UCSF

ZINC06382813

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 25th, 2006 11 Yes

Popular Name: 5-Hydroxy-4-oxo-1,4-dihydropyridine-2-carboxylic acid 5-Hydroxy-4-oxo-1,4-dihydropyrid…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 43077-77-6 , 54912-33-3 , [43077-77-6]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.76 -1.68 -45.94 2 5 -1 93 154.101 1 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0321844A2; US4743685; US4889930; US4980465; US5106977; US5185330; US5300497 IBM Patent Data

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