UCSF

ZINC01682065

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 18 No

Popular Name: N-(4-chloro-2,5-dimethoxyphenyl)-3-oxobutanamide N-(4-chloro-2,5-dimethoxyphenyl)…

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CAS Numbers: 4433-79-8 , [4433-79-8]

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) 1.58 1.03 -16.19 1 5 0 64 271.7 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 108 TCI
Purity 95% Fluorochem

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