UCSF

ZINC05863671

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2006 10 Yes

Popular Name: 1-Ethoxy-2-methylbenzene 1-Ethoxy-2-methylbenzene

Find On: PubMed — Wikipedia — Google

CAS Number: 614-71-1

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) 2.77 1.64 -3.3 0 1 0 9 136.194 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 98% Fluorochem
PUBCHEM_PATENT_ID WO1998007695A1 IBM Patent Data

Activity (Go SEA)

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