UCSF

ZINC52886793

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2010 14 Yes

Popular Name: (S)-phenyl(pyrimidin-5-yl)methanol (S)-phenyl(pyrimidin-5-yl)methanol

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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) 0.75 3.93 -6.89 1 3 0 46 186.214 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0891355A1; US5854264; WO1997036896A1 IBM Patent Data

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Rings

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

No pre-computed analogs available. Try a structural similarity search.