68234908 -OEChem-05082314203D 67 71 0 0 0 0 0 0 0999 V2000 2.6955 3.7600 0.9291 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -8.7694 1.9342 1.2759 F 0 0 0 0 0 0 0 0 0 0 0 0 -10.7472 2.1287 0.3670 F 0 0 0 0 0 0 0 0 0 0 0 0 -9.0720 3.2553 -0.4700 F 0 0 0 0 0 0 0 0 0 0 0 0 -9.1643 0.9895 -0.7693 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4542 -1.7716 -1.1239 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3381 -1.8565 0.2072 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9471 -1.3257 1.0949 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8032 1.4806 0.0008 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9692 1.7283 -0.4989 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1714 -1.6597 -0.3505 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1198 -1.0648 -1.2987 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6305 -1.6487 1.0874 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7861 -1.8052 -1.1888 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2979 -2.3914 1.1829 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5079 -0.9508 -0.4631 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0239 -2.0218 0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6061 0.4052 -0.1512 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6385 -1.6547 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8356 -2.7338 -0.3961 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -1.4741 1.6483 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8347 1.0574 -0.2544 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8671 -1.0026 -0.9813 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1925 -2.8980 -0.1178 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9258 -1.6384 1.9265 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7376 -2.3505 1.0435 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9652 0.3535 -0.6695 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1885 -2.5261 1.3404 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2974 0.2206 -0.2191 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5248 -1.0456 -0.1358 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6262 0.4002 -0.5236 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8613 2.3667 -0.1816 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6387 -0.6181 -0.8486 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 1.8790 0.3422 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4214 2.0840 0.1033 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5836 3.7534 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9499 -0.6971 -2.3485 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2615 3.1884 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3390 4.1501 0.3273 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3166 -2.7107 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9508 -0.0047 -1.0694 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4752 -1.1083 -2.3356 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3548 -2.1126 1.7683 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4843 -0.6188 1.4374 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0573 -1.2750 -1.8146 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8954 -2.8227 -1.5843 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4488 -3.4613 0.9912 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9319 -2.3000 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7376 0.9753 0.1664 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5786 -2.7113 -1.1244 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4421 -3.1866 -1.3017 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0437 -0.9031 2.3412 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8593 2.1215 -0.0392 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7444 -1.5560 -1.3047 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8128 -3.4565 -0.8138 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3402 -1.2037 2.8323 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3257 -2.7924 2.3949 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6141 -3.3475 0.7518 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0599 -0.6669 1.8602 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5656 -0.3880 -0.3094 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3191 -1.6071 -0.5003 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7539 1.1145 0.4554 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3807 4.4765 -0.1357 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0526 -0.9555 -2.9207 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7103 -1.4612 -2.5371 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3253 0.2612 -2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1249 5.2053 0.4639 H 0 0 0 0 0 0 0 0 0 0 0 0 1 38 1 0 0 0 0 2 35 1 0 0 0 0 3 35 1 0 0 0 0 4 35 1 0 0 0 0 5 27 1 0 0 0 0 5 35 1 0 0 0 0 6 30 2 0 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 7 17 1 0 0 0 0 8 28 1 0 0 0 0 8 30 1 0 0 0 0 8 59 1 0 0 0 0 9 29 1 0 0 0 0 9 32 1 0 0 0 0 9 34 1 0 0 0 0 10 31 1 0 0 0 0 10 32 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 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 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 18 2 0 0 0 0 16 19 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 18 22 1 0 0 0 0 18 49 1 0 0 0 0 19 23 2 0 0 0 0 19 50 1 0 0 0 0 20 24 1 0 0 0 0 20 51 1 0 0 0 0 21 25 2 0 0 0 0 21 52 1 0 0 0 0 22 27 2 0 0 0 0 22 53 1 0 0 0 0 23 27 1 0 0 0 0 23 54 1 0 0 0 0 24 26 2 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 26 28 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 31 33 1 0 0 0 0 32 36 1 0 0 0 0 33 37 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 34 38 2 0 0 0 0 34 62 1 0 0 0 0 36 39 2 0 0 0 0 36 63 1 0 0 0 0 37 64 1 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 38 39 1 0 0 0 0 39 67 1 0 0 0 0 M END > DB17754 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/OJICYBSWSZGRFB-UHFFFAOYSA-N/SDF?record_type=3d > CCC1=C(N2C=C(Cl)C=CC2=N1)C(=O)NCC1=CC=C(C=C1)N1CCC(CC1)C1=CC=C(OC(F)(F)F)C=C1 > InChI=1S/C29H28ClF3N4O2/c1-2-25-27(37-18-22(30)7-12-26(37)35-25)28(38)34-17-19-3-8-23(9-4-19)36-15-13-21(14-16-36)20-5-10-24(11-6-20)39-29(31,32)33/h3-12,18,21H,2,13-17H2,1H3,(H,34,38) > OJICYBSWSZGRFB-UHFFFAOYSA-N > C29H28ClF3N4O2 > 557.01 > 556.1852883 > 4 > 67 > 2.0728607958321787 > 55.955339370667446 > 0 > 1 > 0 > 0 > 6-chloro-2-ethyl-N-[(4-{4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl}phenyl)methyl]imidazo[1,2-a]pyridine-3-carboxamide > 6.724635363333334 > 1 > 0 > 5 > 0 > 58.870000000000005 > 142.70929999999996 > 8 > 0 > 6-chloro-2-ethyl-N-[(4-{4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl}phenyl)methyl]imidazo[1,2-a]pyridine-3-carboxamide > 0 $$$$