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Compound Detail

CHEMBL4300402

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CC(=O)N(C/C=C/P(=O)(O)O)OCc1ccc(-c2ccccc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4300402
Phase Preclinical
Structure Type MOL
InChI Key LRSMLYWTNNUCGL-WLRTZDKTSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

361.3
MW (Da)
3.33
ALogP
3
HBA
2
HBD
87.1
PSA (Ų)
0.58
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 C18H20NO5P
MW 361.33
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness 0.14

Data from ChEMBL 36 via Core Engine