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Compound Detail

CHEMBL1183608

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Cc1cc(-c2ccccc2)cc(-c2ccccc2)[n+]1-c1ccc(S(=O)(=O)Nc2nnc(S(N)(=O)=O)s2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1183608
Phase Preclinical
Structure Type MOL
InChI Key XLKOPUNLSAOKDW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

564.7
MW (Da)
3.91
ALogP
7
HBA
2
HBD
136.0
PSA (Ų)
0.29
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H22N5O4S3+
MW 564.69
Aromatic Rings 5
Heavy Atoms 38
NP-Likeness -1.31

Data from ChEMBL 36 via Core Engine