General Information of the Compound
| Compound ID |
CP0438257
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| Compound Name |
propyl 3-imidazol-1-yl-2-[(4-phenylbenzoyl)amino]propanoate
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| Structure |
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| Formula |
C22H23N3O3
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| Molecular Weight |
377.444
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| Canonical SMILES |
CCCOC(=O)C(Cn1ccnc1)NC(=O)c1ccc(cc1)-c1ccccc1
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| InChI |
InChI=1S/C22H23N3O3/c1-2-14-28-22(27)20(15-25-13-12-23-16-25)24-21(26)19-10-8-18(9-11-19)17-6-4-3-5-7-17/h3-13,16,20H,2,14-15H2,1H3,(H,24,26)
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| InChIKey |
KRTKBGVAKDCIEF-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