UCSF

ZINC43174901

Substance Information

In ZINC since Heavy atoms Benign functionality
May 8th, 2010 33 No

CAS Numbers: 956104-40-8 , [956104-40-8]

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) 3.34 9.77 -20.39 1 7 0 89 477.443 4

Vendor Notes

Note Type Comments Provided By
Target Adrenergic Receptor Selleck Chemicals

Activity (Go SEA)

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

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