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Compound Detail

CHEMBL1178818

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Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2ccc(O)nn2)c1Br
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1178818
Phase Preclinical
Structure Type MOL
InChI Key LTUFGJPPYKPMHS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

460.3
MW (Da)
2.36
ALogP
9
HBA
3
HBD
147.3
PSA (Ų)
0.53
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H10BrN5O5S2
MW 460.29
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -2.50

Data from ChEMBL 36 via Core Engine