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Compound Detail

CHEMBL1622916

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Cc1c(Nc2scc(-c3ccccc3)[n+]2-c2ccccc2)c(=O)n(-c2ccccc2)n1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1622916
Phase Preclinical
Structure Type MOL
InChI Key YSDKLJLQBNLZIB-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

439.6
MW (Da)
5.23
ALogP
5
HBA
1
HBD
42.8
PSA (Ų)
0.38
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H23N4OS+
MW 439.56
Aromatic Rings 5
Heavy Atoms 32
NP-Likeness -1.19

Data from ChEMBL 36 via Core Engine