Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: Z24BD2IFB3

Structure

InChI Key IYSYPCSSDZBWHN-UHFFFAOYSA-N
Smile O=C1Cc2ccccc2C(=C2CCNCC2)c2ccsc21
InChI
InChI=1S/C18H17NOS/c20-16-11-13-3-1-2-4-14(13)17(12-5-8-19-9-6-12)15-7-10-21-18(15)16/h1-4,7,10,19H,5-6,8-9,11H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H17NOS
Molecular Weight 295.41
AlogP 3.67
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 0.0
Polar Surface Area 29.1
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 21.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Influenza, Human 2 D007251 ClinicalTrials

Related Entries

MCS

Scaffolds

Cross References

Resources Reference
ChEBI 174806
ChEMBL CHEMBL1197564
FDA SRS Z24BD2IFB3
Human Metabolome Database HMDB0060646
PubChem 9904236
SureChEMBL SCHEMBL936577
ZINC ZINC000005517457