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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL413376
CHEMBL413376
Compound Name SURAMIN HEXASODIUM
ChEMBL Synonyms NAPHURIDE | SURAMIN HEXASODIUM | Moranyl | Naganal | CI-1003 | Suramin Sodium | Antrypol
Max Phase 3
Trade Names
Molecular Formula C51H34N6Na6O23S6

Additional synonyms for CHEMBL413376 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [Na+].[Na+].[Na+].[Na+].[Na+].[Na+].Cc1ccc(cc1NC(=O)c2cccc(N ...
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Standard InChI InChI=1S/C51H40N6O23S6.6Na/c1-25-9-11-29(49(60)54-37-13-15-4 ...
Download InChI
Standard InChI Key VAPNKLKDKUDFHK-UHFFFAOYSA-H

Alternate Forms of Compound in ChEMBL


CHEMBL413376

Molecule Features

CHEMBL413376 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:N First In Class:N Chirality:Achiral Molecule Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Indications

MESH Heading MESH ID EFO ID EFO Term Max phase for indication
CHILD DEVELOPMENT DISORDERS, PERVASIVED002659EFO:0003756AUTISM SPECTRUM DISORDER1
LEISHMANIASISD007896EFO:0005044LEISHMANIASIS4
PROSTATIC NEOPLASMSD011471EFO:0001663PROSTATE CARCINOMA3
TRYPANOSOMIASISD014352DOID:10113TRYPANOSOMIASIS4

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
1297.3 1296.0469 - - - -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
- - - - - -


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - - - - - -0

Structural Alerts

There are no structural alerts for CHEMBL413376

Compound Cross References

ATC P - ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
P01 - ANTIPROTOZOALS
P01C - AGENTS AGAINST LEISHMANIASIS AND TRYPANOSOMIASIS
P01CX - Other agents against leishmaniasis and trypanosomiasis
P01CX02 - suramin sodium

ChemSpider ChemSpider:VAPNKLKDKUDFHK-UHFFFAOYSA-H
PubChem SID: 11112082 SID: 124881892 SID: 26747683 SID: 26753666 SID: 85231329

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL413376



eMolecules 531755
EPA CompTox Dashboard DTXSID30156024
FDA SRS 89521262IH
MolPort MolPort-003-665-583
Nikkaji J166.125F
PubChem 101303499 5360 8514
PubChem: Drugs of the Future 12013770
PubChem: Thomson Pharma 14866441
SureChEMBL SCHEMBL414636

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/VAPNKLKDKUDFHK-UHFFFAOYSA-H spacer
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