ba54146fd [0,0,1,0,0,0|2,0,1]=4 29 B18R1.25575 CCOC(=O)C(C=O)Oc1cccc(c1Cl)OC 682820c6446707d1e545a443da963d9e [0,0,1,0,0,0|2,0,1]=4 30 B18R1.25575 CCOC(=O)C(C=O)Oc1cccc(c1F)OC 5683ea5ecebfc9588862655a4aafc5fb [0,0,1,0,0,0|2,0,1]=4 31 B18R1.25575 CCOC(=O)C(C=O)Oc1cccc(c1I)OC 15862fc737b8e3ae4dfbd3b75f10bad6 [0,0,1,0,0,0|2,0,1]=4 32 B18R1.29852 CCOC(=O)C(=O)C(C)Oc1ccccc1OC 95453d7fb42fff082eef6a6287d23723 [0,0,1,0,0,0|2,0,1]=4 33 B18R1.221819 CCOC(=O)CC(=O)Nc1c(cccc1OC)I c46917a7ba53e265f791eed1d88321d4 [0,0,1,0,0,0|2,0,1]=4 34 B17R1.19274 CCOC(=O)C(C=O)Nc1cccc(c1)OC c92a661a8818833dfb8b8cd3567db906 [1,0,1,0,0,0|1,0,1]=4 35 B17R1.19274 CCOC(=O)C(C=O)Oc1cccc(c1)OC 924f04921f237c83797ae7f6407642fb [1,0,1,0,0,0|1,0,1]=4 36 B17R1.5690 CCCC(=O)C(=O)Nc1cccc(c1O)OC 4b72dfacb4419903f16ed9171e6da7bb [1,0,1,0,0,0|2,0,0]=4 37 B17R1.5690 CCNC(=O)C(=O)Nc1cccc(c1O)OC 0faad4cc7cce03e4d062d4d1a4aba529 [1,0,1,0,0,0|2,0,0]=4 38 B17R1.5690 CCOC(=O)C(=O)Nc1cccc(c1Cl)OC 7ecd84aca6d21e5d10080716603006eb [1,0,1,0,0,0|2,0,0]=4 39 B17R1.5690 CCOC(=O)C(=O)Nc1cccc(c1F)OC a77914f1c43197ab00eaccbb5f02a19c [1,0,1,0,0,0|2,0,0]=4 40 B17R1.5690 CCOC(=O)C(=O)Nc1cccc(c1O)OC ddc08d24b820ff5d212c780be0186201 [1,0,1,0,0,0|1,0,0]=3 41 B17R1.5015 C=C(COc1ccccc1CC)C(=O)OCC 4a1449b094dcc196e1449fcc33a7e0fc [1,0,1,0,0,0|1,0,1]=4 42 B17R1.5015 C=C(COc1cccnc1OC)C(=O)OCC 8b52a7c5ef2bcac6ecfd38cb871bb99f [1,0,1,0,0,0|1,0,1]=4 43 B17R1.5015 C=C(COc1ccncc1OC)C(=O)OCC 7aed8e199bbf74ac3d2c73690bf40870 [1,0,1,0,0,0|1,0,1]=4 44 B17R1.5015 C=C(COc1cnccc1OC)C(=O)OCC de1d0160b742254e0d802589c178f7ac [1,0,1,0,0,0|1,0,1]=4 45 B17R1.125642 CCOC(=O)CNc1cccc(c1C=O)OC 3828b15c7b497ab3bacaf9d19c25724a [1,0,1,0,0,0|1,0,1]=4 46 B17R1.125642 CCOC(=O)COc1cccc(c1C=O)OC c565eb3679c913dd87de55a645b75cf0 [1,0,1,0,0,0|1,0,1]=4 47 B17R1.31993 CCO/C=C/C(=O)Nc1c(cccc1OC)C 7763a4756bf6f81bba2c69b8232ad042 [1,0,1,0,0,0|1,0,1]=4 48 B17R1.31993 CCO/C=C/C(=O)Nc1c(cccc1OC)Cl cbe7de5547a3e5ef7417d60c17673eca [1,0,1,0,0,0|2,0,0]=4 49 B17R1.31993 CCO/C=C/C(=O)Nc1c(cccc1OC)I ee3166cb5571d3e0db10f13a16cee68f [1,0,1,0,0,0|2,0,0]=4 50 B17R1.31993 CCO/C=C/C(=O)Nc1c(cccc1OC)O 7b29e337bb96a8c24b9088d5673e488e [1,0,1,0,0,0|2,0,0]=4 51 B17R1.31993 CCO/C=C/C(=O)Nc1c(cccc1OC)S 529f0b87350be8f470ad1f9f491478ff [1,0,1,0,0,0|2,0,0]=4 52 B17R1.31993 CCOC=CC(=O)Nc1c(cccc1OC)C 