General Information of the Compound
| Compound ID |
CP0527716
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| Compound Name |
N-(3-chlorophenyl)-4-oxothiochromene-3-carboxamide
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| Formula |
C16H10ClNO2S
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| Molecular Weight |
315.781
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| Canonical SMILES |
Clc1cccc(NC(=O)c2csc3ccccc3c2=O)c1
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| InChI |
InChI=1S/C16H10ClNO2S/c17-10-4-3-5-11(8-10)18-16(20)13-9-21-14-7-2-1-6-12(14)15(13)19/h1-9H,(H,18,20)
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| InChIKey |
AEFUKUPDUDNBGX-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