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Compound Detail

CHEMBL497465

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CCCNc1c(C)nc(-c2c(C)cc(C)cc2OC)nc1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL497465
Phase Preclinical
Structure Type MOL
InChI Key GFAHRZRGKSGMME-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

315.4
MW (Da)
3.91
ALogP
5
HBA
1
HBD
56.3
PSA (Ų)
0.88
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H25N3O2
MW 315.42
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.73

Literature References

PubMed DOI Target Context # Activities
18672365 10.1016/j.bmcl.2008.07.063 Corticotropin-releasing factor receptor 1 1

Data from ChEMBL 36 via Core Engine