UCSF

ZINC01733908

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 10 Yes

Popular Name: N-methyl-dl-aspartic acid N-methyl-dl-aspartic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 17833-53-3 , 303750-06-3 , 4226-18-0 , 6384-92-5 , [303750-06-3] , [4226-18-0]

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) -2.61 2.69 -51.11 2 5 -1 97 146.122 4 ↓
Lo Low (pH 4.5-6) -2.61 0.71 -28.91 3 5 0 94 147.13 4 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 185 Acros Organics
Purity 95% Fluorochem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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