PIMONIDAZOLE

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: Parent
UNII: 46JO4D76R2

Structure
InChI Key WVWOOAYQYLJEFD-UHFFFAOYSA-N
Smile O=[N+]([O-])c1nccn1CC(O)CN1CCCCC1
InChI
InChI=1S/C11H18N4O3/c16-10(8-13-5-2-1-3-6-13)9-14-7-4-12-11(14)15(17)18/h4,7,10,16H,1-3,5-6,8-9H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H18N4O3
Molecular Weight 254.29
AlogP 0.64
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 84.43
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 18.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Tuberculosis, Pulmonary 2 D014397 ClinicalTrials
Prostatic Neoplasms, Castration-Resistant 2 D064129 ClinicalTrials
Aortic Aneurysm, Thoracic 1 D017545 ClinicalTrials
Rectal Neoplasms 0 D012004 ClinicalTrials

Related Entries

Scaffolds

Salt

Cross References

Resources Reference
CAS NUMBER 70132-50-2
ChEMBL CHEMBL58752
DrugBank DB12485
FDA SRS 46JO4D76R2
PubChem 50981
SureChEMBL SCHEMBL51977
CONTENTS