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Compound Detail

CHEMBL4573183

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NC(=O)c1c(F)ccc2[nH]c(-c3ccc(O)cc3)nc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4573183
Phase Preclinical
Structure Type MOL
InChI Key SNUKVGDNMVOLRH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

271.2
MW (Da)
2.17
ALogP
3
HBA
3
HBD
92.0
PSA (Ų)
0.67
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H10FN3O2
MW 271.25
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -0.94

Literature References

PubMed DOI Target Context # Activities
27353531 10.1016/j.bmcl.2016.06.045 Poly [ADP-ribose] polymerase 1 2

Data from ChEMBL 36 via Core Engine