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Compound Detail

CHEMBL11934

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Oc1ccc2[nH]c3c(c2c1)C=CNC3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL11934
Phase Preclinical
Structure Type MOL
InChI Key NBTXKZZJFYKNRW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

186.2
MW (Da)
1.95
ALogP
2
HBA
3
HBD
48.0
PSA (Ų)
0.59
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H10N2O
MW 186.21
Aromatic Rings 2
Heavy Atoms 14
NP-Likeness 0.89

Literature References

PubMed DOI Target Context # Activities
6127411 10.1021/jm00351a015 GABA-A receptor; anion channel 1

Data from ChEMBL 36 via Core Engine