UCSF

ZINC01582891

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 10 No

Popular Name: 4-(Hydroxymethyl)benzene-1,2-diol 4-(Hydroxymethyl)benzene-1,2-diol

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CAS Numbers: 3897-89-0 , [3897-89-0]

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) 0.31 -3.12 -8.57 3 3 0 60 140.138 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 117 TCI
Purity 95% Fluorochem

Activity (Go SEA)

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