UCSF

ZINC01532570

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) -2.92 -5.81 -48.52 3 6 -1 117 177.132 5

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.34e+02 g/l DrugBank-experimental
PUBCHEM_PATENT_ID EP0751997A1; US5786186; US6013263; US6017536; US6020459; US6054265; US6060065; US6093794; WO1995025799A1; WO1996019495A1 IBM Patent Data
UniProt Database Links FUCDH_XANCP; LGA1_ASPNG; LGA1_HYPJE; LGD1_HYPJE ChEBI

Activity (Go SEA)

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