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Compound Detail

CHEMBL1741058

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CC1(C)[C@H](C(=O)O)N2C(=O)[C@@H](CCO)[C@H]2S1(=O)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1741058
Phase Preclinical
Structure Type MOL
InChI Key NILHHYITITUGOI-GKROBHDKSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

277.3
MW (Da)
-1.19
ALogP
5
HBA
2
HBD
112.0
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 C10H15NO6S
MW 277.30
Aromatic Rings 0
Heavy Atoms 18
NP-Likeness 0.75

Data from ChEMBL 36 via Core Engine