General Information of the Compound
| Compound ID |
CP0533949
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| Compound Name |
7-hydroxy-2-[(2-methylphenyl)methyl]-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one
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| Structure |
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| Formula |
C16H18N2O2
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| Molecular Weight |
270.332
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| Canonical SMILES |
Cc1ccccc1CN1CCn2cc(O)c(=O)cc2C1
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| InChI |
InChI=1S/C16H18N2O2/c1-12-4-2-3-5-13(12)9-17-6-7-18-11-16(20)15(19)8-14(18)10-17/h2-5,8,11,20H,6-7,9-10H2,1H3
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| InChIKey |
PKFAQFAAQDMRBB-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