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Compound Detail

CHEMBL1179852

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Cc1cc(C)[n+](CC(=O)Nc2ccc3nc(S(N)(=O)=O)sc3c2)c(C)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1179852
Phase Preclinical
Structure Type MOL
InChI Key TWNBIHDFEMHIQI-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

391.5
MW (Da)
1.80
ALogP
5
HBA
2
HBD
106.0
PSA (Ų)
0.66
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 C17H19N4O3S2+
MW 391.50
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.68

Data from ChEMBL 36 via Core Engine