UCSF

ZINC00398753

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 14 Yes

Popular Name: 1,2-Propanediol, 3-(2-ethylphenoxy)-; 1,2-Propanediol, 3-(o-ethylphenoxy)-; 3-(o-Ethylphenoxy)-1,2-propanediol; BRN 3254153; LS-120437; NSC 72336 1,2-Propanediol, 3-(2-ethylpheno…

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Other Names:

MFCD00033214

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) 1.58 0.95 -8.49 2 3 0 50 196.246 5 ↓

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