UCSF

ZINC01884636

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2005 26 No

Popular Name: 3-Pyridinol, 5,5'-(dithiodimethylene)bis(4-methoxymethyl-2-methyl-, dihydrochloride; Bis(2-methyl-3-hydroxy-4-methoxymethyl-5-methylpyridyl)disulfide dihydrochloride; LS-133006 3-Pyridinol, 5,5'-(dithiodimethy…

Find On: PubMed — Wikipedia — Google

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) 2.12 -4.05 -12.48 2 6 0 84 396.534 9 ↓
Lo Low (pH 4.5-6) 2.12 -3.92 -81.83 4 6 2 87 398.55 9 ↓
Lo Low (pH 4.5-6) 2.12 -3.98 -39.15 3 6 1 85 397.542 9 ↓

Activity (Go SEA)

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