General Information of the Compound
| Compound ID |
CP0153974
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| Compound Name |
N-benzyl-5-hydroxy-6-oxo-2-pyrazin-2-yl-1H-pyrimidine-4-carboxamide
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| Structure |
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| Formula |
C16H13N5O3
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| Molecular Weight |
323.312
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| Canonical SMILES |
Oc1c(nc([nH]c1=O)-c1cnccn1)C(=O)NCc1ccccc1
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| InChI |
InChI=1S/C16H13N5O3/c22-13-12(15(23)19-8-10-4-2-1-3-5-10)20-14(21-16(13)24)11-9-17-6-7-18-11/h1-7,9,22H,8H2,(H,19,23)(H,20,21,24)
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| InChIKey |
UELFGZXFHREMPM-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