51625947 -OEChem-05132415232D 68 72 0 1 0 0 0 0 0999 V2000 8.1058 5.2881 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -3.7881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -4.7881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 0.7119 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.2881 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0173 0.7064 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8264 -0.6949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9955 0.9143 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4955 0.0483 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 1.2119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 2.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 0.8051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 2.4143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.2119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 0.7119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.7881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.7881 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0468 -1.7881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -2.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -2.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2742 1.3755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -3.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -3.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -3.7881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4821 2.3537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 3.0228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4332 2.6627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -4.7881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9469 4.0010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6411 3.6408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -5.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8979 4.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1026 1.5496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0982 2.2064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 2.8230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1675 0.4407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9791 0.2682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6916 3.0040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9336 2.6665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 1.9127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5851 1.0875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7133 1.6868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9162 1.6868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8381 -0.1805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2366 -0.8707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7913 0.6042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3928 1.2945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9162 -1.2631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7133 -1.2631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.1681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6438 -1.9781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4497 -1.9781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6993 1.6078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9456 0.8497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4497 -3.5981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1493 2.8312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8939 2.2478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6947 -4.7881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -5.4081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9347 -4.7881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4861 4.4158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2307 3.8324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6028 -5.8251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4497 -5.5981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2228 -4.7512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 35 1 0 0 0 0 2 25 1 0 0 0 0 2 31 1 0 0 0 0 3 27 1 0 0 0 0 3 34 1 0 0 0 0 4 10 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 19 5 1 6 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 6 24 1 0 0 0 0 7 9 1 0 0 0 0 7 21 2 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 36 1 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 14 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 17 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 18 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 53 1 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 22 25 1 0 0 0 0 22 54 1 0 0 0 0 23 26 2 0 0 0 0 23 55 1 0 0 0 0 24 28 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 27 2 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 29 32 1 0 0 0 0 29 59 1 0 0 0 0 30 33 2 0 0 0 0 30 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 35 2 0 0 0 0 32 64 1 0 0 0 0 33 35 1 0 0 0 0 33 65 1 0 0 0 0 34 66 1 0 0 0 0 34 67 1 0 0 0 0 34 68 1 0 0 0 0 M END > 51625947 > 1 > 639 > 8 > 0 > 8 > AAADcfB7sQAAAAAAAAAAAAAAAAAAAeIAAAA8YIAAAAAAAAAB0AAAHwAIAAAADCzBmw4zFocIBACiAiJiJACCCAMgoIAdyAA+jIiNZiKEuRuUMCpkwBOKqAew0LMOIAABAAAAQABAAAIAAACAAAAAAAAAAA== > 1-cyclopentyl-4-[(S)-(3,4-dimethoxyphenyl)-[1-[(4-fluorophenyl)methyl]tetrazol-5-yl]methyl]piperazine > 1-cyclopentyl-4-[(S)-(3,4-dimethoxyphenyl)-[1-[(4-fluorophenyl)methyl]-5-tetrazolyl]methyl]piperazine > 1-cyclopentyl-4-[(S)-(3,4-dimethoxyphenyl)-[1-[(4-fluorophenyl)methyl]tetrazol-5-yl]methyl]piperazine > 1-cyclopentyl-4-[(S)-(3,4-dimethoxyphenyl)-[1-[(4-fluorophenyl)methyl]tetrazol-5-yl]methyl]piperazine > 1-cyclopentyl-4-[(S)-(3,4-dimethoxyphenyl)-[1-[(4-fluorophenyl)methyl]-1,2,3,4-tetrazol-5-yl]methyl]piperazine > 1-cyclopentyl-4-[(S)-(3,4-dimethoxyphenyl)-[1-(4-fluorobenzyl)tetrazol-5-yl]methyl]piperazine > InChI=1S/C26H33FN6O2/c1-34-23-12-9-20(17-24(23)35-2)25(32-15-13-31(14-16-32)22-5-3-4-6-22)26-28-29-30-33(26)18-19-7-10-21(27)11-8-19/h7-12,17,22,25H,3-6,13-16,18H2,1-2H3/t25-/m0/s1 > CARNRNMYCTYGAG-VWLOTQADSA-N > 3.8 > 480.26490248 > C26H33FN6O2 > 480.6 > COC1=C(C=C(C=C1)C(C2=NN=NN2CC3=CC=C(C=C3)F)N4CCN(CC4)C5CCCC5)OC > COC1=C(C=C(C=C1)[C@@H](C2=NN=NN2CC3=CC=C(C=C3)F)N4CCN(CC4)C5CCCC5)OC > 68.5 > 480.26490248 > 0 > 35 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 20 22 8 20 23 8 22 25 8 23 26 8 25 27 8 26 27 8 28 29 8 28 30 8 29 32 8 30 33 8 32 35 8 33 35 8 19 5 6 6 21 8 6 8 8 7 21 8 7 9 8 8 9 8 $$$$