UCSF

ZINC21982211

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) 0.91 0.32 -41.84 1 4 -1 73 172.547 1
Hi High (pH 8-9.5) 1.36 -0.7 -97.66 0 4 -2 76 171.539 1

Vendor Notes

Note Type Comments Provided By
MP 300-302° Matrix Scientific
MP 302 TCI
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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