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Compound Detail

CHEMBL99097

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CCCC(C)n1c(CC)nc2c(-c3ccc(O)nc3C)ccnc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL99097
Phase Preclinical
Structure Type MOL
InChI Key NHMYGZYFNQWLLX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

324.4
MW (Da)
4.43
ALogP
5
HBA
1
HBD
63.8
PSA (Ų)
0.75
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 C19H24N4O
MW 324.43
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -0.82

Literature References

PubMed DOI Target Context # Activities
12482442 10.1016/s0960-894x(02)00835-1 Corticotropin releasing factor receptor 1

Data from ChEMBL 36 via Core Engine