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Compound Detail

CHEMBL160521

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COc1cc(/C(C)=N/NC(=O)c2ccc(O)c(Cl)c2)cc(OC)c1OCc1ccc(C(C)C)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL160521
Phase Preclinical
Structure Type MOL
InChI Key CRKDIKGTOAHYEO-STBIYBPSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

497.0
MW (Da)
5.92
ALogP
6
HBA
2
HBD
89.4
PSA (Ų)
0.28
QED
1
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H29ClN2O5
MW 496.99
Aromatic Rings 3
Heavy Atoms 35
NP-Likeness -0.82

Literature References

PubMed DOI Target Context # Activities
11844695 10.1016/s0960-894x(01)00819-8 Glucagon receptor 1

Data from ChEMBL 36 via Core Engine