UCSF

ZINC34624144

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 30 Yes

Popular Name: (2-fluoro-4-pentyl-phenyl) (2-fluoro-4-pentyl-phenyl)

Find On: PubMed — Wikipedia — Google

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) 8.55 18.09 -7.04 0 2 0 26 416.621 10 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US5344587; US5387369; US5876626; US5958290 IBM Patent Data

Activity (Go SEA)

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