0 B13R0.1398 CC(=CCC/C(=C/CNC(C)C)/C)C 97ce2c76992fcf39cb0cc971b075779c [0,0,0,0,0,0|2,0,2]=4 1 B13R0.1398 CC(=CCC/C(=C/COC(C)C)/C)C 4c8fce43fb0b0448295602c3bcc729bf [0,0,0,0,0,0|2,0,2]=4 2 B13R0.1398 CC(=CCC/C(=C\COC(C)C)/C)C e4ef46d8fdea83bccf5f18570b2840b1 [0,0,0,0,0,0|2,0,2]=4 3 B13R0.1398 CC(=CCCC(=CCNC(C)C)C)C 5b914b06ce2ac03b80f4ba57e1f13cf5 [0,0,0,0,0,0|2,0,2]=4 4 B13R0.1398 CC(=CCCC(=O)NCC=C(C)C)C 5814e5f690744ea4ae3966f91335e226 [0,0,0,0,0,0|3,0,1]=4 5 B13R0.1398 CC(=CCCC(C)OC/C=C(/C)\I)C 5641b21d5bb2cd8aebc1c46e777af352 [0,0,0,0,0,0|2,0,2]=4 6 B13R0.1398 CC(=CCCC(C)OC/C=C(\C)/Cl)C 94bf7893dd887ca29ee665fc91aed973 [0,0,0,0,0,0|2,0,2]=4 7 B13R0.1398 CC(=CCCC(C)OCC=C(C)C)C ed5dd4115ca1f7dfd14bf13c0d884e9f [0,0,0,0,0,0|2,0,2]=4 8 B13R0.1398 CC(=CCCC(C)OCC=C(C)Cl)C b64008a0846eb70c591ad53a5a7e2db0 [0,0,0,0,0,0|2,0,2]=4 9 B13R0.1398 CC(=CCCC(C)OCC=C(C)I)C b851ca6817119e2220035c16441c081e [0,0,0,0,0,0|2,0,2]=4 10 B13R0.1398 CC(=CCC[C@@H](C)OC/C=C(/C)\I)C 6d286ce50fe7403e41804d74523fbb21 [0,0,0,0,0,0|2,0,2]=4 11 B13R0.1398 CC(=CCC[C@@H](C)OC/C=C(\C)/Cl)C 6c97048506216277743fc43123d7ede8 [0,0,0,0,0,0|2,0,2]=4 12 B13R0.1398 CC(=CCC[C@@H](C)OCC=C(C)C)C f7b6285c32a1e09a91be152ba02fd294 [0,0,0,0,0,0|2,0,2]=4 13 B13R0.1398 CC(=CCC[C@@H](C)OCC=C(C)Cl)C 490142f808fbb66a0b39ac543aec0e07 [0,0,0,0,0,0|2,0,2]=4 14 B13R0.1398 CC(=CCC[C@@H](C)OCC=C(C)I)C 32836ec4b16a104b482cac05ef22061d [0,0,0,0,0,0|2,0,2]=4 15 B13R0.1398 CC(=CCC[C@H](C)OC/C=C(/C)\I)C 0c15e9448b50be21a7f9990a65b72477 [0,0,0,0,0,0|2,0,2]=4 16 B13R0.1398 CC(=CCC[C@H](C)OC/C=C(\C)/Cl)C 85fb20c93349300df3597eab9f341a05 [0,0,0,0,0,0|2,0,2]=4 17 B13R0.1398 CC(=CCC[C@H](C)OCC=C(C)C)C c174aa443c05760eb97d6577bcbf908e [0,0,0,0,0,0|2,0,2]=4 18 B13R0.1398 CC(=CCC[C@H](C)OCC=C(C)Cl)C 5efa50bd06bb8ee9670d4bf86066b02b [0,0,0,0,0,0|2,0,2]=4 19 B13R0.1398 CC(=CCC[C@H](C)OCC=C(C)I)C e25584af994fc50f8bba1a768849c840 [0,0,0,0,0,0|2,0,2]=4 20 B13R0.1398 CC(=O)CCOC(C)CCC=C(C)C f3276fc2bfccbfaea42b680b8a111808 [0,0,0,0,0,0|1,0,3]=4 21 B13R0.1398 CC(=O)CCO[C@@H](C)CCC=C(C)C c52dd060b622636cf122ab78c833af13 [0,0,0,0,0,0|1,0,3]=4 22 B13R0.1398 CC(=O)CCO[C@H](C)CCC=C(C)C f686836c4881fc26fbe00a9db03eb3ce [0,0,0,0,0,0|1,0,3]=4 23 B13R0.1398 CC(=O)NC/C=C(\C)/CCC=C(C)C 9cc4debf6b69ae7adb2f748c34229fd1 [0,0,0,0,0,0|1,0,1]=2 24 B13R0.1398 CC(=O)NCC=C(C)CCC=C(C)C 3bd7e9608ee8e34c13604cd4e9370f53 [0,0,0,0,0,0|1,0,1]=2 25 B13R0.1398 CC(=O)OCOC(C)CCC=C(C)C 9e18f5ad9f4cd9d77840d5ac08596c3e [0,0,0,0,0,0|2,0,2]=4 26 B13R0.1398 CC(=O)OCO[C@@H](C)CCC=C(C)C 7cf0f8a79434fbb1f805de304f2c772f [0,0,0,0,0,0|2,0,2]=4 27 B13R0.1398 CC(=O)OCO[C@H](C)CCC=C(C)C f9e58b0a0139e5c8737b6d3e8e66e8ac [0,0,0,0,0,0|2,0,2]=4 28 B12R0.233 C/C=C/C=C/C(=O)NCC=C(C)C f316470202b42c2fedc09c4c0fb78f32 [1,0,0,0,0,0|2,0,0]=3 29 B12R0.233 C/C=C/COC(C)CCC=C(C)C dfe4c6755c6857c6ad4bce3c383b5910 [1,0,0,0,0,0|1,0,2]=4 30 B12R0.233 C/C=C/CO[C@@H](C)CCC=C(C)C 02f7a7f2b22b295adf61eb67c89bf0b1 [1,0,0,0,0,0|1,0,2]=4 31 B12R0.233 C/C=C/CO[C@H](C)CCC=C(C)C 100bad2191266a758752f0250aba8059 [1,0,0,0,0,0|1,0,2]=4 32 B12R0.233 C/C=C\COC(C)CCC=C(C)C 9fee4f3637453232f662fcd65307efa7 [1,0,0,0,0,0|1,0,2]=4 33 B12R0.233 C/C=C\CO[C@@H](C)CCC=C(C)C bc0171238f3207cc471504b084095353 [1,0,0,0,0,0|1,0,2]=4 34 B12R0.233 C/C=C\CO[C@H](C)CCC=C(C)C df528b709ff1cc9dffca661f98c9423a [1,0,0,0,0,0|1,0,2]=4 35 B12R0.233 CC(=CCC/C(=C/CNC=O)/C)C 3e14bbe991c262417a815fb8906cc9e8 [1,0,0,0,0,0|1,0,1]=3 36 B12R0.233 CC(=CCCC(=CCNC=O)C)C 87105d8dc2ac51ea2fb3224ec40be61a [1,0,0,0,0,0|1,0,1]=3 37 B12R0.233 CC=CC=CC(=O)NCC=C(C)C f2a946b4828c667956fcd1bc6d02c01f [1,0,0,0,0,0|2,0,0]=3 38 B12R0.233 CC=CCNC(=O)CCC=C(C)C ba58ad50689e5999dc9ae7003ef82b09 [1,0,0,0,0,0|2,0,1]=4 39 B12R0.233 CCNC/C=C(\C)/CCC=C(C)C ea5d81eacdfad28a4cb12d7aa52a24b1 [1,0,0,0,0,0|1,0,2]=4 40 B12R0.233 CCNCC=C(C)CCC=C(C)C cde507f0423e56f71984e7e8ee0c7c64 [1,0,0,0,0,0|1,0,2]=4 41 B12R0.233 CCOC/C=C(/C)\CCC=C(C)C 3deb6e29a4d9f40ddd103b3acdde8b61 [1,0,0,0,0,0|1,0,2]=4 42 B12R0.233 CCOC/C=C(\C)/CCC=C(C)C 99f98e23f2be8a72af6c69c6484b1d77 [1,0,0,0,0,0|1,0,2]=4 43 B12R0.268 CC(=CCCNC/C=C/C(=O)O)C 3efc9493a47c59390bc6815205566af5 [1,0,0,0,0,0|2,0,1]=4 44 B12R0.268 CC(=CCCNCC=CC(=O)O)C 3edf0e35c8db526fb0e6f4f8e893ce69 [1,0,0,0,0,0|2,0,1]=4 45 B12R0.268 CC(=CCCOC/C=C/C(=O)O)C 3dadf0ddd227a6952f1df301b758168a [1,0,0,0,0,0|2,0,1]=4 46 B12R0.268 CC(=CCCOCC=CC(=O)O)C 3b8719428d5261cc8d20b7927dbb1ac5 [1,0,0,0,0,0|2,0,1]=4 47 B14R0.222 CC(=O)C(=O)COC(C)CCC=C(C)C a1c92c837c3b6d55cfbb3571495ca334 [0,1,0,0,0,0|1,0,2]=4 48 B14R0.222 CC(=O)C(=O)CO[C@@H](C)CCC=C(C)C 53b533a3d5c56d7ec990aa54c4fa674a [0,1,0,0,0,0|1,0,2]=4 49 B14R0.222 CC(=O)C(=O)CO[C@H](C)CCC=C(C)C 6cbb6e15eb7fc3d421d985c59255c33f [0,1,0,0,0,0|1,0,2]=4 50 B14R0.304 C#CC(=O)NC/C=C(\C)/CCC=C(C)C e10bb29bf77ea72523903a32b92ab714 [0,1,0,0,0,0|1,0,2]=4 51 B14R0.304 C#CC(=O)NCC=C(C)CCC=C(C)C cece5788b8a5b2543f0a8736869ac166 [0,1,0,0,0,0|1,0,2]=4 52 B14R0.304 C=C(C=O)OC/C=C(\C)/CCC=C(C)C 17392e82200bf4731492e16521c58f18 [0,1,0,0,0,0|1,0,2]=4 53 B14R0.304 C=CC(=O)NC/C=C(\C)/CCC=C(C)C 40f8d7d206e1341eee049f3e6f19d424 [0,1,0,0,0,0|1,0,2]=4 54 B14R0.304 C=CC(=O)NCC=C(C)CCC=C(C)C 3b8632dfe085bd3490da1adbc2801a96 [0,1,0,0,0,0|1,0,2]=4 55 B14R0.304 CC(=CCC/C(=C/CNC(=O)C=O)/C)C 791300e1560fb39b979506597572e175 [0,1,0,0,0,0|1,0,2]=4 56 B14R0.304 CC(=CCC/C(=C/CNC(=O)CF)/C)C a542dbcb56306ec6b1fb88a234093613 [0,1,0,0,0,0|1,0,1]=3 57 B14R0.304 CC(=CCC/C(=C/CNC(=O)CO)/C)C d8d4234a3029f7636d62a44e44f9a1c6 [0,1,0,0,0,0|1,0,1]=3 58 B14R0.304 CC(=CCC/C(=C/CNC(=O)CS)/C)C 0c5833eda46a5f40027227d4b78bada7 [0,1,0,0,0,0|1,0,1]=3 59 B14R0.304 CC(=CCC/C(=C/CNC(C)C=O)/C)C e2a11d3ed2d690aee81b79db810ac3b9 [0,1,0,0,0,0|1,0,2]=4 60 B14R0.304 CC(=CCC/C(=C/CN[C@H](C)C=O)/C)C b0584d4f154ad38810fbe1211b348121 [0,1,0,0,0,0|1,0,2]=4 61 B14R0.304 CC(=CCC/C(=C/COC(C)C=O)/C)C 45c024d49b019987f92dfd8e4eabfd78 [0,1,0,0,0,0|1,0,2]=4 62 B14R0.304 CC(=CCC/C(=C/CO[C@H](C)C=O)/C)C 7b67515b2e901d6be7610122e54d54d6 [0,1,0,0,0,0|1,0,2]=4 63 B14R0.304 CC(=CCC/C(=C\COC(C)C=O)/C)C 22ded1b6fd8b51461100409ef83d803c [0,1,0,0,0,0|1,0,2]=4 64 B14R0.304 CC(=CCC/C(=C\CO[C@H](C)C=O)/C)C 3ee9112ed7da3eaabca697c929c76bdc [0,1,0,0,0,0|1,0,2]=4 65 B14R0.304 CC(=CCCC(=CCNC(=O)C=O)C)C 19663d14b8a6e145d3a622f1f0eb0a03 [0,1,0,0,0,0|1,0,2]=4 66 B14R0.304 CC(=CCCC(=CCNC(=O)CF)C)C cb80eb06743168fd6243f2f0329f0f98 [0,1,0,0,0,0|1,0,1]=3 67 B14R0.304 CC(=CCCC(=CCNC(=O)CO)C)C a3acce1db8877d6255d6f48af6340f60 [0,1,0,0,0,0|1,0,1]=3 68 B14R0.304 CC(=CCCC(=CCNC(=O)CS)C)C 27b94a87b4292ce43068991925d3f117 [0,1,0,0,0,0|1,0,1]=3 69 B14R0.304 CC(=CCCC(=CCNC(C)C=O)C)C dd7b317b4bf59b29577ef4f2cf390667 [0,1,0,0,0,0|1,0,2]=4 70 B14R0.304 CC(=CCCC(=CCN[C@H](C)C=O)C)C 947af5ff18bbe2e518b032e8dde79331 [0,1,0,0,0,0|1,0,2]=4 71 B14R0.304 CCC(=O)NC/C=C(\C)/CCC=C(C)C 4ac44991ad588bbffae1a220808fcb17 [0,1,0,0,0,0|1,0,1]=3 72 B14R0.304 CCC(=O)NCC=C(C)CCC=C(C)C 599c9dd190ac8aa1752747e769448ab7 [0,1,0,0,0,0|1,0,1]=3 73 B14R0.1421 CC(=O)/C=C/C(=O)N(C)CCCN(C)C 23e9f99d8c21d7dc6b080696a26e92f4 [0,1,0,0,0,0|2,0,1]=4 74 B14R0.1421 CC(=O)/C=C/C(=O)N(C)CCOC(C)C 024d22d0076c488c66720e01bab5ede0 [0,1,0,0,0,0|2,0,1]=4 75 B14R0.1421 CC(=O)C=CC(=O)N(C)CCCN(C)C 36a87ea08fbc7d798d5925cf2661e367 [0,1,0,0,0,0|2,0,1]=4 76 B14R0.1421 CC(=O)C=CC(=O)N(C)CCOC(C)C 0e0b69a2d0ba3c7077785b4be86b0977 [0,1,0,0,0,0|2,0,1]=4 77 B14R1.4268 CC(=CCCN(C)c1nc(cs1)C)C 2a010221427e3cde51bb2042ef7929be [0,0,0,1,0,0|3,0,0]=4 78 B14R1.4268 CC(=CCCN(C)c1ncc(s1)C)C 2d82c6baa11c82b724860032a1b3607b [0,0,0,1,0,0|2,1,0]=4 79 B14R1.4268 CC(=CCNC(=O)c1ccc(o1)C)C 759e825128c010e99c9857c1658500b0 [0,0,0,1,0,0|2,0,1]=4 80 B14R1.4268 CC(=CCNC(=O)c1ccc(s1)C)C 39911a4d0d54fc5879124d808407bdc3 [0,0,0,1,0,0|2,1,0]=4 81 B14R1.4268 CC(=CCNC(C)c1ccc(o1)C)C 2bbfb7f0ac9df6daa10e1aede9306287 [0,0,0,1,0,0|1,0,2]=4 82 B14R1.4268 CC(=CCN[C@@H](C)c1ccc(s1)C)C b13f8dd90095285a596c4bcb9e2349e1 [0,0,0,1,0,0|1,1,1]=4 83 B14R1.4268 CC(=CCN[C@H](C)c1ccc(o1)C)C ee4b275e06580613014c5ccdce1bc6a3 [0,0,0,1,0,0|1,0,2]=4 84 B14R1.4268 CC(=CCO[C@H](C)c1ccc(s1)C)C 0c4c9202432fb61f2e17ac33e7bf32b6 [0,0,0,1,0,0|1,1,1]=4 85 B14R1.6314 C=C(C)c1ccc(s1)NCC=C(C)C a83c86bea67dd7980b6a7612770b769b [0,0,0,1,0,0|3,0,0]=4 86 B14R1.6314 CC(=CCNc1ccc([nH]1)C(=O)O)C 089d62df2faadd77d5af59c01cd01c88 [0,0,0,1,0,0|3,0,0]=4 87 B14R1.6314 CC(=CCNc1ccc(o1)C(=O)N)C f8b90a18aa5cb5ec4393dda9b30df23c [0,0,0,1,0,0|3,0,0]=4 88 B14R1.6314 CC(=CCNc1ccc(o1)C(=O)O)C e3fcd6dc9f3d5785d07662cfc8369abe [0,0,0,1,0,0|3,0,0]=4 89 B14R1.6314 CC(=CCNc1ccc(s1)C(=O)N)C 834e3707eba36bcf8a3c4783c84ef1d1 [0,0,0,1,0,0|3,0,0]=4 90 B14R1.6314 CC(=O)c1cc(c[nH]1)NCC=C(C)C 0770e56b1b119e3a997c28b4b2b3725f [0,0,0,1,0,0|2,0,1]=4 91 B14R1.6314 CC(=O)c1cc(cs1)NCC=C(C)C a9cd29376bd03936314d70aaf3e8b6d5 [0,0,0,1,0,0|2,0,1]=4 92 B14R1.6314 CC(=O)c1ccc([nH]1)NCC=C(C)C 39458b31ede973238e946d61ad3f16ab [0,0,0,1,0,0|2,0,0]=3 93 B14R1.6314 CC(=O)c1ccc(o1)NCC=C(C)C 9f2c58e131354fb1bc4b4eef4796284a [0,0,0,1,0,0|2,0,0]=3 94 B14R1.6314 CC(=O)c1ccc(s1)NC/C=C(/C)\I 4071c93c8acb33b18e5c37ae02e8a675 [0,0,0,1,0,0|3,0,0]=4 95 B14R1.6314 CC(=O)c1ccc(s1)NC/C=C(\C)/Cl f995a85cc25e66120c1f82b764ff4ae1 [0,0,0,1,0,0|3,0,0]=4 96 B14R1.6314 CC(=O)c1ccc(s1)NCC=C(C)C 156a7fb47bfd888a405d2bfa0dc306e6 [0,0,0,1,0,0|2,0,0]=3 97 B14R1.6314 CC(=O)c1ccc(s1)NCC=C(C)Cl 45c055da3b8c5b8b0d834a1ae069c78e [0,0,0,1,0,0|3,0,0]=4 98 B14R1.6314 CC(=O)c1ccc(s1)NCC=C(C)I bd12369ffe332657c66fe2cae2988fef [0,0,0,1,0,0|3,0,0]=4 99 B14R1.6314 CC(=O)c1cnc(o1)NCC=C(C)C 56c680e4a34083b413237195b9b1f669 [0,0,0,1,0,0|3,0,0]=4 100 B14R1.6314 CC(=O)c1cnc(s1)NCC=C(C)C 2db3b53906dd3ce527ccac4a5c44f22e [0,0,0,1,0,0|3,0,0]=4 101 B14R1.6314 CC(=O)c1csc(c1)NCC=C(C)C 79df0ac0df4af08c4b3581b699e603ba [0,0,0,1,0,0|2,0,1]=4 102 B14R1.6314 CC(=O)c1csc(n1)NCC=C(C)C 79c7b24e648bd1afe0fb90f3772364ab [0,0,0,1,0,0|3,0,0]=4 103 B14R1.6314 CC(=O)c1nc(cs1)NCC=C(C)C ef5991f59d1a24fc489e655aebee3fc5 [0,0,0,1,0,0|3,0,0]=4 104 B14R1.6314 CC(=O)c1ncc(s1)NCC=C(C)C da965923265a80fc8a5e1ca2befadc41 [0,0,0,1,0,0|3,0,0]=4 105 B12R0.44 CC(=CCNC(=O)/C=C/C(=O)N)C 793e261a94d903dff10983244c6d4df0 [0,0,0,0,1,0|3,0,0]=4 106 B12R0.44 CC(=CCNC(=O)/C=C\C(=O)N)C e79a5ed7d7de63256f5b3148cab9125b [0,0,0,0,1,0|3,0,0]=4 107 B12R0.44 CC(=CCNC(=O)C=CC(=O)N)C 357f6490fee1088f2f304eb92c3195fa [0,0,0,0,1,0|3,0,0]=4 108 B12R0.44 CC(=O)/C=C/C(=O)NCC=C(C)C ca1fca94076cad59a31f1f97eaac2662 [0,0,0,0,1,0|2,0,0]=3 109 B12R0.44 CC(=O)C=CC(=O)NCC=C(C)C fe431638321bbc35597af4daa892efe7 [0,0,0,0,1,0|2,0,0]=3 110 B12R0.44 CC(=O)CNC(=O)CCC=C(C)C bd903bb0590505ae95843c48d45210b2 [0,0,0,0,1,0|2,0,1]=4 111 B14R0.67 C=C(C)CNC/C=C(\C)/CCC=C(C)C c1390220bd0ac9cfe7cb2099239002a0 [0,0,0,0,0,1|1,0,2]=4 112 B14R0.67 C=C(C)CNCC=C(C)CCC=C(C)C 1f846fc0d69fa82e8f7ce66c9c2c7bdf [0,0,0,0,0,1|1,0,2]=4 113 B14R0.67 C=C(C)COC/C=C(/C)\CCC=C(C)C 6db71b532e716ec0062afeda225f7d6d [0,0,0,0,0,1|1,0,2]=4 114 B14R0.67 C=C(C)COC/C=C(\C)/CCC=C(C)C da89d48c53aca84e3cf752c8bffaf995 [0,0,0,0,0,1|1,0,2]=4 115 B14R0.67 CC(=CCC/C(=C/CNCC(=O)N)/C)C 2ab5b533f3ea5f201dcafc422e02672f [0,0,0,0,0,1|1,0,2]=4 116 B14R0.67 CC(=CCC/C(=C/CNCC(=O)O)/C)C 08ebdf1df1c2131dd53f1e75e7c1244c [0,0,0,0,0,1|1,0,2]=4 117 B14R0.67 CC(=CCC/C(=C/COCC(=O)N)/C)C d0b55abc4394f50c03ca1f2b8db91f66 [0,0,0,0,0,1|1,0,2]=4 118 B14R0.67 CC(=CCC/C(=C/COCC(=O)O)/C)C 260478f441aec8e1826344bc0b2729a5 [0,0,0,0,0,1|1,0,2]=4 119 B14R0.67 CC(=CCC/C(=C\COCC(=O)N)/C)C 2ee052c1e165f6190c3de685f156a3fd [0,0,0,0,0,1|1,0,2]=4 120 B14R0.67 CC(=CCC/C(=C\COCC(=O)O)/C)C 95a97da4af822ee921fd0beb21742356 [0,0,0,0,0,1|1,0,2]=4 121 B14R0.67 CC(=CCCC(=CCNCC(=O)N)C)C 17bc7ddc5fe137c0f93ccfcf52f074b3 [0,0,0,0,0,1|1,0,2]=4 122 B14R0.67 CC(=CCCC(=CCNCC(=O)O)C)C 4fa773ff50a5b822dbb2ced325756aeb [0,0,0,0,0,1|1,0,2]=4 123 B14R0.67 CC(=CCCC(C)OC/C=C/C(=O)O)C 2f6a8a74b6be969abd3457fddc0accdf [0,0,0,0,0,1|1,0,2]=4 124 B14R0.67 CC(=CCCC(C)OCC=CC(=O)O)C 4f2ae5b67115ccbf7076f6887b15a2c1 [0,0,0,0,0,1|1,0,2]=4 125 B14R0.67 CC(=CCC[C@@H](C)OC/C=C/C(=O)O)C 4bd53ff01ec961a9b77af8b672a09cf3 [0,0,0,0,0,1|1,0,2]=4 126 B14R0.67 CC(=CCC[C@@H](C)OCC=CC(=O)O)C 9792d6e3829c91fc81348410bddff0f8 [0,0,0,0,0,1|1,0,2]=4 