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Compound Detail

CHEMBL5787109

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COc1cc(Nc2ccc3n(c2=O)C(c2ccc(F)cc2)CCC3)ccc1-n1cnc(C)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5787109
Phase Preclinical
Structure Type MOL
InChI Key IWKIASXOGHBZFV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

444.5
MW (Da)
5.16
ALogP
6
HBA
1
HBD
61.1
PSA (Ų)
0.46
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H25FN4O2
MW 444.51
Aromatic Rings 4
Heavy Atoms 33
NP-Likeness -1.02

Data from ChEMBL 36 via Core Engine