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Compound Detail

CHEMBL5897655

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COc1cc2c(cc1Nc1ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n1)CCNC2C(=O)O

Basic Information

ChEMBL ID CHEMBL5897655
Phase Preclinical
Structure Type MOL
InChI Key ICSDMJULIKTRRQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

532.0
MW (Da)
4.08
ALogP
9
HBA
4
HBD
142.5
PSA (Ų)
0.34
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H26ClN5O5S
MW 532.02
Aromatic Rings 3
Heavy Atoms 36
NP-Likeness -0.76

Data from ChEMBL 36 via Core Engine