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Compound Detail

CHEMBL3262286

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Cn1cc(COc2ncccc2-c2cncnc2)c2nc3ccccc3cc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3262286
Phase Preclinical
Structure Type MOL
InChI Key JXXYPXKQUIOQCQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

367.4
MW (Da)
4.16
ALogP
6
HBA
0
HBD
65.7
PSA (Ų)
0.48
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 C22H17N5O
MW 367.41
Aromatic Rings 5
Heavy Atoms 28
NP-Likeness -1.00

Literature References

PubMed DOI Target Context # Activities
24725435 10.1016/j.bmcl.2014.03.054 cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A 2

Data from ChEMBL 36 via Core Engine