UCSF

ZINC00127966

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Substance Information

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

Popular Name: 2-(4-Fluoro-phenyl)-quinoline-4-carboxylic acid 2-(4-Fluoro-phenyl)-quinoline-4-…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 441-28-1 , [441-28-1]

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) 3.80 1.12 -48.82 0 3 -1 53 266.251 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 193 - 197 Enamine Building Blocks
MP 194 - 196 Enamine Building Blocks
MP 194...196 Enamine Building Blocks
MP 214 - 216 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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