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Compound Detail

CHEMBL4068967

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ClC1=C(Cl)C(Cl)=C(Cl)C1=NN(c1ccccc1)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4068967
Phase Preclinical
Structure Type MOL
InChI Key IPBBSGYAKBMDSS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

384.1
MW (Da)
6.57
ALogP
2
HBA
0
HBD
15.6
PSA (Ų)
0.55
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H10Cl4N2
MW 384.09
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.39

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