ISOCARBOXAZID

Search structure
Trade Names:
Synonyms:
Status: Approved (1959)
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: N06AF01
UNII: 34237V843T

Structure
InChI Key XKFPYPQQHFEXRZ-UHFFFAOYSA-N
Smile Cc1cc(C(=O)NNCc2ccccc2)no1
InChI
InChI=1S/C12H13N3O2/c1-9-7-11(15-17-9)12(16)14-13-8-10-5-3-2-4-6-10/h2-7,13H,8H2,1H3,(H,14,16)

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H13N3O2
Molecular Weight 231.25
AlogP 1.42
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 67.16
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 17.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Monoamine oxidase inhibitor FDA Wikipedia

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Alzheimer Disease 0 D000544 ClinicalTrials

Adverse Reactions

SOC By Demographic Distribution
System Organ Classification (SOC)
Relative Frequency (%)
Cardiac disorders
22.22
Vascular disorders
18.52
Injury, poisoning and procedural complications
11.11
Psychiatric disorders
11.11
General disorders and administration site conditions
7.41
Respiratory, thoracic and mediastinal disorders
7.41
Skin and subcutaneous tissue disorders
7.41
Infections and infestations
3.7
Investigations
3.7
Musculoskeletal and connective tissue disorders
3.7
Nervous system disorders
3.7

Cross References

Resources Reference
CAS NUMBER 59-63-2
ChEBI 93635
ChEMBL CHEMBL1201168
DrugBank DB01247
DrugCentral 1490
EPA CompTox DTXSID4023171
FDA SRS 34237V843T
Human Metabolome Database HMDB0015377
Guide to Pharmacology 7204
PharmGKB PA450101
PubChem 3759
SureChEMBL SCHEMBL49562
ZINC ZINC000000001587
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