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Compound Detail

CHEMBL24625

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COc1cc2c(Nc3cc(O)c(C)cc3F)ncnc2cc1OCC1CCN(C)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL24625
Phase Preclinical
Structure Type MOL
InChI Key SIABKVPDKZOJCK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

426.5
MW (Da)
4.26
ALogP
7
HBA
2
HBD
79.7
PSA (Ų)
0.61
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 C23H27FN4O3
MW 426.49
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness -0.79

Data from ChEMBL 36 via Core Engine