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Compound Detail

CHEMBL4116268

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NC(=O)c1c(NC(=O)Nc2ccc(Cl)cc2)sc2c1CCN(CC1CCCC1)C2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4116268
Phase Preclinical
Structure Type MOL
InChI Key ZORNQUQGZNUWDH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

433.0
MW (Da)
4.69
ALogP
4
HBA
3
HBD
87.5
PSA (Ų)
0.64
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H25ClN4O2S
MW 432.98
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -1.97

Data from ChEMBL 36 via Core Engine