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Compound Detail

CHEMBL1207420

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CC(C)C(=O)c1cn(-c2nc(C(=O)O)cs2)c2cc(Cl)ccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1207420
Phase Preclinical
Structure Type MOL
InChI Key VXTOSDRVRFHLPH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

348.8
MW (Da)
4.28
ALogP
5
HBA
1
HBD
72.2
PSA (Ų)
0.71
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 C16H13ClN2O3S
MW 348.81
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.04

Data from ChEMBL 36 via Core Engine