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Compound Detail

CHEMBL1205479

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CC(C)c1cc(SC(C)(C)Sc2cc(-c3ccc(F)cc3)c(OCC(O)C[C@@H](O)CC(=O)O)c(C(C)C)c2)cc(-c2ccc(F)cc2)c1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1205479
Phase Preclinical
Structure Type MOL
InChI Key VDPZSEASYIIOOX-FICMROCWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

710.9
MW (Da)
9.84
ALogP
7
HBA
4
HBD
107.2
PSA (Ų)
0.07
QED
2
Ro5 Violations
15
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C39H44F2O6S2
MW 710.91
Aromatic Rings 4
Heavy Atoms 49
NP-Likeness 0.33

Data from ChEMBL 36 via Core Engine