UCSF

ZINC00396586

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 12 Yes

Popular Name: 4-Ethylphenyl Acetate 4-Ethylphenyl Acetate

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CAS Number: 3245-23-6

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) 2.40 3.23 -7.06 0 2 0 26 164.204 3 ↓

Vendor Notes

Note Type Comments Provided By
BP 226 TCI

Activity (Go SEA)

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