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Compound Detail

CHEMBL475638

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Cn1c(Sc2nc3ccc(Cl)cc3s2)nnc1-c1cccs1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL475638
Phase Preclinical
Structure Type MOL
InChI Key UCOJKVJKVHRPPP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

364.9
MW (Da)
4.96
ALogP
7
HBA
0
HBD
43.6
PSA (Ų)
0.52
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 C14H9ClN4S3
MW 364.91
Aromatic Rings 4
Heavy Atoms 22
NP-Likeness -3.01

Literature References

PubMed DOI Target Context # Activities
19282190 10.1016/j.bmc.2009.02.046 Unchecked 2

Data from ChEMBL 36 via Core Engine