ChEMBL logo

ChEMBL

spacer
ChEMBL Statistics
  Loading Statistics...
spacer

Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1567463
CHEMBL1567463
Compound Name CHOLINE ALFOSCERATE
ChEMBL Synonyms Choline Glycerophosphate | Choline Alfoscerate
Max Phase 0
Trade Names
Molecular Formula C8H20NO6P

Additional synonyms for CHEMBL1567463 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES C[N+](C)(C)CCOP(=O)([O-])OC[C@H](O)CO
Standard InChI InChI=1S/C8H20NO6P/c1-9(2,3)4-5-14-16(12,13)15-7-8(11)6-10/h ...
Download InChI
Standard InChI Key SUHOQUVVVLNYQR-MRVPVSSYSA-N

Molecule Features

CHEMBL1567463 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Racemic Mixture Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Clinical Data

Number of clinical trials registered at clinicaltrials.gov
Number of reviews at The Cochrane Collaboration
Number of entries at British National Formulary

Structural Alerts

There are 5 structural alerts for CHEMBL1567463. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL1567463

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
257.2 257.1028 -4.13 8 108.86 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
6 2 0 7 2 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
1.21 - -5.4 -4.8 0 16 0.34

Compound Cross References

ATC N - NERVOUS SYSTEM
N07 - OTHER NERVOUS SYSTEM DRUGS
N07A - PARASYMPATHOMIMETICS
N07AX - Other parasympathomimetics
N07AX02 - choline alfoscerate

ChemSpider ChemSpider:SUHOQUVVVLNYQR-MRVPVSSYSA-N
PubChem SID: 855725
Wikipedia Alpha-GPC

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1567463



ACToR 28319-77-9
ChEBI 16870
FDA SRS 60M22SGW66
MolPort MolPort-006-666-494
PubChem 657272
PubChem: Thomson Pharma 14823632
Recon g3pc
SureChEMBL SCHEMBL63754
ZINC ZINC01532714

UniChem REST Service Call: https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/SUHOQUVVVLNYQR-MRVPVSSYSA-N spacer
spacer