UCSF

ZINC04095655

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) 3.28 -0.96 -11.88 2 5 0 83 284.267 1

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0501781A2; EP0501781A3; US4602913 IBM Patent Data

Activity (Go SEA)

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