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Compound Detail

CHEMBL2426204

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CN1CCN(c2nnc(NC(=O)Nc3ccc(Cl)c(Cl)c3)s2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2426204
Phase Preclinical
Structure Type MOL
InChI Key WKAURGYHUMYRIP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

387.3
MW (Da)
3.24
ALogP
6
HBA
2
HBD
73.4
PSA (Ų)
0.85
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 C14H16Cl2N6OS
MW 387.30
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -2.60

Literature References

PubMed DOI Target Context # Activities
24012121 10.1016/j.bmcl.2013.08.025 RecQ-like DNA helicase BLM 1

Data from ChEMBL 36 via Core Engine