General Information of the Compound
| Compound ID |
CP0921427
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| Compound Name |
4'-[(6-N-n-propylaminocarboxyl-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 |
C30H32N8O2
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| Molecular Weight |
536.64
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| Canonical SMILES |
CCCNC(=O)c1cc(C)c2nc(CCC)n(Cc3ccc(-c4ccccc4C(=O)Nc4nnn[nH]4)cc3)c2c1
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| InChI |
InChI=1S/C30H32N8O2/c1-4-8-26-32-27-19(3)16-22(28(39)31-15-5-2)17-25(27)38(26)18-20-11-13-21(14-12-20)23-9-6-7-10-24(23)29(40)33-30-34-36-37-35-30/h6-7,9-14,16-17H,4-5,8,15,18H2,1-3H3,(H,31,39)(H2,33,34,35,36,37,40)
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| InChIKey |
UNLUQZXLCPIKOX-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