UCSF

ZINC04202341

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 14 No

Popular Name: Methyl 2-hydroxy-5-nitrobenzoate Methyl 2-hydroxy-5-nitrobenzoate

Find On: PubMed — Wikipedia — Google

CAS Number: 17302-46-4

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) 2.06 1.73 -36.52 0 6 -1 95 196.138 3 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 114-117? Alfa-Aesar
Melting_Point 114-117° Alfa-Aesar
Purity 95% Fluorochem

Activity (Go SEA)

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