941727ddfc97988ce1465ec56bb209b5 [1,0,1,0,0,0|1,0,1]=4 53 B17R1.31993 CCOC=CC(=O)Nc1c(cccc1OC)Cl edde8b018016c4fd1214e6e55e43d383 [1,0,1,0,0,0|2,0,0]=4 54 B17R1.31993 CCOC=CC(=O)Nc1c(cccc1OC)I 8edfe40a81b26bfbed772126a8329e3b [1,0,1,0,0,0|2,0,0]=4 55 B17R1.31993 CCOC=CC(=O)Nc1c(cccc1OC)O 4f7d43770667b9f80b31091a55a535f3 [1,0,1,0,0,0|2,0,0]=4 56 B17R1.31993 CCOC=CC(=O)Nc1c(cccc1OC)S 1d02fd9fc43e62fb69fad0f606ebee2f [1,0,1,0,0,0|2,0,0]=4 57 B19R1.1565887 CCOC(=O)C(C=O)Nc1cccc(c1CO)OC 9157420721e093b122c1dd44861be122 [0,1,1,0,0,0|1,0,1]=4 58 B19R1.1565887 CCOC(=O)C(C=O)Nc1cccc(c1OC)OC 6eeaea9927fecdeca1132581784f044c [0,1,1,0,0,0|1,0,1]=4 59 B19R1.1565887 CCOC(=O)C(C=O)Oc1cccc(c1OC)OC f0c220a0c8311c2d9dc2ac3c5580e705 [0,1,1,0,0,0|1,0,1]=4 60 B19R1.364487 CCOC(=O)CC(=O)Nc1c(cccc1OC)C=O 9e2e6c54daba2c1959aae22768fef35c [0,1,1,0,0,0|1,0,1]=4 61 B19R2.1596 CCCNC(=O)C1=Cc2cccc(c2OC1)OC 5783e793e84cb1645f86456e638c46b5 [1,1,0,0,0,0|1,0,1]=4 62 B19R2.1596 CCCNC(=O)c1cnc2c(cccc2c1)OC 57a89bf110ea357f6255ba7ef154345a [1,1,0,0,0,0|2,0,0]=4 63 B19R2.1596 COc1cccc2c1OCC(=C2)C(=O)NCCBr 851e52a122b78c96771b5dc95a5b2be8 [1,1,0,0,0,0|1,0,1]=4 64 B19R2.1596 COc1cccc2c1OCC(=C2)C(=O)NCCF 3ff2b33a696a98caa887a5605e2f7633 [1,1,0,0,0,0|1,0,1]=4 65 B19R2.1596 COc1cccc2c1OCC(=C2)C(=O)NCCI 891530da8f9d56275681a71889e59c73 [1,1,0,0,0,0|1,0,1]=4 66 B19R2.1596 COc1cccc2c1OCC(=C2)C(=O)NCCO 40db7a5d73b0d803854eb78f96a4cebf [1,1,0,0,0,0|1,0,1]=4 67 B19R2.1596 COc1cccc2c1OCC(=C2)C(=O)NCCS 752c071c514f761d1d4955bbabf5a9dd [1,1,0,0,0,0|1,0,1]=4 68 B19R2.1596 COc1cccc2c1ncc(c2)C(=O)NCCBr 8ab4a3c8def874b3f0c36f0b24613f48 [1,1,0,0,0,0|2,0,0]=4 69 B19R2.1596 COc1cccc2c1ncc(c2)C(=O)NCCF 0d4d530714acdc7e4adb85c64b1d7728 [1,1,0,0,0,0|2,0,0]=4 70 B19R2.1596 COc1cccc2c1ncc(c2)C(=O)NCCI 5a297e7ecf8963f4035d53e57b0e5116 [1,1,0,0,0,0|2,0,0]=4 71 B19R2.1596 COc1cccc2c1ncc(c2)C(=O)NCCO 20f2bad736ce7d480dd17c2be1ecf0a1 [1,1,0,0,0,0|2,0,0]=4 72 B19R2.1596 COc1cccc2c1ncc(c2)C(=O)NCCS 8bd57dea99aeeb2073c3a0fe0e0585ea [1,1,0,0,0,0|2,0,0]=4 73 B19R2.80971 CCNc1cccc2c1ncc(c2)C(=O)OCC deb19936dd18c40d2e27ba80fd233841 [1,1,0,0,0,0|2,0,0]=4 74 B19R2.80971 CCOC(=O)c1cnc2c(cccc2c1)NCF 24d1d964d36e923291b7e5adc6ea6635 [1,1,0,0,0,0|2,0,0]=4 75 B19R2.80971 CCOC(=O)c1cnc2c(cccc2c1)NCO a5e69283040c60c03612e0e64cf2ecb6 [1,1,0,0,0,0|2,0,0]=4 76 B19R2.80971 CCOC(=O)c1cnc2c(cccc2c1)OCC f4a00f7f58f12ee2b196a0693008a18e [1,1,0,0,0,0|1,0,0]=3 77 B19R2.80971 CCOC(=O)c1cnc2c(cccc2c1)OCF 8dbe64c5bd34b220838f70d00dceca29 [1,1,0,0,0,0|1,0,0]=3 78 B19R2.171264 CCN(C)C(=O)C1=Cc2cccc(c2OC1)OC 43c97ed0f063d370bd8788b1924063b1 [1,1,0,0,0,0|1,0,1]=4 79 B19R2.171264 CCN(C)C(=O)c1cnc2c(cccc2c1)OC 7634349cdd43c8f006f34426d1231ac8 [1,1,0,0,0,0|2,0,0]=4 80 B19R2.200827 C#CCNC(=O)c1cc2cccc(c2oc1=O)C df81890ef9cbbfbb9e27bd1672a08402 [1,1,0,0,0,0|1,0,1]=4 81 B19R2.200827 C#CCNC(=O)c1cc2cccc(c2oc1=O)O 47a6965752401dba74c8daf1c070a6ca [1,1,0,0,0,0|1,0,1]=4 82 B19R2.200827 CCCNC(=O)c1cc2cccc(c2oc1=O)Br c01d3c97c04d68e86f5d98305a395e61 [1,1,0,0,0,0|2,0,0]=4 83 B19R2.200827 CCCNC(=O)c1cc2cccc(c2oc1=O)C 910c92704103072a46ab1399dcb5b3a9 [1,1,0,0,0,0|1,0,0]=3 84 B19R2.200827 CCCNC(=O)c1cc2cccc(c2oc1=O)Cl 9e4dad9184629ec1131c48f8bdc38fd5 [1,1,0,0,0,0|2,0,0]=4 85 B19R2.200827 CCCNC(=O)c1cc2cccc(c2oc1=O)F c386feed1d9df61f85429990b224599d [1,1,0,0,0,0|2,0,0]=4 86 B19R2.200827 CCCNC(=O)c1cc2cccc(c2oc1=O)O c865bb556e1d69dec3958e54942620ea [1,1,0,0,0,0|1,0,0]=3 87 B19R2.200827 Cc1cccc2c1oc(=O)c(c2)C(=O)NCC#N aaf0c6a8d0131250a569cfc5b07da38a [1,1,0,0,0,0|1,0,1]=4 88 B19R2.200827 Cc1cccc2c1oc(=O)c(c2)C(=O)NCCBr 9a693addba40547d2a686a3375df7719 [1,1,0,0,0,0|1,0,0]=3 89 B19R2.200827 Cc1cccc2c1oc(=O)c(c2)C(=O)NCCF 9bd1998b343cfe5c11143b3c3a3fe1f9 [1,1,0,0,0,0|1,0,0]=3 90 B19R2.200827 Cc1cccc2c1oc(=O)c(c2)C(=O)NCCI 7c4f62db318574cf81c380d3da24e857 [1,1,0,0,0,0|1,0,0]=3 91 B19R2.200827 Cc1cccc2c1oc(=O)c(c2)C(=O)NCCO d1943f315754410f372c89c9e4051dea [1,1,0,0,0,0|1,0,0]=3 92 B19R2.200827 Cc1cccc2c1oc(=O)c(c2)C(=O)NCCS f718f2e99079800b39aa9527b96a3336 [1,1,0,0,0,0|1,0,0]=3 93 B19R2.200827 N#CCNC(=O)c1cc2cccc(c2oc1=O)O 18933e20d904f97cae72015e03603747 [1,1,0,0,0,0|1,0,1]=4 94 B19R2.200827 O=C(NCCBr)c1cc2cccc(c2oc1=O)Br 893d1f45dcf5971653c762a1f94bb00b [1,1,0,0,0,0|2,0,0]=4 95 B19R2.200827 O=C(NCCBr)c1cc2cccc(c2oc1=O)Cl de40096d7af71ddc45984e363a520a6f [1,1,0,0,0,0|2,0,0]=4 96 B19R2.200827 O=C(NCCBr)c1cc2cccc(c2oc1=O)F c2d95461ec2fbfbdbd1b62edd3554d27 [1,1,0,0,0,0|2,0,0]=4 97 B19R2.200827 O=C(NCCBr)c1cc2cccc(c2oc1=O)O fa69e09871565993042b6caa110730fd [1,1,0,0,0,0|1,0,0]=3 98 B19R2.200827 O=C(NCCF)c1cc2cccc(c2oc1=O)Br 1dbe8cf869ae9bcb2c103b7cbf169113 [1,1,0,0,0,0|2,0,0]=4 99 B19R2.200827 O=C(NCCF)c1cc2cccc(c2oc1=O)Cl 27d639deafaa91926bc9f974e62029a8 [1,1,0,0,0,0|2,0,0]=4 100 B19R2.200827 O=C(NCCF)c1cc2cccc(c2oc1=O)F d1d09e0d9eb3162321479f22b864ced8 [1,1,0,0,0,0|2,0,0]=4 101 B19R2.200827 O=C(NCCF)c1cc2cccc(c2oc1=O)O 419da43b1b91ba38877c6084efe102d5 [1,1,0,0,0,0|1,0,0]=3 102 B19R2.200827 O=C(NCCI)c1cc2cccc(c2oc1=O)Br 1ed70cf20f3bb56d79314c077a3ac079 [1,1,0,0,0,0|2,0,0]=4 103 B19R2.200827 O=C(NCCI)c1cc2cccc(c2oc1=O)Cl 1c9b7fb0a91e9bcfa2e63d2a6bd884ec [1,1,0,0,0,0|2,0,0]=4 104 B19R2.200827 O=C(NCCI)c1cc2cccc(c2oc1=O)F d5199230f4d1f1ab5560c423af37a3d8 [1,1,0,0,0,0|2,0,0]=4 105 B19R2.200827 O=C(NCCI)c1cc2cccc(c2oc1=O)O 03a18a79b53277c375d0399660bc9375 [1,1,0,0,0,0|1,0,0]=3 106 B19R2.200827 O=C(NCCO)c1cc2cccc(c2oc1=O)Br 2b39a8b66b61d72ada7a5bd7f6a11a2d [1,1,0,0,0,0|2,0,0]=4 107 B19R2.200827 O=C(NCCO)c1cc2cccc(c2oc1=O)Cl 79f4e98def6b8e3ba5380de6e2bd4326 [1,1,0,0,0,0|2,0,0]=4 108 B19R2.200827 O=C(NCCO)c1cc2cccc(c2oc1=O)F 2cedb494accd72ecd3bc6a63b3e08b28 [1,1,0,0,0,0|2,0,0]=4 109 B19R2.200827 O=C(NCCO)c1cc2cccc(c2oc1=O)O 55e7214b6e3463466b8367d56e723dc7 [1,1,0,0,0,0|1,0,0]=3 110 B19R2.200827 O=C(NCCS)c1cc2cccc(c2oc1=O)Br 388181d85f589c33cd39f8b0e7f335e4 [1,1,0,0,0,0|2,0,0]=4 111 B19R2.200827 O=C(NCCS)c1cc2cccc(c2oc1=O)Cl 558388810de8a5e29bc1cb592aeca6b7 [1,1,0,0,0,0|2,0,0]=4 112 B19R2.200827 O=C(NCCS)c1cc2cccc(c2oc1=O)F b22b42cb154bf93afda8cdfc95eab189 [1,1,0,0,0,0|2,0,0]=4 113 B19R2.200827 O=C(NCCS)c1cc2cccc(c2oc1=O)O 24394e1a9d9f5b8045bf2cdaa4d41517 [1,1,0,0,0,0|1,0,0]=3 114 B19R2.206184 CCN(C)C(=O)c1cc2cccc(c2oc1=O)Br 6e65451ac1e7a5febd7827f536053438 [1,1,0,0,0,0|2,0,0]=4 115 B19R2.206184 CCN(C)C(=O)c1cc2cccc(c2oc1=O)C 8ebe272f847a1e4b7537d38595bd814c [1,1,0,0,0,0|1,0,0]=3 116 B19R2.206184 CCN(C)C(=O)c1cc2cccc(c2oc1=O)Cl c51588cee5a16623af4e1b0ede9afe41 [1,1,0,0,0,0|2,0,0]=4 117 B19R2.206184 CCN(C)C(=O)c1cc2cccc(c2oc1=O)F 7cf04d6873301435abdeaa632bec8857 [1,1,0,0,0,0|2,0,0]=4 118 B19R2.206184 CCN(C)C(=O)c1cc2cccc(c2oc1=O)O 9547ed9206b64a46dfe5cfd5fdda5a8c [1,1,0,0,0,0|1,0,0]=3 119 B19R2.780311 CCOC(=O)c1oc2cccc(c2c1C)OCC aab76d737031c77ce8390941dcdd6441 [0,1,0,0,1,0|2,0,0]=4 120 B19R2.780311 CCOC(=O)c1oc2cccc(c2c1C)OCF 5121eb4b5f2eec75b77fba14720113d1 [0,1,0,0,1,0|2,0,0]=4 121 B21R2.518141 