127 B14R0.67 CC(=CCC[C@H](C)OC/C=C/C(=O)O)C 0e8989ae55d62e06a7133ac28dbea281 [0,0,0,0,0,1|1,0,2]=4 128 B14R0.67 CC(=CCC[C@H](C)OCC=CC(=O)O)C dc80ae846c5c3871f2d315d6f8c8c9ac [0,0,0,0,0,1|1,0,2]=4 129 B14R0.67 CC(=O)CNC/C=C(\C)/CCC=C(C)C fe6d16b085ea2dc5e29b1b13a037d225 [0,0,0,0,0,1|0,0,2]=3 130 B14R0.67 CC(=O)COC/C=C(\C)/CCC=C(C)C 5727da016f973868fb6b266b980d0543 [0,0,0,0,0,1|0,0,2]=3 131 B14R0.67 CC(=O)NC/C=C/C(=O)NCC=C(C)C d4e26989c9e778e83c162dc45b29a97b [0,0,0,0,0,1|2,0,1]=4 132 B14R0.67 CC(=O)OC/C=C(\C)/CNCC=C(C)C 25ed5cf91b00ae5272998cd2ceb0534c [0,0,0,0,0,1|1,0,1]=3 133 B14R0.67 CC(=O)OC/C=C(\C)/COC/C=C(/C)\Cl e00909ce191e57b06e7e74d6cb51f938 [0,0,0,0,0,1|2,0,1]=4 134 B14R0.67 CC(=O)OC/C=C(\C)/COC/C=C(/C)\I 04fdd9f3879962195c4fb66d73868ddf [0,0,0,0,0,1|2,0,1]=4 135 B14R0.67 CC(=O)OC/C=C(\C)/COCC=C(C)C 1260e21f9a55d009cc1b3c8020980675 [0,0,0,0,0,1|1,0,1]=3 136 B14R0.67 CC(=O)OC/C=C(\C)/COCC=C(C)I 8a7cfc1545b7a429eb86bfabcb75d3e6 [0,0,0,0,0,1|2,0,1]=4 137 B11R0.140 CC=CC=CC(=O)NCC=CC d88c19135340300026f8e0ae44d027f6 [2,0,0,0,0,0|2,0,0]=4 138 B11R0.140 CC=CCNC(=O)/C=C/C=C/C 4838de6559e98041098f510c7149f218 [2,0,0,0,0,0|2,0,0]=4 139 B11R0.147 C=C/C=C/C(=O)NCC=C(C)C c0425db0b4ea764b931a8e2c15710914 [2,0,0,0,0,0|2,0,0]=4 140 B11R0.147 C=C/C=C\C(=O)NCC=C(C)C 8e8c0ff332d96ef161c9626d04ad836a [2,0,0,0,0,0|2,0,0]=4 141 B11R0.147 C=CC=CC(=O)NCC=C(C)C 8223f326431cb94a236905b4d2b6e54a [2,0,0,0,0,0|2,0,0]=4 142 B11R0.148 C/C=C/C=C/COCC=C(C)C 2a21e5a4d0c2509b2182c52377f4b8c7 [2,0,0,0,0,0|1,0,1]=4 143 B11R0.148 CC(=CCCOC/C=C/C=O)C 1fab7dde6d99d50de7cd655799af450b [2,0,0,0,0,0|1,0,1]=4 144 B11R0.148 CC=CC=CCOCC=C(C)C 8752d4413332009ee129fd6701824c2b [2,0,0,0,0,0|1,0,1]=4 145 B13R0.1 C/C=C/COC/C(=C/COC(=O)C)/C 898e2a0c3637da5ef097ff2510067a63 [1,1,0,0,0,0|1,0,1]=4 146 B13R0.1 C/C=C\COC/C(=C/COC(=O)C)/C f21c11d577320a95daeec7e956b04226 [1,1,0,0,0,0|1,0,1]=4 147 B13R0.1 CC(=CCC/C(=C/CNCC=O)/C)C 06753a756feeea885387e806d2f57c27 [1,1,0,0,0,0|0,0,2]=4 148 B13R0.1 CC(=CCC/C(=C/COCC=O)/C)C 320baa642517f1ee317aecd4bfc1bd38 [1,1,0,0,0,0|0,0,2]=4 149 B13R0.1 CC(=CCC/C(=C\COCC=O)/C)C fe109a1d6ce7f63dad1fbec37dfadeb9 [1,1,0,0,0,0|0,0,2]=4 150 B13R0.1 CC(=CCCC(=CCNCC=O)C)C 04bd24719ebddc151b6ece096da6a7d3 [1,1,0,0,0,0|0,0,2]=4 151 B13R0.1 CC=CCNC/C(=C/COC(=O)C)/C 50882110e08e0b9b9e9cc6baa8cf5ef5 [1,1,0,0,0,0|1,0,1]=4 152 B13R0.1 CC=CCOC/C(=C/COC(=O)C)/C 35727f6af67b6c7caed55cb428cb1296 [1,1,0,0,0,0|1,0,1]=4 153 B13R0.493 C/C=C(\C)/C=C/C(=O)NCC=C(C)C 1df1f9d3166dc4d273047439842ff929 [1,1,0,0,0,0|2,0,0]=4 154 B13R0.202 COC(=O)/C=C/COCCC=C(C)C 571b9c3e113ab885e21701ed30d8274a [1,1,0,0,0,0|1,0,1]=4 155 B13R0.349 CC(=O)/C=C/C(=O)N(C)CCC(C)C 291b59f53625a756adb0f318d241d920 [0,1,0,0,1,0|1,0,1]=4 156 B13R0.349 CC(=O)/C=C/C(=O)N(C)CCN(C)C f1d66391e106b88cb1457f7549568387 [0,1,0,0,1,0|2,0,0]=4 157 B13R0.349 CC(=O)C=CC(=O)N(C)CCC(C)C a10da51e3dfe31fa2e61c2b9aa3dff32 [0,1,0,0,1,0|1,0,1]=4 158 B13R0.349 CC(=O)C=CC(=O)N(C)CCN(C)C 92bc29ccd8419fe5774379de1f49475d [0,1,0,0,1,0|2,0,0]=4 159 B15R0.246 CC(=CCC/C(=C/CNCC(=O)CO)/C)C 98237032a370f35761e24f04c944334d [0,1,0,0,0,1|0,0,2]=4 160 B15R0.246 CC(=CCCC(=CCNCC(=O)CO)C)C 487dc7262b1836e24ed1b5ab74e3686d [0,1,0,0,0,1|0,0,2]=4 161 B15R0.246 CCC(=O)CNC/C=C(\C)/CCC=C(C)C 8ec0ea83877a21402e97a21cf59a0cda [0,1,0,0,0,1|0,0,2]=4 162 B15R0.246 CCC(=O)CNCC=C(C)CCC=C(C)C 92d14093bf92c358063e2c04dc136434 [0,1,0,0,0,1|0,0,2]=4 163 B15R0.246 CCC(=O)COC/C=C(/C)\CCC=C(C)C 1b0d4a5e35d2834e7bca36da56fd419b [0,1,0,0,0,1|0,0,2]=4 164 B15R0.246 CCC(=O)COC/C=C(\C)/CCC=C(C)C 8e6d630c5d10af83647d7260579ed314 [0,1,0,0,0,1|0,0,2]=4 165 B15R0.246 CNC(=O)CNC/C=C(\C)/CCC=C(C)C dfa068efd7c94ba6aa4e2ff1beae808e [0,1,0,0,0,1|0,0,2]=4 166 B15R0.246 CNC(=O)CNCC=C(C)CCC=C(C)C f4412f7025b7789f33226b348f7492eb [0,1,0,0,0,1|0,0,2]=4 167 B15R0.246 CNC(=O)COC/C=C(/C)\CCC=C(C)C f365845d5b75d4edf270b43c50468328 [0,1,0,0,0,1|0,0,2]=4 168 B15R0.246 CNC(=O)COC/C=C(\C)/CCC=C(C)C 233fd44d7d4353037096b6ace4675a08 [0,1,0,0,0,1|0,0,2]=4 169 B15R0.246 COC(=O)/C=C/COC(C)CCC=C(C)C 