UCSF

ZINC03843652

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 22 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) 5.49 0.72 -1.16 1 1 0 20 304.518 0

Vendor Notes

Note Type Comments Provided By
mp 166 - 168 MolMall (formerly Molecular Diversity Preservation International)
mp 195 - 197 MolMall (formerly Molecular Diversity Preservation International)

Activity (Go SEA)

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