UCSF

ZINC01665920

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) 3.00 1.45 -42.99 0 3 -1 49 201.286 9

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0408635A1; EP0408635B1; US4898969; US5011977 IBM Patent Data

Activity (Go SEA)

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