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Compound Detail

CHEMBL33090

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Clc1ccc(C(Cc2ccncc2)c2ccc3c(c2)OCO3)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL33090
Phase Preclinical
Structure Type MOL
InChI Key FEKRQSLXQVPZGO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

337.8
MW (Da)
4.84
ALogP
3
HBA
0
HBD
31.4
PSA (Ų)
0.68
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H16ClNO2
MW 337.81
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -0.38

Literature References

PubMed DOI Target Context # Activities
12031319 10.1016/s0960-894x(02)00190-7 3',5'-cyclic-AMP phosphodiesterase 4A 2

Data from ChEMBL 36 via Core Engine