
 CHEMBL2058856

 76 81  0  0  0  0  0  0  0  0999 V2000
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   11.0226    4.2369    0.0417 H   0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL2058856

>  <PubChem CID>
70690562

>  <Formula>
C34H33N7O2

>  <Molecular Weight>
571.685000

>  <IUPAC Name>
N-[(3-methoxyphenyl)methyl]-7-methyl-2-propyl-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]benzimidazole-5-carboxamide

>  <XlogP>
6.2

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
6

>  <Canonical SMILES>
CCCC1=NC2=C(C=C(C=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5)C(=O)NCC6=CC(=CC=C6)OC)C

>  <Isomeric SMILES>
CCCC1=NC2=C(C=C(C=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5)C(=O)NCC6=CC(=CC=C6)OC)C

>  <InChI Std. ID>
InChI=1S/C34H33N7O2/c1-4-8-31-36-32-22(2)17-26(34(42)35-20-24-9-7-10-27(18-24)43-3)19-30(32)41(31)21-23-13-15-25(16-14-23)28-11-5-6-12-29(28)33-37-39-40-38-33/h5-7,9-19H,4,8,20-21H2,1-3H3,(H,35,42)(H,37,38,39,40)

>  <InChI Key>
AUFYZCHIDFVDQF-UHFFFAOYSA-N

