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Compound Detail

CHEMBL1183800

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CCc1cc(-c2ccccc2)cc(CC)[n+]1CC(=O)Nc1c(S(N)(=O)=O)cc(S(N)(=O)=O)c(Cl)c1Cl

Basic Information

ChEMBL ID CHEMBL1183800
Phase Preclinical
Structure Type MOL
InChI Key HJJKXGQDPQAATP-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

572.5
MW (Da)
3.01
ALogP
5
HBA
3
HBD
153.3
PSA (Ų)
0.35
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H25Cl2N4O5S2+
MW 572.52
Aromatic Rings 3
Heavy Atoms 36
NP-Likeness -0.74

Data from ChEMBL 36 via Core Engine