Synonyms:
Status: Approved (1967)
Entry Type: Small molecule
Molecule Category: Parent
ATC: J04AK02
UNII: 8G167061QZ

Structure

InChI Key AEUTYOVWOVBAKS-UWVGGRQHSA-N
Smile CC[C@@H](CO)NCCN[C@@H](CC)CO
InChI
InChI=1S/C10H24N2O2/c1-3-9(7-13)11-5-6-12-10(4-2)8-14/h9-14H,3-8H2,1-2H3/t9-,10-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H24N2O2
Molecular Weight 204.31
AlogP -0.29
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 9.0
Polar Surface Area 64.52
Molecular species BASE
Aromatic Rings 0.0
Heavy Atoms 14.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Ligase
- - - - 0
Enzyme
- - - - 0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Tuberculosis, Pulmonary 3 D014397 ClinicalTrials
Uveitis, Anterior 3 D014606 ClinicalTrials
Mycobacterium Infections 3 D009164 ClinicalTrials
Mycobacterium avium-intracellulare Infection 2 D015270 ClinicalTrials
Acquired Immunodeficiency Syndrome 2 D000163 ClinicalTrials
Sarcoidosis 2 D012507 ClinicalTrials

Related Entries

Salt

Cross References

Resources Reference
CAS NUMBER 74-55-5
ChEBI 4877
ChEMBL CHEMBL44884
DrugBank DB00330
DrugCentral 1073
EPA CompTox DTXSID8023006
FDA SRS 8G167061QZ
Human Metabolome Database HMDB0014474
KEGG C06984
PDB 95E
PubChem 14052
SureChEMBL SCHEMBL3399
ZINC ZINC000019364219