60ef421f34a8d6db1e3c0ce556de9c9a [0,1,0,0,0,1|0,0,2]=4 170 B15R0.246 COC(=O)/C=C/CO[C@@H](C)CCC=C(C)C cca09fd8c43f29c44eb5b4c16987ca2b [0,1,0,0,0,1|0,0,2]=4 171 B15R0.246 COC(=O)/C=C/CO[C@H](C)CCC=C(C)C c7c3d0ffbba1bbcd745f1eba3c76324d [0,1,0,0,0,1|0,0,2]=4 172 B15R0.246 COC(=O)/C=C\COC(C)CCC=C(C)C 158d56e65d6ce4154d0b8d0c71716d73 [0,1,0,0,0,1|0,0,2]=4 173 B15R0.246 COC(=O)/C=C\CO[C@@H](C)CCC=C(C)C 1e2ea21179bddb83954cfd23be7d6165 [0,1,0,0,0,1|0,0,2]=4 174 B15R0.246 COC(=O)/C=C\CO[C@H](C)CCC=C(C)C b272f231a39f916dfe2c6406b19f4054 [0,1,0,0,0,1|0,0,2]=4 175 B15R0.246 COC(=O)C=CCOC(C)CCC=C(C)C f3b7b9297711db23fdc4a281d14ec922 [0,1,0,0,0,1|0,0,2]=4 176 B15R0.246 COC(=O)C=CCO[C@@H](C)CCC=C(C)C 7e42c1aab405bcc4b4563d1cf4ed2a97 [0,1,0,0,0,1|0,0,2]=4 177 B15R0.246 COC(=O)C=CCO[C@H](C)CCC=C(C)C dbf243576a93fdbd702580eb23268547 [0,1,0,0,0,1|0,0,2]=4 178 B15R0.246 COC(=O)CNC/C=C(\C)/CCC=C(C)C 137b4fc0e2befd0d7f50a1e3a24a223e [0,1,0,0,0,1|0,0,2]=4 179 B15R0.246 COC(=O)CNCC=C(C)CCC=C(C)C 2fad39e23022af0dd14d2fc70c80e317 [0,1,0,0,0,1|0,0,2]=4 180 B15R0.246 COC(=O)COC/C=C(/C)\CCC=C(C)C 84eb789961986f36d15f3fe9108f29a0 [0,1,0,0,0,1|0,0,2]=4 181 B15R0.246 COC(=O)COC/C=C(\C)/CCC=C(C)C eb92c45287cb86a4b74bd2331106373d [0,1,0,0,0,1|0,0,2]=4 182 B15R0.2722 C=C(C)C(=O)NC/C=C(\C)/CCC=C(C)C 9a3cdaafa837110be8293d62cdc0281b [0,1,0,0,0,1|1,0,1]=4 183 B15R0.2722 C=C(C)C(=O)NCC=C(C)CCC=C(C)C ed0fb9a1dca4e8e07b15055cf77d29c9 [0,1,0,0,0,1|1,0,1]=4 184 B15R0.2722 CC(=CCC/C(=C/CNC(=O)C(=O)N)/C)C e4c93c4d9e8597817c4ac70f36d24980 [0,1,0,0,0,1|1,0,1]=4 185 B15R0.2722 CC(=CCCC(=CCNC(=O)C(=O)N)C)C c132aa330acac4bc46fcdaacf7a3ce56 [0,1,0,0,0,1|1,0,1]=4 186 B15R0.2722 CC(=O)C(=O)NC/C=C(\C)/CCC=C(C)C 07b27799fc9860168ee94ecff1874842 [0,1,0,0,0,1|0,0,1]=3 187 B15R0.2722 CC(=O)C(=O)NCC=C(C)CCC=C(C)C e9e9941cac53091a348999febbe991f2 [0,1,0,0,0,1|0,0,1]=3 188 B15R0.2722 CC(=O)C(C)NC/C=C(\C)/CCC=C(C)C bab827e812124b2017b6ee5c5ddd6852 [0,1,0,0,0,1|0,0,2]=4 189 B15R0.2722 CC(=O)C(C)NCC=C(C)CCC=C(C)C f28db2a0587164b665bbdfe001efe696 [0,1,0,0,0,1|0,0,2]=4 190 B15R0.2722 CC(=O)C(C)OC/C=C(/C)\CCC=C(C)C a1168864116095d7e3d2a01be72192d6 [0,1,0,0,0,1|0,0,2]=4 191 B15R0.2722 CC(=O)C(C)OC/C=C(\C)/CCC=C(C)C 538a565f23a0d3618e4be24db6b2bf0d [0,1,0,0,0,1|0,0,2]=4 192 B15R0.2724 C=C(C)CNC(=O)/C=C(\C)/CCC=C(C)C 0b208a63b520485e2fdbca003d9e2129 [0,1,0,0,0,1|1,0,1]=4 193 B15R0.2724 CC(=CCC/C(=C/C(=O)NCC(=O)N)/C)C f5d866423acea0042d95ad81c97e524a [0,1,0,0,0,1|1,0,1]=4 194 B15R0.2724 CC(=O)CNC(=O)/C=C(\C)/CCC=C(C)C ff08100b5b01577eed3313480fcdedf4 [0,1,0,0,0,1|0,0,1]=3 195 B15R0.224 CC(=O)/C=C/C(=O)N(C)CCC(=O)N(C)C b08156b8b9744d1545c1c0ca2be52b22 [0,2,0,0,0,0|2,0,0]=4 196 B15R0.224 CC(=O)C=CC(=O)N(C)CCC(=O)N(C)C 77c5a0299bdf25e26974cb7a21b7d812 [0,2,0,0,0,0|2,0,0]=4 197 B15R0.110 C#CCC(=O)NC/C=C(\C)/CCC=C(C)C d856389d6ae9c0ab9b1ac27bc434be69 [0,2,0,0,0,0|1,0,1]=4 198 B15R0.110 C#CCC(=O)NCC=C(C)CCC=C(C)C 670a9dd84f2cc726d5cfa4581060a272 [0,2,0,0,0,0|1,0,1]=4 199 B15R0.110 C/C=C/C(=O)NC/C=C(\C)/CCC=C(C)C 97f8b95a35503b8808cd47532822e9fa [0,2,0,0,0,0|1,0,1]=4 200 B15R0.110 C/C=C/C(=O)NCC=C(C)CCC=C(C)C 2112a4d76a0aa047d9bcc40797349a1f [0,2,0,0,0,0|1,0,1]=4 201 B15R0.110 C=CCC(=O)NC/C=C(\C)/CCC=C(C)C 39e10ca2de640c5e56da3717e0dba884 [0,2,0,0,0,0|1,0,1]=4 202 B15R0.110 C=CCC(=O)NCC=C(C)CCC=C(C)C 9768114591560e7677413671601e38dc [0,2,0,0,0,0|1,0,1]=4 203 B15R0.110 CC#CC(=O)NC/C=C(\C)/CCC=C(C)C 9a591aab54e2722d316719e35579511d [0,2,0,0,0,0|1,0,1]=4 204 B15R0.110 CC#CC(=O)NCC=C(C)CCC=C(C)C 0812700e10912e57412eb6f8b0ddad31 [0,2,0,0,0,0|1,0,1]=4 205 B15R0.110 CC(=CCC/C(=C/CNC(=O)CC#N)/C)C c7cf987729568d464406450203a3adbd [0,2,0,0,0,0|1,0,1]=4 206 B15R0.110 CC(=CCC/C(=C/CNC(=O)CC=O)/C)C 98a4cdd913ec9ca281c61cfeed9096c4 [0,2,0,0,0,0|1,0,1]=4 207 B15R0.110 CC(=CCC/C(=C/CNC(=O)CCF)/C)C acbd2239c1724c8fb71d07717e35711c [0,2,0,0,0,0|1,0,1]=4 208 B15R0.110 CC(=CCC/C(=C/CNC(=O)CCO)/C)C ea966e13446a636c94b04dffaea8c81d [0,2,0,0,0,0|1,0,1]=4 209 B15R0.110 CC(=CCC/C(=C/CNC(=O)CCS)/C)C d09505ba3cfb8c183069ec96b6059738 [0,2,0,0,0,0|1,0,1]=4 210 B15R0.110 CC(=CCC/C(=C/CNC(=O)CON)/C)C b8101101dbaeb4229161bce96aed6e55 [0,2,0,0,0,0|1,0,1]=4 211 B15R0.110 CC(=CCCC(=CCNC(=O)CC#N)C)C f00f489210a0918bed6bdfe10dc9f82f [0,2,0,0,0,0|1,0,1]=4 212 B15R0.110 CC(=CCCC(=CCNC(=O)CC=O)C)C ce62d6b69eefae31a50c72f7810b1cfd [0,2,0,0,0,0|1,0,1]=4 213 B15R0.110 CC(=CCCC(=CCNC(=O)CCF)C)C 647cc0a379c346e4ed7e5ca681d1d4ed [0,2,0,0,0,0|1,0,1]=4 214 B15R0.110 CC(=CCCC(=CCNC(=O)CCO)C)C 3a5c58bd88355cdb40a607f9cb339750 [0,2,0,0,0,0|1,0,1]=4 215 B15R0.110 CC(=CCCC(=CCNC(=O)CCS)C)C d14069e00b7c4d5af260033ad89d7ca8 [0,2,0,0,0,0|1,0,1]=4 216 B15R0.110 CC(=CCCC(=CCNC(=O)CON)C)C 2f47c0a9bc23614c12ac8bf498704275 [0,2,0,0,0,0|1,0,1]=4 217 B15R0.110 CCCC(=O)NC/C=C(\C)/CCC=C(C)C 1c4b28929ea50caa34ddf93c51b24f2b [0,2,0,0,0,0|1,0,1]=4 218 B15R0.110 CCCC(=O)NCC=C(C)CCC=C(C)C 6f37bef90692c6e729aecf53c788f043 [0,2,0,0,0,0|1,0,1]=4 219 B15R0.110 COCC(=O)NC/C=C(\C)/CCC=C(C)C 55f2e07dd9a5f21f4f20e930737a5482 [0,2,0,0,0,0|1,0,1]=4 220 B15R0.110 COCC(=O)NCC=C(C)CCC=C(C)C d971d71489c9db3e38338f20508bb742 [0,2,0,0,0,0|1,0,1]=4 221 B15R0.110 CSCC(=O)NC/C=C(\C)/CCC=C(C)C a6318e68b205c58105d9608a42b81df8 [0,2,0,0,0,0|1,0,1]=4 222 B15R0.110 CSCC(=O)NCC=C(C)CCC=C(C)C b45789938344638260e14ac9d1cf25ed [0,2,0,0,0,0|1,0,1]=4 223 B13R1.60 CC(=CCNc1ccc([nH]1)C=O)C cbaf962cd5d85b95f6261fa768bafad0 [1,0,0,1,0,0|2,0,0]=4 224 B13R1.60 CC(=CCNc1ccc(o1)C=O)C babc62c9e2e4830e000dccfbf8ca0186 [1,0,0,1,0,0|2,0,0]=4 225 B13R1.60 CC(=CCNc1ccc(s1)C=O)C 0f692d3a1c1ecc75d6966b429112acc3 [1,0,0,1,0,0|2,0,0]=4 226 B13R1.149 CC(=CCNc1cccc(=O)[nH]1)C f08e7d2f040db44e22decb9ee6b5074e [1,0,0,1,0,0|2,0,0]=4 227 B13R1.149 CC(=CCNc1cccc(c1)C)C e32493186d57e80d618a41966ec16a78 [1,0,0,1,0,0|1,0,1]=4 228 B13R1.149 CC(=CCNc1cccc(n1)C)C 28a30ba90d0b495ada7e347b02bb2def [1,0,0,1,0,0|2,0,0]=4 229 B13R1.149 CC(=CCOc1cccc(=O)[nH]1)C ebcb1cb05df65a1a128503444711ca05 [1,0,0,1,0,0|2,0,0]=4 230 B13R1.149 CC(=CCOc1cccc(c1)C)C 0b2bb8bad039fffecef4b8826b5811d8 [1,0,0,1,0,0|1,0,1]=4 231 B13R1.149 CC(=CCOc1cccc(n1)C)C 41906a50e7f9e52702c05861055c983c [1,0,0,1,0,0|2,0,0]=4 232 B13R1.658 C/C=C/CNc1ccc(s1)C(=O)C 1d3d0cc1bdd06e8de931b92ad77af0db [1,0,0,1,0,0|2,0,0]=4 233 B13R1.658 C/C=C\CNc1ccc(s1)C(=O)C 3c3c77e15ca9712ddf598cbb3fc6a17f [1,0,0,1,0,0|2,0,0]=4 234 B13R1.658 CC=CCNc1ccc([nH]1)C(=O)C baec0965db75337d6fd64f879d052e73 [1,0,0,1,0,0|2,0,0]=4 235 B13R1.658 CC=CCNc1ccc(o1)C(=O)C 45e0040d2a8afbabe770d70fec7c99a7 [1,0,0,1,0,0|2,0,0]=4 236 B13R1.658 CC=CCNc1ccc(s1)C(=O)C 4aeebf240f1b368cc241abe7874633e7 [1,0,0,1,0,0|2,0,0]=4 237 B13R1.128 CC(=CCCNc1ccc(s1)C)C 31cc34a0c1b9cbee91171dec24fec0f2 [1,0,0,1,0,0|1,1,0]=4 238 B13R1.128 CC(=CCCOC1=COC(=O)C1)C cb8e436692447aad38b8eaca27af8dbf [1,0,0,1,0,0|2,0,0]=4 239 B13R1.128 CC(=CCCOC1C=CC(=O)C1)C 17571701f8f72195b28c33338fc56e08 [1,0,0,1,0,0|1,0,1]=4 240 B13R1.128 CC(=CCCO[C@H]1C=CC(=O)C1)C e75495ee816b7c4b1328e9f635584f96 [1,0,0,1,0,0|1,0,1]=4 241 B15R1.5468 CC(=CCCC(=O)Nc1ccc(s1)C)C 3da6b74e2075b91aa10235fe116bfd77 [0,0,0,1,0,1|1,1,0]=4 242 B15R1.5468 CC(=CCCN(C)Cc1ccc(o1)C)C 778d43556785da9a69a131b977026e80 [0,0,0,1,0,1|1,0,1]=4 243 B15R1.5468 CC(=CCCN(C)Cc1ccc(s1)C)C e3a8e5edf6a2368e43d6c6379645a2dd [0,0,0,1,0,1|1,1,0]=4 244 B15R1.5483 CC(=CCCNC(C)c1ccc(o1)C)C 602543e2ff9d09f82f60eaefe58b7303 [0,0,0,1,0,1|0,0,2]=4 245 B15R1.5483 CC(=CCCN[C@@H](C)c1ccc(s1)C)C 5f0b377b694f9b913533222bd6f983e9 [0,0,0,1,0,1|0,1,1]=4 246 B15R1.5483 CC(=CCCN[C@H](C)c1ccc(o1)C)C 8e0dd2c4d40248d0e2a7418e8f640d55 [0,0,0,1,0,1|0,0,2]=4 247 B15R1.5483 CC(=CCCO[C@H](C)c1ccc(s1)C)C 6e6f0d974bed9309707d77a9865789ad [0,0,0,1,0,1|0,1,1]=4 248 B15R1.5483 CC(=CCNCC(=O)c1ccc(o1)C)C a22b52d6ca2d5da803f7cac03cd1c193 [0,0,0,1,0,1|1,0,1]=4 249 B15R1.5483 CC(=CCNCC(=O)c1ccc(s1)C)C fd4967264530d1d7dd92833357b8c1e6 [0,0,0,1,0,1|1,1,0]=4 250 B15R1.5483 CC(=CCOCC(=O)c1ccc(o1)C)C 74d1a12b9187dac673cc47b014adc460 [0,0,0,1,0,1|1,0,1]=4 251 B15R1.5483 CC(=CCOCC(=O)c1ccc(s1)C)C 73aa16d5d70e16f4096e0eac3142990f [0,0,0,1,0,1|1,1,0]=4 252 B15R1.8273 