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Compound Detail

CHEMBL4300902

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CC(=O)N(C/C=C/P(=O)(O)O)OCc1ccc2ccccc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4300902
Phase Preclinical
Structure Type MOL
InChI Key HEBWJHGHHMLCPE-ONNFQVAWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

335.3
MW (Da)
2.81
ALogP
3
HBA
2
HBD
87.1
PSA (Ų)
0.63
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H18NO5P
MW 335.30
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness 0.21

Data from ChEMBL 36 via Core Engine