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Compound Detail

CHEMBL1183810

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Cc1cc(C)[n+](CC(=O)Nc2nnc(S(N)(=O)=O)s2)c(C)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1183810
Phase Preclinical
Structure Type MOL
InChI Key PMXQIBXLHFWGQH-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

342.4
MW (Da)
0.04
ALogP
6
HBA
2
HBD
118.9
PSA (Ų)
0.60
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H16N5O3S2+
MW 342.43
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -1.75

Data from ChEMBL 36 via Core Engine