UCSF

ZINC01657274

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 12 No

Popular Name: 2-chloro-N-phenylpropanamide 2-chloro-N-phenylpropanamide

Find On: PubMed — Wikipedia — Google

CAS Numbers: 21262-52-2 , [21262-52-2]

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) 2.09 4.68 -10.31 1 2 0 29 183.638 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 78 - 80 Enamine Building Blocks
MP 78...80 Enamine Building Blocks
MP 79 - 80 Enamine Building Blocks
MP 80 - 80 Enamine Building Blocks
MP 80 - 82 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks
MP 90 - 91 Matrix Scientific
purity 95 Enamine Building Blocks
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0284099A2 IBM Patent Data
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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