UCSF

ZINC01433361

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2004 13 Yes

Popular Name: Methyl 3-(3-hydroxyphenyl)propionate Methyl 3-(3-hydroxyphenyl)propio…

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CAS Numbers: 61389-68-2 , [61389-68-2]

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) 1.69 3.89 -6.84 1 3 0 47 180.203 4 ↓

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