General Information of the Compound
| Compound ID |
CP0428112
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| Compound Name |
6-(3-chlorothiophen-2-yl)chromen-2-one
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| Structure |
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| Formula |
C13H7ClO2S
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| Molecular Weight |
262.717
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| Canonical SMILES |
Clc1ccsc1-c1ccc2oc(=O)ccc2c1
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| InChI |
InChI=1S/C13H7ClO2S/c14-10-5-6-17-13(10)9-1-3-11-8(7-9)2-4-12(15)16-11/h1-7H
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| InChIKey |
SUGHXFMEDPEVSG-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