General Information of the Compound
| Compound ID |
CP0459727
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| Compound Name |
3-carboxamido coumarin, 9
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| Structure |
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| Formula |
C17H13NO4
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| Molecular Weight |
295.294
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| Canonical SMILES |
COc1cccc(NC(=O)c2cc3ccccc3oc2=O)c1
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| InChI |
InChI=1S/C17H13NO4/c1-21-13-7-4-6-12(10-13)18-16(19)14-9-11-5-2-3-8-15(11)22-17(14)20/h2-10H,1H3,(H,18,19)
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| InChIKey |
OJCPTZMTRMJDRI-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