UCSF

ZINC00080339

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 Yes

Popular Name: Methyl 2-(2-Cyanoacetamido)benzoate Methyl 2-(2-Cyanoacetamido)benzoate

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CAS Number: 154325-57-2

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) 0.88 4.88 -14.5 1 5 0 79 218.212 4 ↓

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