General Information of the Compound
| Compound ID |
CP0949901
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| Compound Name |
2-(Aminomethyl)-7-(quinolin-2-ylmethoxy)-4H-chromen-4-one hydrochloride
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| Structure |
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| Formula |
C20H17ClN2O3
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| Molecular Weight |
368.82
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| Canonical SMILES |
Cl.NCc1cc(=O)c2ccc(OCc3ccc4ccccc4n3)cc2o1
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| InChI |
InChI=1S/C20H16N2O3.ClH/c21-11-16-9-19(23)17-8-7-15(10-20(17)25-16)24-12-14-6-5-13-3-1-2-4-18(13)22-14;/h1-10H,11-12,21H2;1H
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| InChIKey |
QGOCJLCOCIWULA-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