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Compound Detail

CHEMBL193974

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N#Cc1ccc(Nc2nc(Cc3c(Cl)cccc3Cl)ns2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL193974
Phase Preclinical
Structure Type MOL
InChI Key MFLPXNLDUOKNSU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

361.3
MW (Da)
5.05
ALogP
5
HBA
1
HBD
61.6
PSA (Ų)
0.71
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H10Cl2N4S
MW 361.26
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.91

Literature References

PubMed DOI Target Context # Activities
15771411 10.1021/jm040127p MT4 1

Data from ChEMBL 36 via Core Engine