UCSF

ZINC39271649

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 12 Yes

Popular Name: (2S,3S)-3-phenylbutane-1,2-diol (2S,3S)-3-phenylbutane-1,2-diol

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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) 1.64 0.63 -6.61 2 2 0 40 166.22 3 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0839179A1; US5747443; WO1997034972A1 IBM Patent Data

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