UCSF

ZINC00410084

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 13 Yes

Popular Name: Hydratropyl acetate Hydratropyl acetate

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CAS Numbers: 10402-52-5 , [10402-52-5]

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) 2.99 2.83 -6.09 0 2 0 26 178.231 4 ↓

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