UCSF

ZINC02037410

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 20 Yes

Popular Name: 6-Methyl-2-pyridin-3-ylquinoline-4-carboxylic acid 6-Methyl-2-pyridin-3-ylquinoline…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 5110-02-1 , [5110-02-1]

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) 2.99 -0.12 -53.31 0 4 -1 65 263.276 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 311° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific
PUBCHEM_PATENT_ID WO2000001692A1 IBM Patent Data

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Analogs ( Draw Identity 99% 90% 80% 70% )