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Compound Detail

CHEMBL1205868

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Cc1ccc(-c2ccc(CCCC(P(=O)(O)O)S(=O)(=O)O)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1205868
Phase Preclinical
Structure Type MOL
InChI Key VZDJYSNFOJHTJU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

384.4
MW (Da)
3.38
ALogP
3
HBA
3
HBD
111.9
PSA (Ų)
0.50
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H21O6PS
MW 384.39
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness 0.02

Data from ChEMBL 36 via Core Engine