ZURANOLONE

Search structure
Synonyms:
Status: Approved (2023)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 7ZW49N180B

Structure
InChI Key HARRKNSQXBRBGZ-GVKWWOCJSA-N
Smile C[C@]12CC[C@@H]3[C@H]4CC[C@@](C)(O)C[C@H]4CC[C@H]3[C@@H]1CC[C@@H]2C(=O)Cn1cc(C#N)cn1
InChI
InChI=1S/C25H35N3O2/c1-24(30)9-7-18-17(11-24)3-4-20-19(18)8-10-25(2)21(20)5-6-22(25)23(29)15-28-14-16(12-26)13-27-28/h13-14,17-22,30H,3-11,15H2,1-2H3/t17-,18+,19-,20-,21+,22-,24-,25+/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C25H35N3O2
Molecular Weight 409.57
AlogP 4.34
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 3.0
Polar Surface Area 78.91
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 30.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Ion channel Ligand-gated ion channel GABA-A receptor
374-375 - - - -
Ion channel Voltage-gated ion channel Transient receptor potential channel
- - - - 95
Membrane receptor
- - - - 88

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Depression, Postpartum 3 D019052 ClinicalTrials
Depressive Disorder, Major 3 D003865 ClinicalTrials
Parkinson Disease 2 D010300 ClinicalTrials
Essential Tremor 2 D020329 ClinicalTrials
Depressive Disorder 2 D003866 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL4105630
DrugBank DB15490
FDA SRS 7ZW49N180B
PubChem 86294073
SureChEMBL SCHEMBL16189866
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