70573774 -OEChem-05092423022D 86 90 0 0 0 0 0 0 0999 V2000 9.4290 10.4703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7862 8.7755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6856 2.1200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 6.7760 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 5.7760 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1434 7.0807 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1434 5.4712 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 7.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 5.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 6.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 5.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 7.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 5.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 6.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 8.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 5.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 7.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 8.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 5.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 8.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3312 5.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 6.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1972 5.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1972 6.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3312 7.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 6.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 9.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 5.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 9.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4541 8.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 5.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 10.2759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7270 6.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4326 8.2374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7432 9.1879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0754 9.9322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7217 9.3942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3861 10.8828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0324 10.3447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3646 11.0890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0969 9.7260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8195 1.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9535 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8195 0.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2656 7.7509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4685 7.7509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3905 5.8836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 5.1933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3437 6.6683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9451 7.3586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4685 4.8010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2656 4.8010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 7.5860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2006 4.8010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9976 4.8010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 7.8960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 8.4660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8059 5.4660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 8.4660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3312 4.6560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9282 7.0860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3312 7.8960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 7.0860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 10.0859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 4.6560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 10.0859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4335 8.6509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8403 8.1186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 5.4660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 10.8959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3470 6.2760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4531 7.6178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0464 8.1501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1358 8.9327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9720 11.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6391 10.4725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5572 11.6783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6217 11.0596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8195 2.2400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2635 2.6569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4166 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6435 1.5831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1995 0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8195 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4395 0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2225 1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 41 1 0 0 0 0 1 78 1 0 0 0 0 2 41 2 0 0 0 0 3 42 1 0 0 0 0 3 86 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 6 24 1 0 0 0 0 6 30 1 0 0 0 0 6 33 1 0 0 0 0 7 23 1 0 0 0 0 7 33 2 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 11 1 0 0 0 0 9 47 1 0 0 0 0 9 48 1 0 0 0 0 10 49 1 0 0 0 0 10 50 1 0 0 0 0 11 51 1 0 0 0 0 11 52 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 53 1 0 0 0 0 13 16 1 0 0 0 0 13 54 1 0 0 0 0 13 55 1 0 0 0 0 14 17 2 0 0 0 0 14 19 1 0 0 0 0 15 18 2 0 0 0 0 15 20 1 0 0 0 0 16 21 2 0 0 0 0 16 22 1 0 0 0 0 17 26 1 0 0 0 0 17 56 1 0 0 0 0 18 27 1 0 0 0 0 18 57 1 0 0 0 0 19 28 2 0 0 0 0 19 58 1 0 0 0 0 20 29 2 0 0 0 0 20 59 1 0 0 0 0 21 23 1 0 0 0 0 21 60 1 0 0 0 0 22 25 2 0 0 0 0 22 61 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 62 1 0 0 0 0 26 31 2 0 0 0 0 26 63 1 0 0 0 0 27 32 2 0 0 0 0 27 64 1 0 0 0 0 28 31 1 0 0 0 0 28 65 1 0 0 0 0 29 32 1 0 0 0 0 29 66 1 0 0 0 0 30 34 1 0 0 0 0 30 67 1 0 0 0 0 30 68 1 0 0 0 0 31 69 1 0 0 0 0 32 70 1 0 0 0 0 33 71 1 0 0 0 0 34 35 1 0 0 0 0 34 72 1 0 0 0 0 34 73 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 38 2 0 0 0 0 36 41 1 0 0 0 0 37 39 1 0 0 0 0 37 74 1 0 0 0 0 38 40 1 0 0 0 0 38 75 1 0 0 0 0 39 40 2 0 0 0 0 39 76 1 0 0 0 0 40 77 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 79 1 0 0 0 0 43 80 1 0 0 0 0 43 81 1 0 0 0 0 43 82 1 0 0 0 0 44 83 1 0 0 0 0 44 84 1 0 0 0 0 44 85 1 0 0 0 0 M END > 70573774 > 1 > 782 > 6 > 2 > 9 > AAADcfB/sAAAAAAAAAAAAAAAAAAAAWAAAAA8YMGCAAAAAFgB9AAAHgAACAAADDzhngY32LcMEgCoAyTzbACCgC01EqAJ2CE4fNiIfrLAnZGUcQhswAPI2aeY2eKOiAAAQAAQACAQAACAACAAQAAAAAAAAA== > 2-[2-[5-[(4-benzhydrylpiperazin-1-yl)methyl]benzimidazol-1-yl]ethyl]benzoic acid;propan-2-ol > 2-[2-[5-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-1-benzimidazolyl]ethyl]benzoic acid;2-propanol > 2-[2-[5-[(4-benzhydrylpiperazin-1-yl)methyl]benzimidazol-1-yl]ethyl]benzoic acid;propan-2-ol > 2-[2-[5-[(4-benzhydrylpiperazin-1-yl)methyl]benzimidazol-1-yl]ethyl]benzoic acid;propan-2-ol > 2-[2-[5-[[4-(diphenylmethyl)piperazin-1-yl]methyl]benzimidazol-1-yl]ethyl]benzoic acid;propan-2-ol > 2-[2-[5-[(4-benzhydrylpiperazino)methyl]benzimidazol-1-yl]ethyl]benzoic acid;propan-2-ol > InChI=1S/C34H34N4O2.C3H8O/c39-34(40)30-14-8-7-9-27(30)17-18-38-25-35-31-23-26(15-16-32(31)38)24-36-19-21-37(22-20-36)33(28-10-3-1-4-11-28)29-12-5-2-6-13-29;1-3(2)4/h1-16,23,25,33H,17-22,24H2,(H,39,40);3-4H,1-2H3 > HLOYKZZIRKHGJQ-UHFFFAOYSA-N > 590.32569121 > C37H42N4O3 > 590.8 > CC(C)O.C1CN(CCN1CC2=CC3=C(C=C2)N(C=N3)CCC4=CC=CC=C4C(=O)O)C(C5=CC=CC=C5)C6=CC=CC=C6 > CC(C)O.C1CN(CCN1CC2=CC3=C(C=C2)N(C=N3)CCC4=CC=CC=C4C(=O)O)C(C5=CC=CC=C5)C6=CC=CC=C6 > 81.8 > 590.32569121 > 0 > 44 > 0 > 0 > 0 > 0 > 0 > 2 > -1 > 1 5 255 > 14 17 8 14 19 8 15 18 8 15 20 8 16 21 8 16 22 8 17 26 8 18 27 8 19 28 8 20 29 8 21 23 8 22 25 8 23 24 8 24 25 8 26 31 8 27 32 8 28 31 8 29 32 8 35 36 8 35 37 8 36 38 8 37 39 8 38 40 8 39 40 8 6 24 8 6 33 8 7 23 8 7 33 8 $$$$