UCSF

ZINC01591828

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 14 Yes

Popular Name: Phenethyl butyrate Phenethyl butyrate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 103-52-6 , [103-52-6]

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) 3.11 2.67 -5.7 0 2 0 26 192.258 6 ↓

Activity (Go SEA)

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