UCSF

ZINC40435346

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2010 12 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) 1.08 1.42 -7.06 3 3 0 51 177.129 2

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 96% Fluorochem
Warnings IRRITANT Matrix Scientific
Warnings Toxic Matrix Scientific

Activity (Go SEA)

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

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