UCSF

ZINC01661289

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 12 Yes

CAS Numbers: 6326-79-0 , [6326-79-0]

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) 1.62 2.6 -7.2 1 3 0 50 226.029 0

Vendor Notes

Note Type Comments Provided By
MP 259 - 261 Enamine Building Blocks
MP 259...261 Enamine Building Blocks
MP 274 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Matrix Scientific
Purity 97% Fluorochem
Purity 98% APIChem
Warnings IRRITANT Matrix Scientific
Warnings Irritant/Refrigerate Matrix Scientific

Activity (Go SEA)

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