UCSF

ZINC32628325

Substance Information

In ZINC since Heavy atoms Benign functionality
May 6th, 2009 15 Yes

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) 3.62 6.08 -42.99 0 2 -1 40 258.002 2

Vendor Notes

Note Type Comments Provided By
mp 135 - 137 MolMall (formerly Molecular Diversity Preservation International)
MP 140 - 142 Enamine Building Blocks
MP 140-142° Oakwood Chemical
MP 140...142 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 98% Fluorochem

Activity (Go SEA)

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