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Compound Detail

CHEMBL1741065

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CC1(C)[C@H](C(=O)O)N2C(=O)[C@@H](CC(=O)O)[C@H]2S1(=O)=O

Basic Information

ChEMBL ID CHEMBL1741065
Phase Preclinical
Structure Type MOL
InChI Key LOWCQEDPHDQDQS-GZDOIFTASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

291.3
MW (Da)
-1.09
ALogP
5
HBA
2
HBD
129.1
PSA (Ų)
0.63
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H13NO7S
MW 291.28
Aromatic Rings 0
Heavy Atoms 19
NP-Likeness 0.56

Data from ChEMBL 36 via Core Engine