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Compound Detail

CHEMBL1208065

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O=P(O)(O)C(CCCc1cccc(Oc2ccc(Oc3ccccc3)cc2)c1)S(=O)(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1208065
Phase Preclinical
Structure Type MOL
InChI Key CCBYUTHOHYHCOS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

478.5
MW (Da)
4.99
ALogP
5
HBA
3
HBD
130.4
PSA (Ų)
0.27
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H23O8PS
MW 478.46
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -0.02

Data from ChEMBL 36 via Core Engine