C#CCCNC(=O)c1cc2cccc(c2oc1=O)OC 0c4ff6553caf69f6d12eab2e012f517e [0,2,0,0,0,0|1,0,0]=3 122 B21R2.518141 C=CCCNC(=O)c1cc2cccc(c2oc1=O)OC 6271ac6d6d54d98aff5f0047449250a9 [0,2,0,0,0,0|1,0,0]=3 123 B21R2.518141 CC#CCNC(=O)c1cc2cccc(c2oc1=O)OC e97fe6c9b1ee54ff05e91b0a7a0c674d [0,2,0,0,0,0|1,0,0]=3 124 B21R2.518141 CC=CCNC(=O)c1cc2cccc(c2oc1=O)OC f165fb6ca35cc4b31d65af59aaff3834 [0,2,0,0,0,0|1,0,0]=3 125 B21R2.518141 CCCCNC(=O)c1cc2cccc(c2oc1=O)OC 45770a99a354a86468a588577b775602 [0,2,0,0,0,0|1,0,0]=3 126 B21R2.518141 COCCNC(=O)c1cc2cccc(c2oc1=O)OC f7f899f33dd4764ecfcb219957f45049 [0,2,0,0,0,0|1,0,0]=3 127 B21R2.518141 COc1cccc2c1oc(=O)c(c2)C(=O)NCCC#N 90697ddd44baeb65c10d2fc0e5a492ae [0,2,0,0,0,0|1,0,0]=3 128 B21R2.518141 COc1cccc2c1oc(=O)c(c2)C(=O)NCCCCl 91b793e77f8cbc7cac663dc7990dd160 [0,2,0,0,0,0|1,0,0]=3 129 B21R2.518141 COc1cccc2c1oc(=O)c(c2)C(=O)NCCCO 257d39cb47a0583e510656796e11d799 [0,2,0,0,0,0|1,0,0]=3 130 B21R2.518141 COc1cccc2c1oc(=O)c(c2)C(=O)NCCON 46c12848cb65a40f43f59e11f4e19134 [0,2,0,0,0,0|1,0,0]=3 131 B21R2.518141 COc1cccc2c1oc(=O)c(c2)C(=O)NCCSC 1b00fd903b3624c40dfde9b4d5804dba [0,2,0,0,0,0|1,0,0]=3 132 B21R2.2059226 C#CCNC(=O)c1cc2cccc(c2oc1=O)OCC cf16f01f516f106028e5fe8f1a73ec99 [0,2,0,0,0,0|1,0,1]=4 133 B21R2.2059226 CCCNC(=O)c1cc2cccc(c2oc1=O)OCC 4a82b04e5c6521d92323a1cc9e3481cf [0,2,0,0,0,0|1,0,0]=3 134 B21R2.2059226 CCOc1cccc2c1oc(=O)c(c2)C(=O)NCC#N ac9e4bec1d2ece7c9b51f926bb3afbb5 [0,2,0,0,0,0|1,0,1]=4 135 B21R2.2059226 CCOc1cccc2c1oc(=O)c(c2)C(=O)NCCBr c0c3a1e43fbf28a4a56379633e76f861 [0,2,0,0,0,0|1,0,0]=3 136 B21R2.2059226 CCOc1cccc2c1oc(=O)c(c2)C(=O)NCCF 0e2ad8e3debccef054fca99b137bc924 [0,2,0,0,0,0|1,0,0]=3 137 B21R2.2059226 CCOc1cccc2c1oc(=O)c(c2)C(=O)NCCI 28649cb41a7480e68de668f4be83823f [0,2,0,0,0,0|1,0,0]=3 138 B21R2.2059226 CCOc1cccc2c1oc(=O)c(c2)C(=O)NCCO ab5e66c11ba2da6cf05fc5fa60721fd3 [0,2,0,0,0,0|1,0,0]=3 139 B21R2.2059226 CCOc1cccc2c1oc(=O)c(c2)C(=O)NCCS 92f99087b2808d3591568d261bf53587 [0,2,0,0,0,0|1,0,0]=3 140 B21R2.12626831 C#CCNC(=O)c1cc2cc(cc(c2oc1=O)OC)Br bd5cd8945a87257a4adbe42541c2ef97 [0,2,0,0,0,0|1,0,1]=4 141 B21R2.12626831 CCCNC(=O)c1cc2cc(cc(c2oc1=O)OC)Br 185edbd533f1d30d1f4ef0886637ffc4 [0,2,0,0,0,0|1,0,0]=3 142 B21R2.12626831 COc1cc(cc2c1oc(=O)c(c2)C(=O)NCC#N)Br 3a57befaf812c6af344a026d1de8e0ac [0,2,0,0,0,0|1,0,1]=4 143 B21R2.12626831 