UCSF

ZINC33368688

Substance Information

In ZINC since Heavy atoms Benign functionality
July 7th, 2009 16 No

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) 0.61 2.48 -16.74 2 4 0 58 222.288 2

Vendor Notes

Note Type Comments Provided By
mp 233 - 234 MolMall (formerly Molecular Diversity Preservation International)
mp 289 - 290 MolMall (formerly Molecular Diversity Preservation International)

Activity (Go SEA)

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