CC(=CCCN(C)c1cc(ccn1)C)C 004a870e24c6312afc1298c8ab05243e [0,0,0,1,0,1|2,0,0]=4 253 B15R1.8273 CC(=CCCN(C)c1cccc(c1)C)C 68c66714582afd6972c0af58bfb56fc0 [0,0,0,1,0,1|2,0,0]=4 254 B15R1.8273 CC(=CCCN(C)c1cccc(n1)C)C f40ff1c077b02b2693bb77cfee66ef01 [0,0,0,1,0,1|2,0,0]=4 255 B15R1.8273 CC(=CCCN(C)c1ccnc(=O)[nH]1)C 2c5dda9d50e1cc8b3812cd261b91a564 [0,0,0,1,0,1|2,0,0]=4 256 B15R1.8273 CC(=CCCN(C)c1cncc(c1)C)C 58ada1683651318aab407be49dbb4fbf [0,0,0,1,0,1|2,0,0]=4 257 B15R1.8273 CC(=CCCN(C)c1cncc(n1)C)C 2518d3caee58063d8f533e5b5bfa7616 [0,0,0,1,0,1|2,0,0]=4 258 B15R1.8273 CC(=CCCN(C)c1nccc(n1)C)C fb33d6604eb1ece40a14d2e687fd1790 [0,0,0,1,0,1|2,0,0]=4 259 B15R1.8879 CC(=O)Nc1ccc(s1)NCC=C(C)C a0b658c6d620b3f5313a13bd8829b917 [0,0,0,1,0,1|2,0,0]=4 260 B15R1.8923 CC(=CCCNc1ccc([nH]1)C(=O)O)C 519362a7d7ae76e7abff390828b07833 [0,0,0,1,0,1|2,0,0]=4 261 B15R1.8923 CC(=CCCNc1ccc(s1)C(=O)N)C 4ec0412cd63ca55bfbeba16f4cc0414e [0,0,0,1,0,1|2,0,0]=4 262 B15R1.8923 CC(=CCNCc1ccc(o1)C(=O)O)C 1d1cc6550b755106a99e8b59fc047bde [0,0,0,1,0,1|2,0,0]=4 263 B15R1.8923 CC(=CCNCc1ccc(s1)C(=O)O)C 45097d34ea8c5b112d0b1683c40c6b9c [0,0,0,1,0,1|2,0,0]=4 264 B15R1.8923 CC(=CCOCc1ccc(o1)C(=O)O)C d9dd57b9650f48ad9cf52b4d555333a5 [0,0,0,1,0,1|2,0,0]=4 265 B15R1.8923 CC(=O)c1cc(cs1)CNCC=C(C)C f6e608d7d3b3ec88d0077af13bf798d5 [0,0,0,1,0,1|1,0,1]=4 266 B15R1.8923 CC(=O)c1cc(cs1)COCC=C(C)C af3868c7dd1689076a7b405702483881 [0,0,0,1,0,1|1,0,1]=4 267 B15R1.8923 CC(=O)c1ccc(s1)NCCC=C(C)C 0430c2768b19de778635925faed879e1 [0,0,0,1,0,1|1,0,0]=3 268 B15R1.8923 CC(=O)c1cnc(o1)NCCC=C(C)C 23a69f6236878178d1456b8cd99b83c3 [0,0,0,1,0,1|2,0,0]=4 269 B15R1.8923 CC(=O)c1cnc(s1)NCCC=C(C)C 6093941af4ebc3265191827f0a39f94e [0,0,0,1,0,1|2,0,0]=4 270 B15R1.8923 CC(=O)c1csc(n1)NCCC=C(C)C 504d20f666de1aae7f73a4dce37b0134 [0,0,0,1,0,1|2,0,0]=4 271 B15R1.8923 CC(=O)c1ncc(s1)COCC=C(C)C d2ae74e1ec2603e14a05d9ae57ac8f67 [0,0,0,1,0,1|2,0,0]=4 272 B15R1.9000 CC(=O)c1cc(ccn1)NCC=C(C)C d5acafc2297e09182bcd547678b55583 [0,0,0,1,0,1|1,0,1]=4 273 B15R1.9000 CC(=O)c1cccc(c1)NCC=C(C)C a3bb095fe620d45b7aa0d5a00d4d7b00 [0,0,0,1,0,1|1,0,1]=4 274 B15R1.9000 CC(=O)c1cccc(c1)OCC=C(C)C cb3d520c6c1c2ec9a6fa3f31a440853c [0,0,0,1,0,1|1,0,1]=4 275 B15R1.9000 CC(=O)c1cccc(n1)NCC=C(C)C 97fd43674ada9965e11bbc6472e78660 [0,0,0,1,0,1|2,0,0]=4 276 B15R1.9000 CC(=O)c1ccnc(c1)NCC=C(C)C f07dee0e3cf22f84da354ded65f536be [0,0,0,1,0,1|1,0,1]=4 277 B15R1.9000 CC(=O)c1ccnc(n1)NCC=C(C)C e9278f2546521f06f25ae8f2f337e255 [0,0,0,1,0,1|2,0,0]=4 278 B15R1.9000 CC(=O)c1cncc(c1)NCC=C(C)C 6cae937b216b3c1b2b970f4eef6c25c5 [0,0,0,1,0,1|1,0,1]=4 279 B15R1.9000 CC(=O)c1cncc(c1)OCC=C(C)C 8cba4ebd88b493d4330184cff602af13 [0,0,0,1,0,1|1,0,1]=4 280 B15R1.9000 CC(=O)c1cncc(n1)NCC=C(C)C 0daf3260e440b41a96304c0760bb684d [0,0,0,1,0,1|2,0,0]=4 281 B15R1.1080 CC(=O)c1ccc(cc1)NCC=C(C)C 70752b036b441fde588b0b604563b42f [0,1,0,1,0,0|1,0,1]=4 282 B15R1.1080 CC(=O)c1ccc(cc1)OCC=C(C)C e480d79ed8dca4aca26def6a4afffdfe [0,1,0,1,0,0|1,0,1]=4 283 B15R1.1080 CC(=O)c1ccc(cn1)NCC=C(C)C 1ee0d3e21a9ad4d5b6e76ea49a4f9455 [0,1,0,1,0,0|1,0,1]=4 284 B15R1.1080 CC(=O)c1ccc(cn1)OCC=C(C)C f48809e52bcdda82127aad6d559a7a66 [0,1,0,1,0,0|1,0,1]=4 285 B15R1.1080 CC(=O)c1ccc(nc1)NCC=C(C)C 05728f463425c2ee35e83d111620d4d4 [0,1,0,1,0,0|1,0,1]=4 286 B15R1.1080 CC(=O)c1ccc(nc1)OCC=C(C)C c0957dc80af4498f6bd8d7e52f7cdd55 [0,1,0,1,0,0|1,0,1]=4 287 B15R1.1080 CC(=O)c1ccc(nn1)NCC=C(C)C 30c8dcdb74fc103e33b4dff50cea2c56 [0,1,0,1,0,0|2,0,0]=4 288 B15R1.882 CC(=CCCN(C)c1ccc(cc1)C)C d6b50fefc0a50280d6a30ae18ec3c719 [0,1,0,1,0,0|2,0,0]=4 289 B15R1.882 CC(=CCCN(C)c1ccc(cn1)C)C 8cc65985494774d27cba1f1d825b5785 [0,1,0,1,0,0|2,0,0]=4 290 B15R1.882 CC(=CCCN(C)c1ccc(nc1)C)C f8a228e6d2ba91b4728a1db7f8b31238 [0,1,0,1,0,0|2,0,0]=4 291 B15R1.938 CC(=CCNc1ccc(s1)C(=O)CF)C 9c2aa1e4ff658c9aa509e057de388af6 [0,1,0,1,0,0|2,0,0]=4 292 B15R1.938 CCC(=O)c1ccc(s1)NCC=C(C)C 6eb55145f8fe29956c400ef0d1820b7d [0,1,0,1,0,0|2,0,0]=4 293 B15R1.938 CNC(=O)c1ccc(o1)NCC=C(C)C 52a01198d77f07db8b25cf87c0f651b8 [0,1,0,1,0,0|2,0,0]=4 