70666223 -OEChem-04262419382D 73 76 0 1 0 0 0 0 0999 V2000 4.8340 -0.3906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8555 2.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 0.8966 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3203 0.9477 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1912 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7576 1.9770 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.6912 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1613 2.2349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3692 1.2567 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9045 2.9040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2103 2.5439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6966 3.8822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0024 3.5220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7455 4.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.3088 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6261 0.5876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 1.8477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 0.8966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 1.8477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0634 1.6168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0145 1.3078 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2224 0.3297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.6912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7087 1.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.6912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.6912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7006 1.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 1.6716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 2.3782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4793 3.1363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5906 2.5222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 1.9299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3162 3.9038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7828 4.4961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6738 4.0478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4275 3.2898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0366 4.7386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2569 4.5729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4184 0.0274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9725 1.9766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3012 2.4643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4906 1.1488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 0.3597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4308 2.4643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7596 1.9766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4492 0.3413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6042 1.1162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.8812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6160 0.2008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3513 -0.2768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8289 0.4586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6287 2.5834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5171 1.0783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2984 1.4764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9003 2.2576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.3812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -4.0012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.8112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -0.8812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.3112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.0712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.5012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.8812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 2 0 0 0 0 2 21 2 0 0 0 0 3 22 2 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 10 5 1 6 0 0 0 5 22 1 0 0 0 0 5 56 1 0 0 0 0 6 21 1 0 0 0 0 6 25 1 0 0 0 0 6 58 1 0 0 0 0 23 7 1 1 0 0 0 7 27 1 0 0 0 0 7 62 1 0 0 0 0 8 26 1 0 0 0 0 8 31 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 37 1 0 0 0 0 10 17 1 0 0 0 0 10 38 1 0 0 0 0 11 13 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 14 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 15 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 19 1 0 0 0 0 16 21 1 6 0 0 0 16 49 1 0 0 0 0 18 20 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 57 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 29 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 28 30 2 0 0 0 0 28 66 1 0 0 0 0 29 32 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 67 1 0 0 0 0 31 68 1 0 0 0 0 32 34 1 0 0 0 0 32 69 1 0 0 0 0 33 35 2 0 0 0 0 33 70 1 0 0 0 0 34 36 2 0 0 0 0 34 71 1 0 0 0 0 35 36 1 0 0 0 0 35 72 1 0 0 0 0 36 73 1 0 0 0 0 M END > 70666223 > 1 > 750 > 5 > 3 > 8 > AAADcfB7sAAAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAAABwAAAHgAQAAAADSjBngQ+wJPIEACoAzV3VACCgCAxEiAI2KG4dJgIYPLAkbGUIAhglgDIyAcYicCOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > (2S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-N-(2-phenyl-3-pyridyl)pyrrolidine-2-carboxamide > (2S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)-1-oxopropyl]amino]-1-oxoethyl]-N-(2-phenyl-3-pyridinyl)-2-pyrrolidinecarboxamide > (2S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-N-(2-phenylpyridin-3-yl)pyrrolidine-2-carboxamide > (2S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-N-(2-phenylpyridin-3-yl)pyrrolidine-2-carboxamide > (2S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]ethanoyl]-N-(2-phenylpyridin-3-yl)pyrrolidine-2-carboxamide > (2S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-N-(2-phenyl-3-pyridyl)pyrrolidine-2-carboxamide > InChI=1S/C28H37N5O3/c1-19(29-2)26(34)32-25(21-13-7-4-8-14-21)28(36)33-18-10-16-23(33)27(35)31-22-15-9-17-30-24(22)20-11-5-3-6-12-20/h3,5-6,9,11-12,15,17,19,21,23,25,29H,4,7-8,10,13-14,16,18H2,1-2H3,(H,31,35)(H,32,34)/t19-,23-,25-/m0/s1 > GLCIMVXICQBGLJ-QXWFJRNPSA-N > 3.5 > 491.28964006 > C28H37N5O3 > 491.6 > CC(C(=O)NC(C1CCCCC1)C(=O)N2CCCC2C(=O)NC3=C(N=CC=C3)C4=CC=CC=C4)NC > C[C@@H](C(=O)N[C@@H](C1CCCCC1)C(=O)N2CCC[C@H]2C(=O)NC3=C(N=CC=C3)C4=CC=CC=C4)NC > 103 > 491.28964006 > 0 > 36 > 3 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 16 21 6 25 26 8 25 28 8 28 30 8 29 32 8 29 33 8 30 31 8 32 34 8 33 35 8 34 36 8 35 36 8 10 5 6 23 7 5 8 26 8 8 31 8 $$$$