UCSF

ZINC19943557

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 11 Yes

Popular Name: D-ASPARTIC ACID DIMETHYL ESTER HYDROCHLORIDE D-ASPARTIC ACID DIMETHYL ESTER H…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 14358-33-9 , 32213-95-9 , 40149-67-5 , 69630-50-8 , 88067-96-3 , [14358-33-9] , [69630-50-8]

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) -1.14 0.81 -6.74 2 5 0 79 161.157 5 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 114-119? Alfa-Aesar
MP 115.5-117.0o C Indofine
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 98%min APIChem

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