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Compound Detail

CHEMBL1207684

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CCC(CSC(CCc1ccccc1C(=O)NS(=O)(=O)c1ccccc1C)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1)C(=O)O

Basic Information

ChEMBL ID CHEMBL1207684
Phase Preclinical
Structure Type MOL
InChI Key BGWKUVIKPAIWNA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

717.3
MW (Da)
8.41
ALogP
7
HBA
2
HBD
122.7
PSA (Ų)
0.11
QED
2
Ro5 Violations
15
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C38H37ClN2O6S2
MW 717.31
Aromatic Rings 5
Heavy Atoms 49
NP-Likeness -0.84

Data from ChEMBL 36 via Core Engine