UCSF

ZINC01584113

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 15 No

Popular Name: 2-Amino-3-(3-nitrophenyl)propanoic acid 2-Amino-3-(3-nitrophenyl)propano…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 169530-97-6 , 19883-74-0 , 22888-56-8 , 621-44-3 , 734529-57-8 , 787544-61-0 , [169530-97-6] , [22888-56-8]

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) -1.30 4.75 -45.17 3 6 0 114 210.189 4 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 97% Fluorochem
Melting_Point ca 230? dec. Alfa-Aesar
Melting_Point ca 230° dec. Alfa-Aesar

Activity (Go SEA)

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