butalbital

Ligand id: 7138

Name: butalbital

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 82.25
Molecular weight 224.12
XLogP 2.7
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name
4,6-dihydroxy-5-(2-methylpropyl)-5-(prop-2-en-1-yl)-2,5-dihydropyrimidin-2-one
International Nonproprietary Names
INN number INN
7 butalbital
Synonyms
alisobumal
allylbarbituric acid
itobarbital
tetrallobarbital
Database Links
CAS Registry No. 77-26-9
ChEMBL Ligand CHEMBL454
DrugBank Ligand DB00241
PubChem CID 2481
Search Google for chemical match using the InChIKey UZVHFVZFNXBMQJ-UHFFFAOYSA-N
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Wikipedia Butalbital
Comments
Butalbital is a barbiturate drug.