UCSF

ZINC02578582

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) 3.87 0.27 -53.08 1 5 -1 78 230.284 7

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0717040A1 IBM Patent Data
Boiling_Point n.d. Squarix

Activity (Go SEA)

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