UCSF

ZINC08628599

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) 1.52 5.57 -14.91 1 2 0 33 173.215 0

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0318225A2; EP0318225B1; EP0412848A2; EP0412848B1; US5112837; US5444071 IBM Patent Data

Activity (Go SEA)

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