SODIUM GLYCIDIDAZOLE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 5YV419FIJS

Structure
InChI Key FWYUJENICVGSJH-UHFFFAOYSA-M
Smile Cc1ncc([N+](=O)[O-])n1CCOC(=O)CN(CC(=O)[O-])CC(=O)OCCn1c([N+](=O)[O-])cnc1C.[Na+]
InChI
InChI=1S/C18H23N7O10.Na/c1-12-19-7-14(24(30)31)22(12)3-5-34-17(28)10-21(9-16(26)27)11-18(29)35-6-4-23-13(2)20-8-15(23)25(32)33;/h7-8H,3-6,9-11H2,1-2H3,(H,26,27);/q;+1/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H22N7NaO10
Molecular Weight 519.4
AlogP -0.31
Hydrogen Bond Acceptor 14.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 14.0
Polar Surface Area 215.06
Molecular species ACID
Aromatic Rings 2.0
Heavy Atoms 35.0

Indications

Mesh Heading Maximum Phase Reference
Esophageal Neoplasms Phase 2 ClinicalTrials
Carcinoma; Carcinoma, Squamous Cell; Esophageal Neoplasms Phase 4 ClinicalTrials
Esophageal Neoplasms Phase 2 ClinicalTrials
Esophageal Neoplasms Phase 2 ClinicalTrials

Related Entries

MCS

Cross References

Resources Reference
ChEMBL CHEMBL4297660
EPA CompTox DTXSID60432742
FDA SRS 5YV419FIJS
PubChem 9914614
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