UCSF

ZINC00621892

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) 3.34 11.49 -46.14 1 6 1 60 415.535 7
Hi High (pH 8-9.5) 3.34 9.03 -14.67 0 6 0 59 414.527 7

Vendor Notes

Note Type Comments Provided By
Molecular_Solubility 4.353 Bitter DB
Therapy Ca channel blocker, coronary vasodilator SMDC MicroSource

Activity (Go SEA)

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