UCSF

ZINC21303204

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 3rd, 2008 9 Yes

Popular Name: (5-CHLORO-3-PYRIDINYL)METHANOL (5-CHLORO-3-PYRIDINYL)METHANOL

Find On: PubMed — Wikipedia — Google

CAS Numbers: 22620-34-4 , [22620-34-4]

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) 0.86 0.5 -6.16 1 2 0 33 143.573 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 97% Matrix Scientific
Warnings IRRITANT Matrix Scientific
Warnings Irritant/Store in Freezer Matrix Scientific
PUBCHEM_PATENT_ID US4489073; US4558045; US4788194; US5859024; US5922732; US5968947; WO1997043286A1 IBM Patent Data

Activity (Go SEA)

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

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