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Compound Detail

CHEMBL3319628

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O=C(O)CN(Cc1ccc(Oc2ccccc2)cc1)C(=O)c1c(Cl)cccc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3319628
Phase Preclinical
Structure Type MOL
InChI Key YPZIRQJITRVDCT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

430.3
MW (Da)
5.51
ALogP
3
HBA
1
HBD
66.8
PSA (Ų)
0.54
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H17Cl2NO4
MW 430.29
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -1.00

Literature References

PubMed DOI Target Context # Activities
24988361 10.1021/jm500681z Diacylglycerol lipase-alpha 1

Data from ChEMBL 36 via Core Engine