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Compound Detail

CHEMBL1204946

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CC(=O)/C=C1/C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1204946
Phase Preclinical
Structure Type MOL
InChI Key IKGZFJCMJFERPR-JSCIZMSRSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

255.3
MW (Da)
0.65
ALogP
4
HBA
1
HBD
74.7
PSA (Ų)
0.58
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H13NO4S
MW 255.29
Aromatic Rings 0
Heavy Atoms 17
NP-Likeness 0.80

Data from ChEMBL 36 via Core Engine