General Information of the Compound
| Compound ID |
CP0864719
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| Compound Name |
2-[({4-[(2-Aminobenzyl)oxy]phenyl}acetyl)amino]-5-(4-chlorophenyl)indan-2-carboxylic acid
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| Structure |
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| Formula |
C31H27ClN2O4
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| Molecular Weight |
527.02
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| Canonical SMILES |
Nc1ccccc1COc1ccc(CC(=O)NC2(C(=O)O)Cc3ccc(-c4ccc(Cl)cc4)cc3C2)cc1
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| InChI |
InChI=1S/C31H27ClN2O4/c32-26-11-9-21(10-12-26)22-7-8-23-17-31(30(36)37,18-25(23)16-22)34-29(35)15-20-5-13-27(14-6-20)38-19-24-3-1-2-4-28(24)33/h1-14,16H,15,17-19,33H2,(H,34,35)(H,36,37)
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| InChIKey |
PVHNREZPJQCDEL-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