0 B30R4.67639070 COc1cccc2c1OCC2NC(=O)N(C)CC3CCCN4C3CCCC4 407f19fbe2e6ff5eb645a80043c21be3 [0,0,0,0,0,0|3,0,1]=4 1 B30R4.67639070 COc1cccc2c1[nH]nc2NC(=O)N(C)CC3CCCN4C3CCCC4 110083205551604ea6693cd13e55b578 [0,0,0,0,0,0|4,0,0]=4 2 B30R4.67639070 COc1cccc2c1ccn2CC(=O)N(C)CC3CCCN4C3CCCC4 5bea4c6140ce7294a19ec88c7f563687 [0,0,0,0,0,0|0,0,0]=0 3 B29R4.51909506 CN(CC1CCCN2C1CCCC2)C(=O)Cn3ccc4c3cccc4Br b988d466ac6836bec4a0c996042ce778 [1,0,0,0,0,0|1,0,0]=2 4 B29R4.51909506 CN(CC1CCCN2C1CCCC2)C(=O)Cn3ccc4c3cccc4Cl 6ba188ad10031532e7ac88b17351eb61 [1,0,0,0,0,0|1,0,0]=2 5 B29R4.51909506 CN(CC1CCCN2C1CCCC2)C(=O)Cn3ccc4c3cccc4F e1cf95799a7fa93426becc2da4b8e27d [1,0,0,0,0,0|1,0,0]=2 6 B29R4.51909506 CN(CC1CCCN2C1CCCC2)C(=O)Cn3cnc4c3cccc4F 793f1200d639b74ea309196d1ed28fc4 [1,0,0,0,0,0|2,0,0]=3 7 B29R4.51909506 Cc1cccc2c1ccn2CC(=O)N(C)CC3CCCN4C3CCCC4 39d7e0e33665d451231e23e8378678b1 [1,0,0,0,0,0|0,0,0]=1 8 B29R4.51909506 Cc1cccc2c1onc2CC(=O)N(C)CC3CCCN4C3CCCC4 dc6426b204f89235bc14021d121ad92c [1,0,0,0,0,0|3,0,0]=4 9 B29R4.90282150 COc1cccc2c1ccn2CC(=O)NC[C@@H]3CCCN4[C@@H]3CCCC4 e7bdc826e01242752bf4573b6fcef27c [1,0,0,0,0,0|0,0,0]=1 10 B31R4.374045247 CN(CC1CCCN2C1CCCC2)C(=O)Cn3ccc4c3cccc4[N+](=O)[O-] 466b2a209bb6c3a8e367dcc5c7c819af [0,1,0,0,0,0|2,0,0]=3 11 B29R3.10820746 COCCN1CCCC(C1)CN(C)C(=O)Cn2ccc3c2cccc3OC a3e1bdded77e29f99d2fbed3e364a314 [0,0,1,0,0,0|1,0,0]=2 12 B29R3.166049029 COc1cccc(c1OC)CCC(=O)N(C)CC2CCCN3C2CCCC3 086df44792a54ff86cf5cdec7a0aba89 [0,0,1,0,0,0|2,0,1]=4 13 B29R4.90282549 COc1cccc2c1OCC2C(=O)N(C)CC3CCCN4C3CCCC4 bddf019cd7fe16d041cc73f21ea313b4 [0,0,0,0,1,0|2,0,1]=4 14 B29R4.90282549 COc1cccc2c1occ2C(=O)N(C)CC3CCCN4C3CCCC4 92cf106452c381a7d1c9cf851a180ae9 [0,0,0,0,1,0|2,0,0]=3 15 B31R4.105976672 COc1cccc2c1ccn2CCC(=O)N(C)CC3CCCN4C3CCCC4 7da443b4c76fee4126769013399dd661 [0,0,0,0,0,1|0,0,0]=1 16 B31R4.105993723 COc1cccc2c1ncc(c2)NC(=O)N(C)CC3CCCN4C3CCCC4 b48f2602e689b21d39f94fa02b581646 [0,0,0,0,0,1|3,0,0]=4 17 B31R4.105993723 COc1nccc2c1ccc(c2)NC(=O)N(C)CC3CCCN4C3CCCC4 a315a9d76f22ba86193d831a503fa8fb [0,0,0,0,0,1|3,0,0]=4 18 B31R4.106031978 COc1cccc2c1cccc2NC(=O)N(C)CC3CCCN4C3CCCC4 fc24b67027edef782de34fd2774730fd [0,0,0,0,0,1|2,0,0]=3 19 B31R4.106031978 COc1cccc2c1cccc2NC(=S)N(C)CC3CCCN4C3CCCC4 fa5fa6a117714cfd7048385a6b10b9ba [0,0,0,0,0,1|2,1,0]=4 20 B31R4.106031978 COc1cccc2c1cncc2NC(=O)N(C)CC3CCCN4C3CCCC4 d8dd0fe6b9d224c82e2b4b91539f79d1 [0,0,0,0,0,1|2,0,0]=3 21 B31R4.106031978 COc1cccc2c1cncc2NC(=S)N(C)CC3CCCN4C3CCCC4 5fafb41e30eb4855af4d33e53eb35bf6 [0,0,0,0,0,1|2,1,0]=4 22 B31R4.106031978 COc1cccc2c1nccc2NC(=O)N(C)CC3CCCN4C3CCCC4 eac2de74e938bab7d96a839dee23a552 [0,0,0,0,0,1|2,0,0]=3 23 B31R4.106031978 COc1cccc2c1nccc2NC(=S)N(C)CC3CCCN4C3CCCC4 35ab83a5721ddc01d04afe4a6d4d1a32 [0,0,0,0,0,1|2,1,0]=4 24 B31R4.106031978 COc1ccnc2c1cccc2NC(=O)N(C)CC3CCCN4C3CCCC4 8c84e0286f95988a857accc5435ec307 [0,0,0,0,0,1|3,0,0]=4 25 B31R4.106031978 COc1nccc2c1cccc2NC(=O)N(C)CC3CCCN4C3CCCC4 44de94e715bf58c57bb6b001d355d714 [0,0,0,0,0,1|3,0,0]=4 26 B28R3.955842 COc1cccc(c1)C(C)CC(=O)N(C)CC2CCCN3C2CCCC3 31563913bb4c74b7d2158c017c17f481 [1,0,1,0,0,0|1,0,1]=4 27 B28R3.6270415 COc1cccc2c1ccn2CC(=O)N(C)CC3CCCN(C3)CCO 7c803313c8e3a48fa302c934267dd253 [1,0,1,0,0,0|1,0,0]=3 28 B28R3.8440921 COCCN1CCCC(C1)CN(C)C(=O)Cn2ccc3c2cccc3Br 55d1266635f9a5cdde8bc7628ec5fe67 [1,0,1,0,0,0|2,0,0]=4 29 B28R3.8440921 COCCN1CCCC(C1)CN(C)C(=O)Cn2ccc3c2cccc3C c6ece87ab30e46da9dbc394abf3c11e0 [1,0,1,0,0,0|1,0,0]=3 30 B28R3.8440921 COCCN1CCCC(C1)CN(C)C(=O)Cn2ccc3c2cccc3Cl bdc98d461438a06e5f53601a50919185 [1,0,1,0,0,0|2,0,0]=4 31 B28R3.8440921 COCCN1CCCC(C1)CN(C)C(=O)Cn2ccc3c2cccc3F 3b1c1c4bab1570761c4101970531d94e [1,0,1,0,0,0|2,0,0]=4 32 B28R3.8442859 COCCN1CCCC(C1)CNC(=O)Cn2ccc3c2cccc3OC 88b67afd1f852f419e686e1ff908effb [1,0,1,0,0,0|1,0,0]=3 33 B28R3.956399 COc1cccc(c1Cl)CCC(=O)N(C)CC2CCCN3C2CCCC3 