General Information of the Compound
| Compound ID |
CP0949899
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| Compound Name |
2-((2-(Aminomethyl)-4-oxo-4H-chromen-6-yl)oxy)-N,N-dimethylacetamide hydrochloride
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| Structure |
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| Formula |
C14H17ClN2O4
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| Molecular Weight |
312.753
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| Canonical SMILES |
CN(C)C(=O)COc1ccc2oc(CN)cc(=O)c2c1.Cl
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| InChI |
InChI=1S/C14H16N2O4.ClH/c1-16(2)14(18)8-19-9-3-4-13-11(5-9)12(17)6-10(7-15)20-13;/h3-6H,7-8,15H2,1-2H3;1H
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| InChIKey |
OPNAXFMOPVZVAN-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