General Information of the Compound
Compound ID |
CP0460627
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Compound Name |
2-(ethylamino)-6-(3-phenylpropanoyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-4-carboxamide
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Structure |
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Formula |
C19H23N5O2
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Molecular Weight |
353.426
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Canonical SMILES |
CCNc1nc2CCN(Cc2c(n1)C(N)=O)C(=O)CCc1ccccc1
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InChI |
InChI=1S/C19H23N5O2/c1-2-21-19-22-15-10-11-24(12-14(15)17(23-19)18(20)26)16(25)9-8-13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3,(H2,20,26)(H,21,22,23)
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InChIKey |
VNYPQVUCHQJJKY-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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