COc1cc(cc2c1oc(=O)c(c2)C(=O)NCCBr)Br 5ea71fa55418b5ea1becd7df21e4ee8a [0,2,0,0,0,0|1,0,0]=3 144 B21R2.12626831 COc1cc(cc2c1oc(=O)c(c2)C(=O)NCCF)Br cd717013e7d1c09665e557378ca4d586 [0,2,0,0,0,0|1,0,0]=3 145 B21R2.12626831 COc1cc(cc2c1oc(=O)c(c2)C(=O)NCCI)Br c10b215fb79eb3d35d16c3ea5b17bbec [0,2,0,0,0,0|1,0,0]=3 146 B21R2.12626831 COc1cc(cc2c1oc(=O)c(c2)C(=O)NCCO)Br 8ecb811c8b285023431cd15b239ec0ad [0,2,0,0,0,0|1,0,0]=3 147 B21R2.12626831 COc1cc(cc2c1oc(=O)c(c2)C(=O)NCCS)Br 2b27b42d8dbdda19c5b63423c6c7f002 [0,2,0,0,0,0|1,0,0]=3 148 B21R2.27617457 C=C(Br)CNC(=O)c1cc2cccc(c2oc1=O)OC 56212456afd6bef848d3aebb0c52ae73 [0,2,0,0,0,0|1,0,1]=4 149 B21R2.27617457 C=C(C)CNC(=O)c1cc2cccc(c2oc1=O)OC 1a3e460f85e67389020d2e6a1307ccc1 [0,2,0,0,0,0|1,0,0]=3 150 B21R2.27617457 COc1cccc2c1oc(=O)c(c2)C(=O)NCC(=O)C 8e38e9eba39e543089d673a6fdebe39b [0,2,0,0,0,0|1,0,0]=3 151 B21R2.27617457 COc1cccc2c1oc(=O)c(c2)C(=O)NCC(=O)N 8c6340fafa1aadbecb1b98a1cd05a974 [0,2,0,0,0,0|1,0,1]=4 152 B21R2.27617457 COc1cccc2c1oc(=O)c(c2)C(=O)NCC(C)C 5ed801991c795cfaed90b9f561c8126d [0,2,0,0,0,0|1,0,0]=3 153 B21R2.27617457 COc1cccc2c1oc(=O)c(c2)C(=O)NCC(C)O c7e2c4d036406081a2793576a094dc08 [0,2,0,0,0,0|1,0,0]=3 154 B21R2.27617457 COc1cccc2c1oc(=O)c(c2)C(=O)NCC(F)F 5e2216d62a1f33500e9d5c14e1b4590a [0,2,0,0,0,0|1,0,0]=3 155 B21R2.27617457 COc1cccc2c1oc(=O)c(c2)C(=O)NC[C@@H](C)O 0955ba0d0f0b7ee8548253bef484d1e6 [0,2,0,0,0,0|1,0,0]=3 156 B21R2.27617457 COc1cccc2c1oc(=O)c(c2)C(=O)NC[C@H](C)O 3adb4ad6e329c7adec3f9934b721202e [0,2,0,0,0,0|1,0,0]=3 157 B21R2.27617520 C#CC(C)NC(=O)c1cc2cccc(c2oc1=O)OC e1fc74eb313f79ccc89125dc9757204d [0,2,0,0,0,0|1,0,0]=3 158 B21R2.27617520 C#C[C@@H](C)NC(=O)c1cc2cccc(c2oc1=O)OC c98420939a9cf83a20f9984d04d0eae2 [0,2,0,0,0,0|1,0,0]=3 159 B21R2.27617520 C#C[C@H](C)NC(=O)c1cc2cccc(c2oc1=O)OC f3d45ef9ea0432a25e2ae2154549cecf [0,2,0,0,0,0|1,0,0]=3 160 B21R2.27617520 C=CC(C)NC(=O)c1cc2cccc(c2oc1=O)OC 663fecf6b537e24b8623d92de1033f5f [0,2,0,0,0,0|1,0,0]=3 161 B21R2.27617520 CCC(C)NC(=O)c1cc2cccc(c2oc1=O)OC 45baa083494c5c6675540b5cc88f057a [0,2,0,0,0,0|1,0,0]=3 162 B21R2.27617520 CC[C@@H](C)NC(=O)c1cc2cccc(c2oc1=O)OC 1cda7d6de06a73b9661b3d43484e79df [0,2,0,0,0,0|1,0,0]=3 163 B21R2.27617520 CC[C@H](C)NC(=O)c1cc2cccc(c2oc1=O)OC 4c7f6614c454c48687ccc9e9c7ecfb08 [0,2,0,0,0,0|1,0,0]=3 164 