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Compound Detail

CHEMBL317810

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CCCCNC(=O)NC(CCc1ccccc1)CP(=O)(OCCCC)OCCCC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL317810
Phase Preclinical
Structure Type MOL
InChI Key VYDWPOHNZDGHMN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

440.6
MW (Da)
5.91
ALogP
4
HBA
2
HBD
76.7
PSA (Ų)
0.23
QED
1
Ro5 Violations
17
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H41N2O4P
MW 440.57
Aromatic Rings 1
Heavy Atoms 30
NP-Likeness -0.34

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(01)80771-X Unchecked 1
- 10.1016/S0960-894X(01)80771-X Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine