Trade Names:
Synonyms:
Status: Approved (1966)
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: L01AX02
UNII: 6Q99RDT97R

Structure

InChI Key NJBFOOCLYDNZJN-UHFFFAOYSA-N
Smile O=C(CCBr)N1CCN(C(=O)CCBr)CC1
InChI
InChI=1S/C10H16Br2N2O2/c11-3-1-9(15)13-5-7-14(8-6-13)10(16)2-4-12/h1-8H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H16Br2N2O2
Molecular Weight 356.06
AlogP 1.23
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 4.0
Polar Surface Area 40.62
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 16.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR DNA inhibitor PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Polycythemia Vera 3 D011087 ClinicalTrials

Cross References

Resources Reference
CAS NUMBER 54-91-1
ChEBI 8242
ChEMBL CHEMBL1585
DrugBank DB00236
DrugCentral 2192
EPA CompTox DTXSID7023485
FDA SRS 6Q99RDT97R
Human Metabolome Database HMDB0014381
Guide to Pharmacology 7271
KEGG C07362
PharmGKB PA164747673
PubChem 4842
SureChEMBL SCHEMBL4889
ZINC ZINC000001530753