General Information of the Compound
| Compound ID |
CP0398459
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| Compound Name |
2-(2-((3-(4-hydroxybenzyl)-5-aminobenzamido)methyl)phenyl)acetic acid
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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 |
Nc1cc(Cc2ccc(O)cc2)cc(c1)C(=O)NCc1ccccc1CC(O)=O
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| InChI |
InChI=1S/C23H22N2O4/c24-20-11-16(9-15-5-7-21(26)8-6-15)10-19(12-20)23(29)25-14-18-4-2-1-3-17(18)13-22(27)28/h1-8,10-12,26H,9,13-14,24H2,(H,25,29)(H,27,28)
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| InChIKey |
RQSCVKBJVYRXTG-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
Protein ID: PT01820, Aminopeptidase N
Protein ID: PT05116, Leucyl-cystinyl aminopeptidase