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Compound Detail

CHEMBL1206255

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CC(C)(C)Cc1cn(-c2nc(C(=O)O)cs2)c2cc(Cl)ccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1206255
Phase Preclinical
Structure Type MOL
InChI Key LJUYCVPMPFITBD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

348.9
MW (Da)
5.03
ALogP
4
HBA
1
HBD
55.1
PSA (Ų)
0.72
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H17ClN2O2S
MW 348.86
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.13

Data from ChEMBL 36 via Core Engine