24cfa21aea539fc19c7949eddbf95950 [1,0,1,0,0,0|2,0,0]=4 34 B28R3.740226 CCC1CCCCN1CCN(C)C(=O)Cn2ccc3c2cccc3OC 25bc2335aa2488f6b2b5d00350bcf883 [1,0,1,0,0,0|2,0,0]=4 35 B28R3.97041070 COc1cccc2c1ccn2CC(=O)NCCCCCN3CCCCC3 e6659228e0f2062445332b7164d04d22 [1,0,1,0,0,0|0,0,0]=2 36 B28R3.97041070 COc1cccc2c1ccn2CC(=O)NCCOCCN3CCCCC3 9268a0806f274bf2cc66029b460bce23 [1,0,1,0,0,0|1,0,0]=3 37 B28R3.97041070 COc1cccc2c1ccn2CC(=O)NCCOCCN3CCOCC3 080702e7141719aee960c310761d8b97 [1,0,1,0,0,0|2,0,0]=4 38 B28R4.34131914 Cc1cccc2c1ccn2CC(=O)NC[C@@H]3CCCN4[C@@H]3CCCC4 f33b9fbac3e1142a6e0f728bda667f75 [2,0,0,0,0,0|0,0,0]=2 39 B28R4.34131914 O=C(Cn1ccc2c1cccc2Br)NC[C@@H]3CCCN4[C@@H]3CCCC4 aee58ed3bd38812f0e74dd368954a52c [2,0,0,0,0,0|1,0,0]=3 40 B28R4.34131914 O=C(Cn1ccc2c1cccc2Cl)NC[C@@H]3CCCN4[C@@H]3CCCC4 440692b083dce2b2d07043c3e9bc5a66 [2,0,0,0,0,0|1,0,0]=3 41 B28R4.34131914 O=C(Cn1ccc2c1cccc2F)NC[C@@H]3CCCN4[C@@H]3CCCC4 11c341a30d17a31277edc3d8cac8b511 [2,0,0,0,0,0|1,0,0]=3 42 B28R4.34131914 O=C(Cn1cnc2c1cccc2F)NC[C@@H]3CCCN4[C@@H]3CCCC4 30dc22fa6ad603969c34f8b4245e0808 [2,0,0,0,0,0|2,0,0]=4 43 B28R4.41182006 CN(CC1CCCN2C1CCCC2)C(=O)Cc3coc4c3cccc4 3ba444dd32b3f12772c62c66cad69cc9 [2,0,0,0,0,0|2,0,0]=4 44 B28R4.41182006 CN(CC1CCCN2C1CCCC2)C(=O)Cc3csc4c3cccc4 afbf2f8ecaf9cba35054098d287411e5 [2,0,0,0,0,0|2,0,0]=4 45 B28R4.41182006 CN(CC1CCCN2C1CCCC2)C(=O)Cc3occ4c3cccc4 7780606a3452401e2e8829d65d03b927 [2,0,0,0,0,0|2,0,0]=4 46 B28R4.41182006 CN(CC1CCCN2C1CCCC2)C(=O)Cn3ccc4c3cccc4 ff75f3259ee9a64d8f258d46404771f9 [2,0,0,0,0,0|0,0,0]=2 47 B28R4.41182006 CN(CC1CCCN2C1CCCC2)C(=O)Cn3ccc4c3nccc4 91ae5488b9cbafaa28d17008e0fb0e47 [2,0,0,0,0,0|1,0,0]=3 48 B28R4.41182006 CN(CC1CCCN2C1CCCC2)C(=O)Cn3cnc4c3cccc4 022c7510909125d1f198fb3b47d76cc8 [2,0,0,0,0,0|1,0,0]=3 49 B28R4.41182006 CN(CC1CCCN2C1CCCC2)C(=O)Cn3ncc4c3cccc4 edff005f08408b167f5cb411e683edb8 [2,0,0,0,0,0|1,0,0]=3 50 B28R4.41182006 CN(CC1CCCN2C1CCCC2)C(=O)Cn3nnc4c3cccc4 