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Compound Detail

CHEMBL2220499

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COC(=O)CCC1CN(C)c2cccc(OC(=O)N(C)c3ccc(OC)cc3)c21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2220499
Phase Preclinical
Structure Type MOL
InChI Key ZNZMYCCWIXVYHJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

398.5
MW (Da)
3.82
ALogP
6
HBA
0
HBD
68.3
PSA (Ų)
0.69
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 C22H26N2O5
MW 398.46
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -0.56

Data from ChEMBL 36 via Core Engine