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Compound Detail

CHEMBL1740343

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COc1ccc2c(c1)C(NC(C)=O)C(=O)N2CCN1CCOCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1740343
Phase Preclinical
Structure Type MOL
InChI Key OADOAHVZELNFCK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

333.4
MW (Da)
0.55
ALogP
5
HBA
1
HBD
71.1
PSA (Ų)
0.85
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H23N3O4
MW 333.39
Aromatic Rings 1
Heavy Atoms 24
NP-Likeness -1.16

Data from ChEMBL 36 via Core Engine