294 B15R1.938 CNC(=O)c1ccc(s1)NCC=C(C)C 1e0e33af7e1a071396e6a7ee1cd6e1bb [0,1,0,1,0,0|2,0,0]=4 295 B15R1.938 COC(=O)c1ccc([nH]1)NCC=C(C)C 552eead85e78581aa1162d876bd07b8f [0,1,0,1,0,0|2,0,0]=4 296 B15R1.938 COC(=O)c1ccc(o1)NCC=C(C)C 89744054bb2937d13ff91de2960ccb31 [0,1,0,1,0,0|2,0,0]=4 297 B15R1.938 COC(=O)c1ccc(s1)NCC=C(C)C 19ada2b6a0509bc1aa5cfe0ee3ded811 [0,1,0,1,0,0|2,0,0]=4 298 B15R1.5611 CC(=O)c1sc(cc1C)NCC=C(C)C 578fa99d2d9436fbdac82350a92ce94b [0,1,0,1,0,0|2,0,0]=4 299 B15R1.6593 CC(=O)c1cc(c(s1)NCC=C(C)C)C c4a280365e95b0f1e7fae15575d7860c [0,1,0,1,0,0|2,0,0]=4 300 B15R1.23456 CC(=O)c1c[nH]c(c1C)NCC=C(C)C d47cafd49bd7c401a689a8a02f678111 [0,1,0,1,0,0|2,0,0]=4 301 B15R1.23456 CC(=O)c1ncc(n1C)NCC=C(C)C 2b9cd6c7afedb930849d2915f2cc82ed [0,1,0,1,0,0|2,0,0]=4 302 B15R1.23456 CC(=O)c1scc(c1C)NCC=C(C)C c4a112eb84f585cff57f157cdea62ce9 [0,1,0,1,0,0|2,0,0]=4 303 B11R0.46 CC=CCNC(=O)/C=C/C(=O)C 2d33413c34aea9a80e454b89cdffc0e6 [1,0,0,0,1,0|2,0,0]=4 304 B11R0.46 CC=CCNC(=O)C=CC(=O)C 17916735d55e34dfd5f1de9c0a5d222f [1,0,0,0,1,0|2,0,0]=4 305 B15R0.221 CC(=CCC/C(=C/CNC/C=C(/C)\I)/C)C bb1c474d97820460f246dffd69457b54 [0,0,0,0,0,2|1,0,1]=4 306 B15R0.221 CC(=CCC/C(=C/CNC/C=C(\C)/Cl)/C)C f6e917c440b02120ca11a2dc4d27850c [0,0,0,0,0,2|1,0,1]=4 307 B15R0.221 CC(=CCC/C(=C/CNCC=C(C)C)/C)C 831afeb581d59ec13c74eb685fe97664 [0,0,0,0,0,2|1,0,1]=4 308 B15R0.221 CC(=CCC/C(=C/CNCC=C(C)Cl)/C)C 78940148c0e9b550d7abbc71441c917d [0,0,0,0,0,2|1,0,1]=4 309 B15R0.221 CC(=CCC/C(=C/CNCC=C(C)I)/C)C e19223327e32dfd0b9a5ef09b21c248a [0,0,0,0,0,2|1,0,1]=4 310 B15R0.221 CC(=CCC/C(=C/COC/C=C(/C)\Cl)/C)C 2d138aac44668227acb410bdbc7598a5 [0,0,0,0,0,2|1,0,1]=4 311 B15R0.221 CC(=CCC/C(=C/COC/C=C(/C)\I)/C)C ccb4434e7990dcd685f274d6ef6e7704 [0,0,0,0,0,2|1,0,1]=4 312 B15R0.221 CC(=CCC/C(=C/COC/C=C(\C)/Cl)/C)C b81502b9e69fbc0910f78f041b1ea0ff [0,0,0,0,0,2|1,0,1]=4 313 B15R0.221 CC(=CCC/C(=C/COCC=C(C)C)/C)C eba7fb7fb370d454b40cc7905de1f22c [0,0,0,0,0,2|1,0,1]=4 314 B15R0.221 CC(=CCC/C(=C/COCC=C(C)Cl)/C)C ac82ad76d77d01c89724d8c25b5785d9 [0,0,0,0,0,2|1,0,1]=4 315 B15R0.221 CC(=CCC/C(=C/COCC=C(C)I)/C)C 82d142812a245b39d5e906b2d0cb005c [0,0,0,0,0,2|1,0,1]=4 316 B15R0.221 CC(=CCC/C(=C\COC/C=C(/C)\I)/C)C e389688d6659c03aa30d681877a6a46b [0,0,0,0,0,2|1,0,1]=4 317 B15R0.221 CC(=CCC/C(=C\COC/C=C(\C)/Cl)/C)C ab4caa2598a75319aeb8caee7ac7e262 [0,0,0,0,0,2|1,0,1]=4 318 B15R0.221 CC(=CCC/C(=C\COCC=C(C)C)/C)C 925b4d1eecc67698cdd1e902f1b43c1c [0,0,0,0,0,2|1,0,1]=4 319 B15R0.221 CC(=CCC/C(=C\COCC=C(C)Cl)/C)C 5f49d473350023ccc4e9f2ff8b918557 [0,0,0,0,0,2|1,0,1]=4 320 B15R0.221 CC(=CCC/C(=C\COCC=C(C)I)/C)C ba3a54117e3c9c35ac819fea72fcea13 [0,0,0,0,0,2|1,0,1]=4 321 B15R0.221 CC(=CCCC(=CCNC/C=C(/C)\I)C)C 7b65210171b46c4a0a25172c10ff799a [0,0,0,0,0,2|1,0,1]=4 322 B15R0.221 CC(=CCCC(=CCNC/C=C(\C)/Cl)C)C 3d052103b1aae2f7e3674d7716c8e7ee [0,0,0,0,0,2|1,0,1]=4 323 B15R0.221 CC(=CCCC(=CCNCC=C(C)C)C)C 151b1628b31ed55ecc297b2c48183d6c [0,0,0,0,0,2|1,0,1]=4 324 B15R0.221 CC(=CCCC(=CCNCC=C(C)Cl)C)C b576950a20a3113b2fdaf1fb809984fd [0,0,0,0,0,2|1,0,1]=4 325 B15R0.221 CC(=CCCC(=CCNCC=C(C)I)C)C ccbab5db35a0bc85b3b5f7241eef8d40 [0,0,0,0,0,2|1,0,1]=4 326 B15R0.221 CC(=O)CCNC/C=C(\C)/CCC=C(C)C 33d4da8e4c5bb0b75de775a9e37a6671 [0,0,0,0,0,2|0,0,2]=4 327 B15R0.221 CC(=O)CCNCC=C(C)CCC=C(C)C 08e5166b975aa51b2e07b83da815326d [0,0,0,0,0,2|0,0,2]=4 328 B15R0.221 CC(=O)CCOC/C=C(/C)\CCC=C(C)C 72ef2c925ff516638289c8f1e2095373 [0,0,0,0,0,2|0,0,2]=4 329 B15R0.221 CC(=O)CCOC/C=C(\C)/CCC=C(C)C 14063a3c9199006d08bd1ed087377fa0 [0,0,0,0,0,2|0,0,2]=4 330 B15R0.221 CC(=O)NCOC/C=C(\C)/CCC=C(C)C eb9ff35562555d29b37026dff0a36387 [0,0,0,0,0,2|0,0,2]=4 331 B15R0.221 CC(=O)OCNC/C=C(\C)/CCC=C(C)C d35cbc1cc19649e9f4b0e93b72148982 [0,0,0,0,0,2|0,0,2]=4 332 B15R0.221 CC(=O)OCNCC=C(C)CCC=C(C)C 3a10001f68ca74c1882283b057688ace [0,0,0,0,0,2|0,0,2]=4 333 B15R0.221 CC(=O)OCOC/C=C(/C)\CCC=C(C)C 67190df269f91cb84dd2ec87454e1825 [0,0,0,0,0,2|0,0,2]=4 334 B15R0.221 CC(=O)OCOC/C=C(\C)/CCC=C(C)C 76f77defb620cdb940149ab001d87af5 [0,0,0,0,0,2|0,0,2]=4