UCSF

ZINC13543254

Annotations

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) 0.89 1.56 -45.79 1 3 -1 56 160.152 0

Vendor Notes

Note Type Comments Provided By
MP 290°(dec.) Oakwood Chemical
MP 293 - 295 Enamine Building Blocks
MP 293...295 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Matrix Scientific
Purity 97% Fluorochem
Purity 98%(HPLC,GC) APIChem
Patent Database Links EP1650200; US2006105412 ChEBI
Warnings IRRITANT Matrix Scientific
UniProt Database Links Q2OA_COMTE; Q2OB_COMTE; Q2OG_COMTE ChEBI

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

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