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Compound Detail

CHEMBL2219615

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CCCCCCCCCCCCCCCCCCOP(=O)([O-])OC1CC[N+]2(CCCC2)CC1

Basic Information

ChEMBL ID CHEMBL2219615
Phase Preclinical
Structure Type MOL
InChI Key JPJJLQSITIBTOK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

487.7
MW (Da)
7.52
ALogP
4
HBA
0
HBD
58.6
PSA (Ų)
0.10
QED
1
Ro5 Violations
20
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H54NO4P
MW 487.71
Aromatic Rings 0
Heavy Atoms 33
NP-Likeness 0.29

Data from ChEMBL 36 via Core Engine