UCSF

ZINC00402564

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 17 No

Popular Name: N-(2-chlorophenyl)-3-keto-4,4-dimethyl-valeramide N-(2-chlorophenyl)-3-keto-4,4-di…

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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) 2.89 1.82 -13.3 1 3 0 46 253.729 4 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0249473A2; EP0249473B1 IBM Patent Data

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