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Compound Detail

CHEMBL1207383

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CC(C)Cc1cn(-c2nc(C(=O)O)cs2)c2ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1207383
Phase Preclinical
Structure Type MOL
InChI Key DCXIVUWUSMPWRY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

300.4
MW (Da)
3.98
ALogP
4
HBA
1
HBD
55.1
PSA (Ų)
0.79
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 C16H16N2O2S
MW 300.38
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -0.82

Data from ChEMBL 36 via Core Engine