General Information of the Compound
| Compound ID |
CP0492702
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| Compound Name |
methyl 4-[[2-(naphthalene-2-carbonylamino)benzoyl]amino]butanoate
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| Structure |
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| Formula |
C23H22N2O4
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| Molecular Weight |
390.439
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| Canonical SMILES |
COC(=O)CCCNC(=O)c1ccccc1NC(=O)c1ccc2ccccc2c1
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| InChI |
InChI=1S/C23H22N2O4/c1-29-21(26)11-6-14-24-23(28)19-9-4-5-10-20(19)25-22(27)18-13-12-16-7-2-3-8-17(16)15-18/h2-5,7-10,12-13,15H,6,11,14H2,1H3,(H,24,28)(H,25,27)
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| InChIKey |
JBDADJPLDVWONF-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