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Compound Detail

CHEMBL2158183

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Cc1ccn2c(=O)c(C(=O)NCc3ccc(F)cc3)cnc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2158183
Phase Preclinical
Structure Type MOL
InChI Key HWAPBDMUFLVXHP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

311.3
MW (Da)
2.07
ALogP
4
HBA
1
HBD
63.5
PSA (Ų)
0.81
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H14FN3O2
MW 311.32
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -2.13

Literature References

PubMed DOI Target Context # Activities
23040894 10.1016/j.bmc.2012.09.008 Unchecked 2

Data from ChEMBL 36 via Core Engine