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Compound Detail

CHEMBL4117494

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NC(=O)c1c(NC(=O)Nc2ccc(Cl)cc2)sc2c1CCN(CC1CC1)C2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4117494
Phase Preclinical
Structure Type MOL
InChI Key HHQYIHXGNAJJHF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

404.9
MW (Da)
3.91
ALogP
4
HBA
3
HBD
87.5
PSA (Ų)
0.71
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 C19H21ClN4O2S
MW 404.92
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -2.12

Data from ChEMBL 36 via Core Engine