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Compound Detail

CHEMBL5974511

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COc1cc2c(cc1Nc1ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n1)CCN(C(=O)CO)C2(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5974511
Phase Preclinical
Structure Type MOL
InChI Key NGDAZGIOVRCTBW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

574.1
MW (Da)
4.42
ALogP
9
HBA
3
HBD
133.8
PSA (Ų)
0.36
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H32ClN5O5S
MW 574.10
Aromatic Rings 3
Heavy Atoms 39
NP-Likeness -0.83

Data from ChEMBL 36 via Core Engine