UCSF

ZINC09304535

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2007 15 No

Popular Name: 3-[(2,3-dimethylphenyl)amino]-3-oxopropanoic acid 3-[(2,3-dimethylphenyl)amino]-3-…

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CAS Number: 95262-02-5

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) 1.43 5.46 -55.36 1 4 -1 69 206.221 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0335046A1; EP0335046B1; US4904787 IBM Patent Data

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