UCSF

ZINC05727805

Substance Information

In ZINC since Heavy atoms Benign functionality
February 10th, 2006 18 No

CAS Number: 20880-92-6

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) 0.79 -5.03 -6.71 1 6 0 66 260.286 1

Vendor Notes

Note Type Comments Provided By
mp 95.5 - 97.5 MolMall (formerly Molecular Diversity Preservation International)

Activity (Go SEA)

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