General Information of the Compound
| Compound ID |
CP0903281
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| Compound Name |
5-(4-Chlorophenyl)-2-{[(4-fluorobenzyl)sulfonyl]amino}indan-2-carboxylic acid
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| Structure |
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| Formula |
C23H19ClFNO4S
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| Molecular Weight |
459.926
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| Canonical SMILES |
O=C(O)C1(NS(=O)(=O)Cc2ccc(F)cc2)Cc2ccc(-c3ccc(Cl)cc3)cc2C1
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| InChI |
InChI=1S/C23H19ClFNO4S/c24-20-7-5-16(6-8-20)17-3-4-18-12-23(22(27)28,13-19(18)11-17)26-31(29,30)14-15-1-9-21(25)10-2-15/h1-11,26H,12-14H2,(H,27,28)
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| InChIKey |
JOYFIWFOTDHWJM-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