ACOTIAMIDE HYDROCHLORIDE

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: NMW7447A9A

Structure
InChI Key NPTDXIXCQCFGKC-UHFFFAOYSA-N
Smile COc1cc(O)c(C(=O)Nc2nc(C(=O)NCCN(C(C)C)C(C)C)cs2)cc1OC.Cl.O.O.O
InChI
InChI=1S/C21H30N4O5S.ClH.3H2O/c1-12(2)25(13(3)4)8-7-22-20(28)15-11-31-21(23-15)24-19(27)14-9-17(29-5)18(30-6)10-16(14)26;;;;/h9-13,26H,7-8H2,1-6H3,(H,22,28)(H,23,24,27);1H;3*1H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H37ClN4O8S
Molecular Weight 541.07
AlogP 2.97
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 10.0
Polar Surface Area 113.02
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 31.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Acetylcholinesterase inhibitor Other

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Dyspepsia 3 D004415 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL2107308
FDA SRS NMW7447A9A
PubChem 6918406
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