UCSF

ZINC57354215

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 19th, 2011 10 Yes

Popular Name: [(4R)-1-methylazepan-4-yl]methanol [(4R)-1-methylazepan-4-yl]methanol

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) 0.75 2.5 -34.39 2 2 1 25 144.238 1 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID WO2000007980A1 IBM Patent Data

Activity (Go SEA)

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