CITICOLINE SODIUM

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 7XQ5AKD9YD

Structure
InChI Key YWAFNFGRBBBSPD-OCMLZEEQSA-M
Smile C[N+](C)(C)CCOP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@H](O)[C@@H]1O.[Na+]
InChI
InChI=1S/C14H26N4O11P2.Na/c1-18(2,3)6-7-26-30(22,23)29-31(24,25)27-8-9-11(19)12(20)13(28-9)17-5-4-10(15)16-14(17)21;/h4-5,9,11-13,19-20H,6-8H2,1-3H3,(H3-,15,16,21,22,23,24,25);/q;+1/p-1/t9-,11-,12-,13-;/m1./s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H25N4NaO11P2
Molecular Weight 510.31
AlogP -2.23
Hydrogen Bond Acceptor 13.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 10.0
Polar Surface Area 215.72
Molecular species ACID
Aromatic Rings 1.0
Heavy Atoms 31.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Amphetamine-Related Disorders 3 D019969 ClinicalTrials
Substance-Related Disorders 2 D019966 ClinicalTrials
Schizophrenia 2 D012559 ClinicalTrials
Brain Injuries 2 D001930 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL1256994
EPA CompTox DTXSID4048981
FDA SRS 7XQ5AKD9YD
PubChem 36605
SureChEMBL SCHEMBL667104
CONTENTS