General Information of the Compound
| Compound ID |
CP0874607
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| Compound Name |
2-(Aminomethyl)-N-(2-(methylsulfonyl)ethyl)-4-oxo-4H-chromene-6-carboxamide hydrochloride
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| Structure |
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| Formula |
C14H17ClN2O5S
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| Molecular Weight |
360.819
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| Canonical SMILES |
CS(=O)(=O)CCNC(=O)c1ccc2oc(CN)cc(=O)c2c1.Cl
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| InChI |
InChI=1S/C14H16N2O5S.ClH/c1-22(19,20)5-4-16-14(18)9-2-3-13-11(6-9)12(17)7-10(8-15)21-13;/h2-3,6-7H,4-5,8,15H2,1H3,(H,16,18);1H
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| InChIKey |
YAWIRTLIJWSONH-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