General Information of the Compound
| Compound ID |
CP0680626
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| Compound Name |
4'-[[6-(N-3,4-dimethoxyphenethyl)aminocarboxyl-4-methyl-2-n-propyl-1H-benzoimidazolyl]methyl]-[1,1'-biphenyl]-2-N-(1H-tetrazol-5-yl)amide
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| Structure |
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| Formula |
C37H38N8O4
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| Molecular Weight |
658.763
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| Canonical SMILES |
CCCc1nc2c(C)cc(C(=O)NCCc3ccc(OC)c(OC)c3)cc2n1Cc1ccc(-c2ccccc2C(=O)Nc2nnn[nH]2)cc1
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| InChI |
InChI=1S/C37H38N8O4/c1-5-8-33-39-34-23(2)19-27(35(46)38-18-17-24-13-16-31(48-3)32(20-24)49-4)21-30(34)45(33)22-25-11-14-26(15-12-25)28-9-6-7-10-29(28)36(47)40-37-41-43-44-42-37/h6-7,9-16,19-21H,5,8,17-18,22H2,1-4H3,(H,38,46)(H2,40,41,42,43,44,47)
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| InChIKey |
LBCVYJXWEBCACR-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound