UCSF

ZINC03831001

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) 3.16 9.72 -51.21 3 5 1 53 339.463 3

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.40e-01 g/l DrugBank-approved
Therapy D2 Dopamine receptor agonist; serotonin mixed receptor agonist/antagonist; inhibitor of prolactin secretion; used clini SMDC Iconix
Patent Database Links EP1256343; EP1568770; EP1576985; EP1666040; EP1772452; EP1776955; EP1815846; EP1815854; EP1829527; EP1829528; EP1870096; EP1952813; EP1987815; GB2001531; US2006199798; US2007225379; US2007231272; US2007269482; WO2005063254; WO2006091697; WO2007093624; WO2 ChEBI

Activity (Go SEA)

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