General Information of the Compound
| Compound ID |
CP0853139
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| Compound Name |
5-(4-Chlorophenyl)-2-({[4-(2,3-dihydro-1H-inden-2-yloxy)phenyl]acetyl}amino)indan-2-carboxylic acid
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| Structure |
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| Formula |
C33H28ClNO4
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| Molecular Weight |
538.043
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| Canonical SMILES |
O=C(Cc1ccc(OC2Cc3ccccc3C2)cc1)NC1(C(=O)O)Cc2ccc(-c3ccc(Cl)cc3)cc2C1
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| InChI |
InChI=1S/C33H28ClNO4/c34-28-11-9-22(10-12-28)25-7-8-26-19-33(32(37)38,20-27(26)16-25)35-31(36)15-21-5-13-29(14-6-21)39-30-17-23-3-1-2-4-24(23)18-30/h1-14,16,30H,15,17-20H2,(H,35,36)(H,37,38)
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| InChIKey |
IZBSGCMWLHCMTH-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