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Compound Detail

CHEMBL1205466

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O=C(O)C[C@H](O)CC(O)COc1c(CCCOc2ccc(F)cc2)cc(Cl)cc1C1CCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1205466
Phase Preclinical
Structure Type MOL
InChI Key SGKRQHZSMMVREF-ZMFCMNQTSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

495.0
MW (Da)
5.11
ALogP
5
HBA
3
HBD
96.2
PSA (Ų)
0.33
QED
1
Ro5 Violations
13
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H32ClFO6
MW 494.99
Aromatic Rings 2
Heavy Atoms 34
NP-Likeness -0.10

Data from ChEMBL 36 via Core Engine