UCSF

ZINC39318786

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2010 12 Yes

Popular Name: [(1R)-1-methoxybutyl]benzene [(1R)-1-methoxybutyl]benzene

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 3.32 6.43 -2.79 0 1 0 9 164.248 4 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0268878A2; EP0268878B1; EP0523697B1; US5023366; US5376615 IBM Patent Data
PUBCHEM_PATENT_ID US5519016; US5688791 IBM Patent Data
PUBCHEM_PATENT_ID US5563159 IBM Patent Data

Activity (Go SEA)

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