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Compound Detail

CHEMBL1182447

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Cc1cc(OCC#CCN(C)C)no1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1182447
Phase Preclinical
Structure Type MOL
InChI Key GQSCMIFRRSZUKK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

194.2
MW (Da)
0.93
ALogP
4
HBA
0
HBD
38.5
PSA (Ų)
0.67
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H14N2O2
MW 194.23
Aromatic Rings 1
Heavy Atoms 14
NP-Likeness -1.57

Data from ChEMBL 36 via Core Engine