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Compound Detail

CHEMBL4445136

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CN(C(=O)CNC(=O)c1cnc2ccc(Cl)cc2c1)C1CCS(=O)(=O)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4445136
Phase Preclinical
Structure Type MOL
InChI Key VXCVFUJIJDZZBK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

409.9
MW (Da)
1.65
ALogP
5
HBA
1
HBD
96.4
PSA (Ų)
0.83
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H20ClN3O4S
MW 409.90
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -2.14

Data from ChEMBL 36 via Core Engine