UCSF

ZINC71789633

Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2012 13 Yes

CAS Number: 79831-76-8

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) -2.04 -6.01 -29.85 5 5 1 85 190.219 0

Vendor Notes

Note Type Comments Provided By
Notes alpha-glucosidase inhibitor Apollo Scientific Bioactives

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.