Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL11912

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
O=C(O)C1Cc2ccccc2CN1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL11912
Phase Preclinical
Structure Type MOL
InChI Key BWKMGYQJPOAASG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

177.2
MW (Da)
0.79
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.67
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C10H11NO2
MW 177.20
Aromatic Rings 1
Heavy Atoms 13
NP-Likeness 0.61

Literature References

PubMed DOI Target Context # Activities
6127411 10.1021/jm00351a015 GABA-A receptor; anion channel 1
10354406 10.1021/jm9807252 Phenylethanolamine N-methyltransferase 1
10354406 10.1021/jm9807252 Adrenergic receptor alpha-2 1
3351861 10.1021/jm00399a024 Phenylethanolamine N-methyltransferase 1

Data from ChEMBL 36 via Core Engine