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Compound Detail

CHEMBL497986

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Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1-c1ccc2[nH]c(=O)ccc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL497986
Phase Preclinical
Structure Type MOL
InChI Key PMVXZCCMMGCYLP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

466.6
MW (Da)
4.50
ALogP
4
HBA
2
HBD
68.4
PSA (Ų)
0.45
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H30N4O2
MW 466.59
Aromatic Rings 4
Heavy Atoms 35
NP-Likeness -1.23

Literature References

PubMed DOI Target Context # Activities
18789685 10.1016/j.bmcl.2008.08.051 Mitogen-activated protein kinase 14 1

Data from ChEMBL 36 via Core Engine