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Compound Detail

CHEMBL4174702

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Cc1cccc2c(=O)[nH]c(-c3c[nH]nc3-c3ccccc3)nc12

Basic Information

ChEMBL ID CHEMBL4174702
Phase Preclinical
Structure Type MOL
InChI Key GFVMLCLBKUUMRU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

302.3
MW (Da)
3.29
ALogP
3
HBA
2
HBD
74.4
PSA (Ų)
0.60
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H14N4O
MW 302.34
Aromatic Rings 4
Heavy Atoms 23
NP-Likeness -1.21

Literature References

PubMed DOI Target Context # Activities
29723786 10.1016/j.ejmech.2018.04.045 Transient receptor potential cation channel subfamily M member 2 3

Data from ChEMBL 36 via Core Engine