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Compound Detail

CHEMBL1731619

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COc1cccc(C(=O)N2CCN(C(=O)COc3ccc4ccccc4c3)CC2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1731619
Phase Preclinical
Structure Type MOL
InChI Key WUTDPDKCHSZJPS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

404.5
MW (Da)
3.21
ALogP
4
HBA
0
HBD
59.1
PSA (Ų)
0.66
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 C24H24N2O4
MW 404.47
Aromatic Rings 3
Heavy Atoms 30
NP-Likeness -1.19

Data from ChEMBL 36 via Core Engine