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Compound Detail

CHEMBL218747

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CCc1cccc2c1CNc1c(cccc1CCc1ccccc1)/C=C\2COc1ccccc1NC(C)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL218747
Phase Preclinical
Structure Type MOL
InChI Key WOOCGNDWCZPGLT-ANYBSYGZSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

502.7
MW (Da)
7.54
ALogP
3
HBA
2
HBD
50.4
PSA (Ų)
0.26
QED
2
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C34H34N2O2
MW 502.66
Aromatic Rings 4
Heavy Atoms 38
NP-Likeness -0.23

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
16890431 10.1016/j.bmcl.2006.07.078 Protein kinase C (PKC) 1
16890431 10.1016/j.bmcl.2006.07.078 cAMP-dependent protein kinase (PKA) 1

Data from ChEMBL 36 via Core Engine