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Compound Detail

CHEMBL1192766

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COc1ccc(Cl)cc1-c1nc(CN(C)Cc2ccccc2)c[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1192766
Phase Preclinical
Structure Type MOL
InChI Key HNCIZBMUGXDVDA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

341.8
MW (Da)
4.37
ALogP
3
HBA
1
HBD
41.1
PSA (Ų)
0.72
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H20ClN3O
MW 341.84
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.16

Data from ChEMBL 36 via Core Engine