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Compound Detail

CHEMBL1184184

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Oc1ccc2c(c1)OC(CNCc1cccs1)CC2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1184184
Phase Preclinical
Structure Type MOL
InChI Key KBNHFHXXRALJJY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

275.4
MW (Da)
2.94
ALogP
4
HBA
2
HBD
41.5
PSA (Ų)
0.90
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 C15H17NO2S
MW 275.37
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -0.51

Data from ChEMBL 36 via Core Engine