4b6742abdd298d6af4e9ae7f55fe90d8 [2,0,0,0,0,0|2,0,0]=4 51 B30R3.2988646 COc1ccccc1C(=O)NCCC(=O)N(C)CC2CCCN3C2CCCC3 6671b8bdfda3269d9711c53312356257 [0,1,1,0,0,0|2,0,0]=4 52 B30R4.228866664 Cc1ccc2c(coc2c1C)CC(=O)N(C)CC3CCCN4C3CCCC4 c2f1c7a870d15d580a2763e4b74cdff0 [1,1,0,0,0,0|2,0,0]=4 53 B30R4.399299826 CN(CC1CCCN2C1CCCC2)C(=O)Cn3c(=O)oc4c3cccc4Cl 9bba5ab1c11854d7c58711c8b667d0f2 [1,1,0,0,0,0|2,0,0]=4 54 B30R4.399299826 Cc1cccc2c1NC(=O)C2CC(=O)N(C)CC3CCCN4C3CCCC4 3bf4e7fb4fafbc7d816877979143ba17 [1,1,0,0,0,0|2,0,0]=4 55 B30R4.399299826 Cc1nc2c(cccc2n1CC(=O)N(C)CC3CCCN4C3CCCC4)F 2361d53fa93986dde18d1e2dbeac7fe0 [1,1,0,0,0,0|2,0,0]=4 56 B30R4.247991021 O=C(Cn1ccc2c1cccc2[N+](=O)[O-])NC[C@@H]3CCCN4[C@@H]3CCCC4 233f275f68909a389e5ada82c3e5103d [1,1,0,0,0,0|2,0,0]=4 57 B32R4.405866443 COc1cccc2c1nc(cc2NC(=O)N(C)CC3CCCN4C3CCCC4)C 1b82133d32ba222bbc564123d3a88c59 [0,1,0,0,0,1|2,0,0]=4 58 B32R4.298669890 CC(=O)Nc1cccc2c1ccn2CC(=O)N(C)CC3CCCN4C3CCCC4 5c55a7ef06614bfdf3945f68756698f2 [0,2,0,0,0,0|1,0,0]=3 59 B30R4.67799957 COc1cccc2c1cccc2C(=O)N(C)CC3CCCN4C3CCCC4 170eda30f814fb4f4b1a6888588dc92b [0,0,1,1,0,0|1,0,1]=4 60 B30R4.150624947 CN(CC1CCCN2C1CCCC2)C(=O)Cn3ccc4ccccc4c3=O c044dc22e75e9cc8d1070e123d6e4ab7 [0,0,1,1,0,0|2,0,0]=4 61 B30R4.75284355 CN(CC1CCCN2C1CCCC2)C(=O)Cn3ccc4c3cc(cc4)C#N 08411e6363d6ab0650935eabc8fb1870 [0,0,1,1,0,0|2,0,0]=4 62 B30R4.75284355 CN(CC1CCCN2C1CCCC2)C(=O)Cn3ccc4c3cc(cc4)C=O d5efa7d0c3b79db60d6d0fe16bef47c9 [0,0,1,1,0,0|2,0,0]=4 63 B30R4.75284355 COc1ccc2ccn(c2c1)CC(=O)N(C)CC3CCCN4C3CCCC4 1cba6e1d9cd55d3c14ab022dbe91a4d1 [0,0,1,1,0,0|0,0,0]=2 64 B30R4.75284355 COc1ccc2scc(c2c1)CC(=O)N(C)CC3CCCN4C3CCCC4 e9ef6823105bb8f243e2a0c04e67138d [0,0,1,1,0,0|2,0,0]=4 65 B30R4.2401111 CN(CC1CCCN2C1CCCC2)C(=O)Cn3ccc4c3ccc(c4)C#N 2bcccf1d4cbe500e252f90656cf9ad0e [0,0,1,1,0,0|2,0,0]=4 66 B30R4.2401111 CN(CC1CCCN2C1CCCC2)C(=O)Cn3ccc4c3ccc(c4)C=O da030efb8b45a246e97f1c0598b6f28e [0,0,1,1,0,0|2,0,0]=4 67 B30R4.2401111 COc1ccc2c(c1)ccn2CC(=O)N(C)CC3CCCN4C3CCCC4 8c42c046a653fa25dfbc44606ec66737 [0,0,1,1,0,0|0,0,0]=2 68 B30R4.2401111 COc1ccc2c(coc2c1)CC(=O)N(C)CC3CCCN4C3CCCC4 c6f904c4927049b22429a23b653745c4 [0,0,1,1,0,0|2,0,0]=4 69 B30R4.367899053 COc1ccc2c(c1)CN(C2)CC(=O)N(C)CC3CCCN4C3CCCC4 794e57e086f8e8cf15940462f72d4aff [0,0,1,1,0,0|0,0,2]=4 70 B30R4.67784288 COc1cccc2c1ccn2CC(=O)N3CCCC(C3)CN4CCCCC4 69fa9a66dca710fe614bd1d8ea20b9fc [0,0,1,1,0,0|0,0,0]=2 71 B30R4.16205 CN(CC1CCCN2C1CCCC2)C(=O)COc3cccc4c3ccn4C 970cb693de87a9f07737f13c73e7a994 [0,0,1,1,0,0|2,0,0]=4 72 B32R5.316474596 COc1cccc2c1ccn2CC(=O)N3C[C@@H]4C[C@H](C3)[C@@H]5CCCC(=O)N5C4 71bb16195c19d9e7006c1c617b027d99 [0,1,0,1,0,0|0,0,1]=3 73 B32R5.316474596 COc1cccc2c1ccn2CC(=O)N3C[C@H]4C[C@H](C3)[C@H]5CCCC(=O)N5C4 ad9b6501efd8bb13c9bad03bbf65cb00 [0,1,0,1,0,0|0,0,1]=3 74 B28R3.2187305 COc1ccccc1CCCC(=O)N(C)CC2CCCN3C2CCCC3 0666864cf11cad2b3b09024c2dbc3cce [0,0,1,0,1,0|0,0,2]=4 75 B28R3.2187305 COc1ccccc1CCNC(=O)N(C)CC2CCCN3C2CCCC3 17f37bd7208356b7c299844fb36df3b4 [0,0,1,0,1,0|0,0,2]=4 76 B28R3.2187305 COc1ccccc1COCC(=O)N(C)CC2CCCN3C2CCCC3 d07b6238978d79bef5bbd6994e3e807f [0,0,1,0,1,0|1,0,1]=4 77 B28R3.2187305 COc1ccccc1OCCC(=O)N(C)CC2CCCN3C2CCCC3 18b5f057c2010deac3712413278a9bb4 [0,0,1,0,1,0|1,0,1]=4 78 B28R3.2187305 COc1ccccc1SCCC(=O)N(C)CC2CCCN3C2CCCC3 c4e20c819f47c4422ee8e54984735a7d [0,0,1,0,1,0|1,0,1]=4 79 B28R3.8350750 COCCN1CCC(C1)CN(C)C(=O)Cn2ccc3c2cccc3OC ef6994286b6ad32a02ca53188289c1c3 [0,0,1,0,1,0|1,0,0]=3 80 B28R3.97041521 COc1cccc2c1ccn2CC(=O)N(C)CCCCN3CCOCC3 2dc6b8f172addfe0bbc3f785ce9e42a7 [0,0,1,0,1,0|1,0,0]=3 81 B28R3.954879 COc1cccc(c1C#N)NC(=O)N(C)CC2CCCN3C2CCCC3 6a7a35fab928fa0da4375ca928bae284 [0,0,1,0,1,0|1,0,1]=4 82 B28R3.954879 COc1cccc(c1C=O)NC(=O)N(C)CC2CCCN3C2CCCC3 dc13fc60c6a34e404d76ccdf7df46d82 [0,0,1,0,1,0|1,0,0]=3 83 B28R3.954879 COc1cccc(c1C=O)NC(=S)N(C)CC2CCCN3C2CCCC3 