UCSF

ZINC00164148

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 11 Yes

Popular Name: 4-(methylamino)benzoic acid 4-(methylamino)benzoic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 10541-83-0 , [10541-83-0]

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) 1.71 2.91 -53.47 1 3 -1 52 150.157 2 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 158-160? Alfa-Aesar
Melting_Point 158-160° Alfa-Aesar
M.P 160-162 °C Indofine
MP 161 TCI
Purity 95% Fluorochem

Activity (Go SEA)

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