UCSF

ZINC38531939

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 11 Yes

Popular Name: 2-Chloro-5-methylnicotinic acid 2-Chloro-5-methylnicotinic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 505084-59-3 , 66909-30-6 , [66909-30-6]

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) 1.67 4.24 -45.98 0 3 -1 53 170.575 1 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 173-178? Alfa-Aesar
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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