UCSF

ZINC20357579

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2008 10 Yes

Popular Name: 1-(3-Aminopyridin-4-yl)ethanone 1-(3-Aminopyridin-4-yl)ethanone

Find On: PubMed — Wikipedia — Google

CAS Numbers: 13210-52-1 , [13210-52-1]

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) 0.18 1.26 -6.91 2 3 0 56 136.154 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 98% Fluorochem

Activity (Go SEA)

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

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