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Compound Detail

CHEMBL5916459

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COc1cc2ncnc(Nc3ccc(NC(=O)Nc4cccc(S(C)(=O)=O)c4)c(Cl)c3)c2c2c1OCCO2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5916459
Phase Preclinical
Structure Type MOL
InChI Key HVUJIGWFYUNZNA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

556.0
MW (Da)
4.85
ALogP
9
HBA
3
HBD
140.8
PSA (Ų)
0.30
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H22ClN5O6S
MW 556.00
Aromatic Rings 4
Heavy Atoms 38
NP-Likeness -1.55

Data from ChEMBL 36 via Core Engine