33e93aca3e1da14e6fde04e585fbe6c3 [0,0,1,0,1,0|1,1,0]=4 84 B28R3.954879 COc1cccc(c1CO)NC(=O)N(C)CC2CCCN3C2CCCC3 64daa65849bd89bc6fd5a3abfb39a3de [0,0,1,0,1,0|1,0,1]=4 85 B28R3.954879 COc1cccc(c1OC)CC(=O)N(C)CC2CCCN3C2CCCC3 9d018ac390e52969c9a8944fb3e3fb24 [0,0,1,0,1,0|1,0,1]=4 86 B28R3.954879 COc1cccc(c1OC)NC(=O)N(C)CC2CCCN3C2CCCC3 c95f9e08a67ea73b85c89d3eca737978 [0,0,1,0,1,0|1,0,1]=4 87 B28R4.34132149 Cc1cccc2c1occ2C(=O)N(C)CC3CCCN4C3CCCC4 a8bef0fd5eb9fa42e15ffd6138dff16e [1,0,0,0,1,0|2,0,0]=4 88 B28R4.57255833 COc1cccc2c1occ2C(=O)NC[C@@H]3CCCN4[C@@H]3CCCC4 a2d022672cccac7f2397f656ddebfc25 [1,0,0,0,1,0|2,0,0]=4 89 B30R3.187528397 COCCN1CCCC(C1)CN(C)C(=O)CCn2ccc3c2cccc3OC 9d593228f6d7ef323da786557df3a5b0 [0,0,1,0,0,1|1,0,0]=3 90 B30R4.39919664 CN(CC1CCCN2C1CCCC2)C(=O)CCn3ccc4c3cccc4Cl 2aa3a13217180d05224299b9c1ffbd77 [1,0,0,0,0,1|1,0,0]=3 91 B30R4.39919664 Cc1cccc2c1[nH]cc2CNC(=O)N(C)CC3CCCN4C3CCCC4 3d0b88619cfcfd38716487db98b94e9d [1,0,0,0,0,1|2,0,0]=4 92 B30R4.39919664 Cc1cccc2c1ccn2CCC(=O)N(C)CC3CCCN4C3CCCC4 cfd3254737223b9de81c12a66100945f [1,0,0,0,0,1|0,0,0]=2 93 B30R4.39931131 CN(CC1CCCN2C1CCCC2)C(=O)Nc3ccc4c(cccc4c3)O d59fccd3d07a5515976cafca846b1d30 [1,0,0,0,0,1|2,0,0]=4 94 B30R4.39966960 CN(CC1CCCN2C1CCCC2)C(=O)Nc3cccc4c3cccc4O 387449eaee26cc786b8c590b69408b1f [1,0,0,0,0,1|2,0,0]=4 95 B30R4.39966960 Cc1cccc2c1nccc2NC(=O)N(C)CC3CCCN4C3CCCC4 cb6bdd67881c98183440a669af0af817 [1,0,0,0,0,1|2,0,0]=4 96 B30R4.67785043 COc1cccc2c1ccn2CCC(=O)NC[C@@H]3CCCN4[C@@H]3CCCC4 59db2197dc1babf0cced6977f06b1ebf [1,0,0,0,0,1|0,0,0]=2 97 B30R4.67785301 COc1cccc2c1ccn2CC(=O)NCC[C@@H]3CCCN4[C@@H]3CCCC4 37c8f3cf1f54777874aaaabe61825d01 [1,0,0,0,0,1|0,0,0]=2 98 B30R4.67854172 COc1cccc2c1nccc2NC(=O)NC[C@@H]3CCCN4[C@@H]3CCCC4 e131463d02e5b48d699051ddefcae629 [1,0,0,0,0,1|2,0,0]=4 99 B32R4.93200611 COc1cccc2c1[nH]cc2CCNC(=O)N(C)CC3CCCN4C3CCCC4 2f963177e7d8a5fa486d3ec9285efed2 [0,0,0,0,0,2|2,0,0]=4