Anagrelide hydrochlorideProduct ingredient for Anagrelide

Name
Anagrelide hydrochloride
Drug Entry
Anagrelide

Anagrelide is a platelet-reducing agent used to lower dangerously elevated platelet levels (i.e. to treat thrombocythemia) in patients with myeloproliferative neoplasms.9 It is an oral imidazoquinazoline that was first approved for use in the US in 1997.8 It appears to carry a better response rate than other thrombocythemia treatments (e.g. busulfan, hydroxyurea) and may be better tolerated.8

Accession Number
DBSALT000379
Structure
Thumb
Synonyms
Anagrelide HCl
UNII
VNS4435G39
CAS Number
58579-51-4
Weight
Average: 292.549
Monoisotopic: 290.973295014
Chemical Formula
C10H8Cl3N3O
InChI Key
TVWRQCIPWUCNMI-UHFFFAOYSA-N
InChI
InChI=1S/C10H7Cl2N3O.ClH/c11-6-1-2-7-5(9(6)12)3-15-4-8(16)14-10(15)13-7;/h1-2H,3-4H2,(H,13,14,16);1H
IUPAC Name
6,7-dichloro-3H,5H-imidazo[2,1-b]quinazolin-2-ol hydrochloride
SMILES
Cl.OC1=NC2=NC3=C(CN2C1)C(Cl)=C(Cl)C=C3
PubChem Compound
42786
ChemSpider
39024
ChEBI
55345
ChEMBL
CHEMBL1200759
Wikipedia
Anagrelide
Predicted Properties
PropertyValueSource
Water Solubility0.104 mg/mLALOGPS
logP1.85ALOGPS
logP1.84ChemAxon
logS-3.4ALOGPS
pKa (Strongest Acidic)4.91ChemAxon
pKa (Strongest Basic)3.98ChemAxon
Physiological Charge1ChemAxon
Hydrogen Acceptor Count4ChemAxon
Hydrogen Donor Count1ChemAxon
Polar Surface Area48.19 Å2ChemAxon
Rotatable Bond Count0ChemAxon
Refractivity63.77 m3·mol-1ChemAxon
Polarizability23.9 Å3ChemAxon
Number of Rings3ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon