General Information of the Compound
| Compound ID |
CP0731735
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| Compound Name |
4'-[[6-(N-2-methoxyphenyl)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 |
C34H32N8O3
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| Molecular Weight |
600.683
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| Canonical SMILES |
CCCc1nc2c(C)cc(C(=O)Nc3ccccc3OC)cc2n1Cc1ccc(-c2ccccc2C(=O)Nc2nnn[nH]2)cc1
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| InChI |
InChI=1S/C34H32N8O3/c1-4-9-30-36-31-21(2)18-24(32(43)35-27-12-7-8-13-29(27)45-3)19-28(31)42(30)20-22-14-16-23(17-15-22)25-10-5-6-11-26(25)33(44)37-34-38-40-41-39-34/h5-8,10-19H,4,9,20H2,1-3H3,(H,35,43)(H2,37,38,39,40,41,44)
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| InChIKey |
FWTFRDCXSJWXPR-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