Trade Names
Synonyms
Status
Molecule Category Free-form
ATC L04AX04
UNII F0P408N6V4
EPA CompTox DTXSID8046664

Structure

InChI Key GOTYRUGSSMKFNF-UHFFFAOYSA-N
Smiles Nc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
InChI
InChI=1S/C13H13N3O3/c14-9-3-1-2-7-8(9)6-16(13(7)19)10-4-5-11(17)15-12(10)18/h1-3,10H,4-6,14H2,(H,15,17,18)

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H13N3O3
Molecular Weight 259.26
AlogP 0.03
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 1.0
Polar Surface Area 92.5
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 19.0

Pharmacology

Mechanism of Action Action Reference
CRL4(CRBN) E3 ubiquitin ligase inhibitor INHIBITOR PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Other cytosolic protein
- - - - 4-6
Transcription factor
- - - - 4-6
Unclassified protein
67-87 286 - - 100
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
53-150 50-480 178 - 4-100
Mus musculus
- - - - 20

Related Entries

Cross References

Resources Reference
ChEBI 63791
ChEMBL CHEMBL848
DrugBank DB00480
DrugCentral 3317
FDA SRS F0P408N6V4
Human Metabolome Database HMDB0014623
Guide to Pharmacology 7331
PharmGKB PA162363968
PubChem 216326
SureChEMBL SCHEMBL32978