UCSF

ZINC11592975

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) -2.34 -4.73 -57.99 6 9 1 145 245.215 2
Mid Mid (pH 6-8) -2.34 -5.22 -23.37 5 9 0 144 244.207 2

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0110955A1; EP0110955B1; EP0286958A2; EP0289121A2; EP0289121B1; EP0315782A2; EP0315782B1; EP0327200A1; EP0327200B1; EP0390857A1; EP0475160B1; EP0544824A1; EP0544824B1; EP0567613A1; EP0651824A1; EP0668782A1; EP0672190A1; EP0772692A1; EP0803573A1; EP085246 IBM Patent Data

Activity (Go SEA)

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