OXETHAZAINE

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: IP8QT76V17

Structure
InChI Key FTLDJPRFCGDUFH-UHFFFAOYSA-N
Smile CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
InChI
InChI=1S/C28H41N3O3/c1-27(2,19-23-13-9-7-10-14-23)29(5)25(33)21-31(17-18-32)22-26(34)30(6)28(3,4)20-24-15-11-8-12-16-24/h7-16,32H,17-22H2,1-6H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C28H41N3O3
Molecular Weight 467.65
AlogP 3.24
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 12.0
Polar Surface Area 64.09
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 34.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Ion channel Voltage-gated ion channel Voltage-gated sodium channel
- 2300 - - 84

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Cross References

Resources Reference
ChEBI 31947
ChEMBL CHEMBL127592
DrugBank DB12532
DrugCentral 3407
EPA CompTox DTXSID0025818
FDA SRS IP8QT76V17
KEGG C12552
PubChem 4621
SureChEMBL SCHEMBL24489
ZINC ZINC000003874585
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