General Information of the Compound
| Compound ID |
CP0946060
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| Compound Name |
2-(aminomethyl)-6-(quinolin-3-yl)-4H-chromen-4-one hydrochloride
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| Structure |
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| Formula |
C19H15ClN2O2
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| Molecular Weight |
338.794
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| Canonical SMILES |
Cl.NCc1cc(=O)c2cc(-c3cnc4ccccc4c3)ccc2o1
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| InChI |
InChI=1S/C19H14N2O2.ClH/c20-10-15-9-18(22)16-8-12(5-6-19(16)23-15)14-7-13-3-1-2-4-17(13)21-11-14;/h1-9,11H,10,20H2;1H
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| InChIKey |
OIYNCUCUVOFHJE-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