UCSF

ZINC04521813

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) 3.76 10.84 -50.1 1 4 -1 77 333.448 12
Lo Low (pH 4.5-6) 3.76 8.86 -14.17 2 4 0 75 334.456 12

Vendor Notes

Note Type Comments Provided By
UniProt Database Links MAAI1_DROME; MAAI2_DROME; PGA2_SCHPO; PGA2_YEAST ChEBI
Reactome Database Links REACT_150179; REACT_150290; REACT_150333 ChEBI
PUBCHEM_PATENT_ID US3954844; US5059586; US5130300; US5182302; US6031001 IBM Patent Data

Activity (Go SEA)

Direct Reactome Annotations (via ChEBI)

Description Species
Synthesis of Prostaglandins (PG) and Thromboxanes (TX)

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