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Compound Detail

CHEMBL2220481

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CCCCN(C)C(=O)Oc1cccc2c1C(CCC(=O)OC)CN2C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2220481
Phase Preclinical
Structure Type MOL
InChI Key ORBKLMHDNWEDAP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

348.4
MW (Da)
3.40
ALogP
5
HBA
0
HBD
59.1
PSA (Ų)
0.71
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H28N2O4
MW 348.44
Aromatic Rings 1
Heavy Atoms 25
NP-Likeness -0.43

Data from ChEMBL 36 via Core Engine