pipobroman

Ligand id: 7271

Name: pipobroman

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 40.62
Molecular weight 353.96
XLogP 1.15
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name
3-bromo-1-[4-(3-bromopropanoyl)piperazin-1-yl]propan-1-one
International Nonproprietary Names
INN number INN
2049 pipobroman
Synonyms
A-8103 | Vercyte®
Database Links
CAS Registry No. 54-91-1
ChEMBL Ligand CHEMBL1585
DrugBank Ligand DB00236
GtoPdb PubChem SID 178103845
PubChem CID 4842
Search Google for chemical match using the InChIKey NJBFOOCLYDNZJN-UHFFFAOYSA-N
Search Google for chemicals with the same backbone NJBFOOCLYDNZJN
Search PubMed clinical trials pipobroman
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Search UniChem for chemical match using the InChIKey NJBFOOCLYDNZJN-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone NJBFOOCLYDNZJN
Wikipedia Pipobroman
Comments
This is a DNA alkylating agent.