ETHAMBUTOL HYDROCHLORIDE

Search structure
Trade Names:
Synonyms:
Status: Approved (1967)
Entry Type: Small molecule
Molecule Category: Salt
UNII: QE4VW5FO07
Parent Compound: ETHAMBUTOL

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

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H26Cl2N2O2
Molecular Weight 277.24
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

Action Mechanism of Action Reference
INHIBITOR Arabinosyltransferase A inhibitor PubMed PubMed PubMed PubMed PubMed PubMed Wikipedia
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transporter Primary active transporter ATP-binding cassette ABCC subfamily
- 88200 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Mycobacterium avium-intracellulare Infection 3 D015270 ClinicalTrials
HIV Infections 1 D015658 ClinicalTrials

Related Entries

Parent

Adverse Reactions

SOC By Demographic Distribution
System Organ Classification (SOC)
Relative Frequency (%)
Immune system disorders
11.51
General disorders and administration site conditions
11.42
Skin and subcutaneous tissue disorders
10.81
Injury, poisoning and procedural complications
9.19
Nervous system disorders
8.31
Eye disorders
7.94
Hepatobiliary disorders
7.82
Infections and infestations
4.06
Gastrointestinal disorders
3.76
Respiratory, thoracic and mediastinal disorders
3.74
Investigations
3.43
Vascular disorders
3.32
Blood and lymphatic system disorders
3.11
Cardiac disorders
2.65

Cross References

Resources Reference
ChEBI 4878
ChEMBL CHEMBL3140361
EPA CompTox DTXSID4045345
FDA SRS QE4VW5FO07
PubChem 14051
SureChEMBL SCHEMBL650049
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