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Compound Detail

CHEMBL3900363

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O=C(COc1ccccc1)Nc1ccc(S(=O)(=O)Nc2nccs2)c2cccnc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3900363
Phase Preclinical
Structure Type MOL
InChI Key KPPMTUNPHPCOPN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

440.5
MW (Da)
3.51
ALogP
7
HBA
2
HBD
110.3
PSA (Ų)
0.46
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H16N4O4S2
MW 440.51
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -2.14

Data from ChEMBL 36 via Core Engine