UCSF

ZINC34537671

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2009 9 Yes

Popular Name: 3-cyano-5-hydroxypyridine 3-cyano-5-hydroxypyridine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 152803-24-2 , 368866-17-5 , [152803-24-2]

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) 0.38 0.27 -6.38 1 3 0 57 120.111 0 ↓
Mid Mid (pH 6-8) 0.38 1.03 -33.37 0 3 -1 60 119.103 0 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 213-217? Alfa-Aesar
Melting_Point 213-217° Alfa-Aesar
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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