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Compound Detail

CHEMBL4076332

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Fc1cccc(NN=C2c3ccccc3-c3ccccc32)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4076332
Phase Preclinical
Structure Type MOL
InChI Key GMGFBGBVJRKDEY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

288.3
MW (Da)
4.67
ALogP
2
HBA
1
HBD
24.4
PSA (Ų)
0.53
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 C19H13FN2
MW 288.33
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -1.26

Literature References

PubMed DOI Target Context # Activities
28916338 10.1016/j.bmcl.2017.09.002 MM1.S 1
28916338 10.1016/j.bmcl.2017.09.002 RPMI-8226 1
28916338 10.1016/j.bmcl.2017.09.002 DEP domain-containing mTOR-interacting protein 1

Data from ChEMBL 36 via Core Engine