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Compound Detail

CHEMBL1186541

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Cc1ccc(-c2c(C(=O)N[n+]3c(C)cc(C)cc3C)[nH]c3ccc(S(N)(=O)=O)cc23)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1186541
Phase Preclinical
Structure Type MOL
InChI Key WOAYEAZNVGHCDU-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

449.6
MW (Da)
3.39
ALogP
3
HBA
3
HBD
108.9
PSA (Ų)
0.42
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 C24H25N4O3S+
MW 449.56
Aromatic Rings 4
Heavy Atoms 32
NP-Likeness -0.79

Data from ChEMBL 36 via Core Engine