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Compound Detail

CHEMBL1205150

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COC(=O)/C=C1/C(=O)N2C1S(=O)(=O)[C@@](C)(COC(=O)CSc1nnnn1C)[C@@H]2C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1205150
Phase Preclinical
Structure Type MOL
InChI Key WOEKVBCDFRSHHE-VSOFOQCTSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

475.5
MW (Da)
-2.25
ALogP
13
HBA
1
HBD
187.9
PSA (Ų)
0.19
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H17N5O9S2
MW 475.46
Aromatic Rings 1
Heavy Atoms 31
NP-Likeness -0.85

Data from ChEMBL 36 via Core Engine