General Information of the Compound
| Compound ID |
CP0437961
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| Compound Name |
2-[(2,5-dimethylphenyl)methyl]-7-hydroxy-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one
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| Structure |
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| Formula |
C17H20N2O2
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| Molecular Weight |
284.359
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| Canonical SMILES |
Cc1ccc(C)c(CN2CCn3cc(O)c(=O)cc3C2)c1
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| InChI |
InChI=1S/C17H20N2O2/c1-12-3-4-13(2)14(7-12)9-18-5-6-19-11-17(21)16(20)8-15(19)10-18/h3-4,7-8,11,21H,5-6,9-10H2,1-2H3
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| InChIKey |
OFEMDIHBDPKVHF-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