UCSF

ZINC19685779

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2008 34 No

CAS Number: 96829-58-2

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) 9.06 18.05 -10.45 1 5 0 65 481.762 23

Vendor Notes

Note Type Comments Provided By
mechanism Pancreatic lipase inhibitor IBScreen Bioactives
biological_use Used to treat obesity IBScreen Bioactives

Activity (Go SEA)

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

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