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Compound Detail

CHEMBL1178885

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Cc1noc(NS(=O)(=O)c2ccsc2C(=O)Nc2cc3c(cc2CNS(C)(=O)=O)OCO3)c1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1178885
Phase Preclinical
Structure Type MOL
InChI Key WSEWFQSMWHJQFF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

549.0
MW (Da)
2.53
ALogP
10
HBA
3
HBD
165.9
PSA (Ų)
0.38
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H17ClN4O8S3
MW 549.01
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -1.87

Data from ChEMBL 36 via Core Engine