UCSF

ZINC04264790

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2005 25 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) 3.66 -4.23 -6.01 3 3 0 60 350.543 1

Vendor Notes

Note Type Comments Provided By
mp 165 - 168 MolMall (formerly Molecular Diversity Preservation International)
mp 220 - 221 MolMall (formerly Molecular Diversity Preservation International)

Activity (Go SEA)

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