UCSF

ZINC02575921

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 17 No

Popular Name: Ethyl (4-isopropylbenzoyl)acetate Ethyl (4-isopropylbenzoyl)acetate

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CAS Number: 54957-66-3

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) 3.17 3.78 -12.58 0 3 0 43 234.295 6 ↓

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