General Information of the Compound
| Compound ID |
CP0873876
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| Compound Name |
5-(2-Chlorophenyl)-2-[({4-[(4-fluorobenzyl)oxy]phenyl}acetyl)amino]indan-2-carboxylic acid
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| Structure |
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| Formula |
C31H25ClFNO4
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| Molecular Weight |
529.995
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| Canonical SMILES |
O=C(Cc1ccc(OCc2ccc(F)cc2)cc1)NC1(C(=O)O)Cc2ccc(-c3ccccc3Cl)cc2C1
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| InChI |
InChI=1S/C31H25ClFNO4/c32-28-4-2-1-3-27(28)22-9-10-23-17-31(30(36)37,18-24(23)16-22)34-29(35)15-20-7-13-26(14-8-20)38-19-21-5-11-25(33)12-6-21/h1-14,16H,15,17-19H2,(H,34,35)(H,36,37)
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| InChIKey |
HSWVRFKIKHFHLW-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