B21R2.27617520 COc1cccc2c1oc(=O)c(c2)C(=O)NC(C)C#N 74126972eb31546a5e505dd3faec3ff2 [0,2,0,0,0,0|1,0,0]=3 165 B21R2.27617520 COc1cccc2c1oc(=O)c(c2)C(=O)NC(C)CO 3c83f440dcfd5ac11ac98df1fb8eaa8e [0,2,0,0,0,0|1,0,0]=3 166 B21R2.27617520 COc1cccc2c1oc(=O)c(c2)C(=O)N[C@@H](C)CO cf92dcf29cb956df5f3d514e1d9b99f0 [0,2,0,0,0,0|1,0,0]=3 167 B21R2.27617520 COc1cccc2c1oc(=O)c(c2)C(=O)N[C@H](C)CO 796ac98b49aa35d7544c11343c62cf1d [0,2,0,0,0,0|1,0,0]=3 168 B21R2.16580505 CCOc1cccc2c1oc(=O)c(c2)C(=O)N(C)CC c744640403d4f0e5fafaa3178d220adf [0,2,0,0,0,0|1,0,0]=3 169 B21R2.29178761 CCN(C)C(=O)c1cc2cc(cc(c2oc1=O)OC)Br f883b3e9b970d993a2f549b53947ff0e [0,2,0,0,0,0|1,0,0]=3 170 B21R2.27617455 COc1cccc2c1oc(=O)c(c2)C(=O)N(C)C(C)C 0d3d057ad49da6c6dafa8051279f279e [0,2,0,0,0,0|1,0,0]=3 171 B21R2.27617458 COc1cccc2c1oc(=O)c(c2)C(=O)NC(C)(C)C fa19c53d49606e3da0d50d3c22aa387a [0,2,0,0,0,0|1,0,0]=3 172 B19R2.294209 COc1cccc(c1)c2c(oc(c2C(=O)O)C)C 36d17bd04816ec820055f7dc39e2ebdc [0,0,1,1,0,0|1,0,1]=4 173 B19R2.811033 CCOc1cc2ccc(cc2cc1C(=O)O)OC f3f25fe5ea3a3232e08aab2462d216df [0,0,1,1,0,0|1,0,0]=3 174 B19R2.811033 CCOc1nc2ccc(cc2cc1C(=O)O)OC d0fb6dd5cf0e9c1ae399b7e61b945702 [0,0,1,1,0,0|1,0,0]=3 175 B19R2.811033 COc1ccc2cc(c(cc2c1)C(=O)O)OCF d459665f8bf92cec5d7d9c4dacf2cb91 [0,0,1,1,0,0|2,0,0]=4 176 B19R2.811033 COc1ccc2nc(c(cc2c1)C(=O)O)OCF edacf362fc8bbb0f8c9954f634036ab4 [0,0,1,1,0,0|2,0,0]=4 177 B21R3.56729915 COc1cccc2c1oc(=O)c(c2)C(=O)N3CCC3 4412d4c5d903ea0fd595f1211067a559 [0,1,0,1,0,0|1,0,0]=3 178 B21R3.56729916 COc1cccc2c1oc(=O)c(c2)C(=O)NC3CC3 67f3bf43009e176a3c6c96b35516ba20 [0,1,0,1,0,0|1,0,0]=3 179 B17R1.43176 CCOC(=O)C(=O)Nc1c(cccc1OC)I 5d5e9e71f19a2b1a3cde66054720085a [0,0,1,0,1,0|2,0,0]=4 180 B17R2.50070 CCOC(C)c1cc2cccc(c2o1)OC 8a7b06fd088b7619f319d715a6454c36 [1,0,0,0,1,0|1,0,1]=4 181 B19R1.30476 CCOC(=O)[C@H](CC(=O)O)Nc1cccc(c1)OC 9c8a7d85d54b841f749d251ac1dee88e [0,0,1,0,0,1|1,0,1]=4 182 B19R1.38772 C=C(CC(=O)OCC)C(=O)Nc1ccccc1CC 4659ee4d1945f7761a70380d0404b56c [0,0,1,0,0,1|2,0,0]=4 183 B19R1.38772 C=C(CC(=O)OCC)C(=O)Nc1ncccc1OC 3c1ff1315cf241f4b888638b7d15ee78 [0,0,1,0,0,1|2,0,0]=4 184 B19R1.325951 C=C(CC(=O)Nc1ccccc1CC)C(=O)OCC 5f7b554dac622e5ba09f72d5b5b5a476 [0,0,1,0,0,1|2,0,0]=4 185 B19R1.325951 C=C(CC(=O)Nc1ccccc1OC)C(=O)OCC 4e094c8081b266ceaa40ad4437a447c9 [0,0,1,0,0,1|1,0,0]=3 186 B19R1.325951 C=C(CC(=O)Nc1ccccc1SC)C(=O)OCC 99c2825c6e02dff0446cd84003a34daa [0,0,1,0,0,1|1,1,0]=4 187 B19R1.325951 C=C(CC(=O)Nc1cccnc1OC)C(=O)OCC aa15d4ecf76f5ec47cfe31cd4f2384ab [0,0,1,0,0,1|2,0,0]=4 188 B19R1.325951 C=C(CC(=O)Nc1ncccc1OC)C(=O)OCC a146b654c467a6d35b2b0e64fa349a18 [0,0,1,0,0,1|2,0,0]=4 189 B19R1.359203 CCOC(=O)/C=C/C(=O)Nc1c(cccc1OC)C 86387141f384e2211e5b02adf10103f8 [0,0,1,0,0,1|1,0,1]=4 190 B19R1.359203 CCOC(=O)/C=C/C(=O)Nc1c(cccc1OC)Cl ecbba6008b66b2952e6004f640ee0ff1 [0,0,1,0,0,1|2,0,0]=4 191 B19R1.359203 CCOC(=O)/C=C/C(=O)Nc1c(cccc1OC)F 477d21a2e45fd7aa18e4ae0aeed61d28 [0,0,1,0,0,1|2,0,0]=4 192 B19R1.359203 CCOC(=O)/C=C/C(=O)Nc1c(cccc1OC)I f7f202f78219db0c15da9781a173953e [0,0,1,0,0,1|2,0,0]=4 193 B19R1.359203 CCOC(=O)/C=C/C(=O)Nc1c(cccc1OC)O c882ffda6f36ab698e0e9f511db4e548 [0,0,1,0,0,1|2,0,0]=4 194 B19R1.359203 CCOC(=O)/C=C/C(=O)Nc1c(cccc1OC)S 05cb4603bfb5ff73e19f77c13dfb4d94 [0,0,1,0,0,1|2,0,0]=4 195 B19R1.359203 CCOC(=O)/C=C\C(=O)Nc1c(cccc1OC)C 120098f8c1f7a41ff00aeda3e303b539 [0,0,1,0,0,1|1,0,1]=4 196 B19R1.359203 CCOC(=O)/C=C\C(=O)Nc1c(cccc1OC)Cl 1f49da3ebf34a717ad90d514a00850a9 [0,0,1,0,0,1|2,0,0]=4 197 B19R1.359203 CCOC(=O)/C=C\C(=O)Nc1c(cccc1OC)F f8932377d0c94bcbd479549692e58306 [0,0,1,0,0,1|2,0,0]=4 198 B19R1.359203 CCOC(=O)/C=C\C(=O)Nc1c(cccc1OC)I 30229cbea990d4e7f358df0780e35b43 [0,0,1,0,0,1|2,0,0]=4 199 B19R1.359203 CCOC(=O)/C=C\C(=O)Nc1c(cccc1OC)O adc91a8cc410d6a80e855144ef7c0198 [0,0,1,0,0,1|2,0,0]=4 200 B19R1.359203 CCOC(=O)/C=C\C(=O)Nc1c(cccc1OC)S 71a7cf20583fb663166c0447070c27a6 [0,0,1,0,0,1|2,0,0]=4 201 B19R1.359203 CCOC(=O)C=CC(=O)Nc1c(cccc1OC)C c696279938cf174d2fd1e758663d4438 [0,0,1,0,0,1|1,0,1]=4 202 B19R1.359203 CCOC(=O)C=CC(=O)Nc1c(cccc1OC)Cl 2740244fbaccd5358ec54e234b77d9a0 [0,0,1,0,0,1|2,0,0]=4 203 B19R1.359203 CCOC(=O)C=CC(=O)Nc1c(cccc1OC)F b171ac3fa79e58747f368c239c043d8f [0,0,1,0,0,1|2,0,0]=4 204 B19R1.359203 CCOC(=O)C=CC(=O)Nc1c(cccc1OC)I fe31432b0466082e0ab4df9358485a12 [0,0,1,0,0,1|2,0,0]=4 205 B19R1.359203 CCOC(=O)C=CC(=O)Nc1c(cccc1OC)O 8255dcd0c0788f24127120f291cb4abd [0,0,1,0,0,1|2,0,0]=4 206 B19R1.359203 CCOC(=O)C=CC(=O)Nc1c(cccc1OC)S 74471b156ac103959eef024a7437d74b [0,0,1,0,0,1|2,0,0]=4 207 B19R1.523087 CCOC(=O)/C=C(\C)/COc1c(cccc1OC)C 0e5a6e8ddd4ce40ffaddf409e5d5b3d4 [0,0,1,0,0,1|1,0,1]=4