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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1233147
CHEMBL1233147
Compound Name GUANOSINE TRIPHOSPHATE
ChEMBL Synonyms GTP | Guanosine Triphosphate
Max Phase 0
Trade Names
Molecular Formula C10H16N5O14P3

Additional synonyms for CHEMBL1233147 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES NC1=Nc2c(ncn2[C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@ ...
Download SMILES
Standard InChI InChI=1S/C10H16N5O14P3/c11-10-13-7-4(8(18)14-10)12-2-15(7)9- ...
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Standard InChI Key XKMLYUALXHKNFT-UUOKFMHZSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL1233147

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
523.2 522.9907 -2.34 8 299.1 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
14 8 3 19 9 3


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
.97 2.42 -4.53 -10.69 2 32 0.17

Structural Alerts

There are 9 structural alerts for CHEMBL1233147. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:XKMLYUALXHKNFT-UUOKFMHZSA-N
PubChem SID: 26756682

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1233147



ACToR 57608-35-2
Brenda 46618 5339 37 93579 53885 47547
ChEBI 15996
DrugBank DB04137
EPA CompTox Dashboard DTXSID30235328
FDA SRS 01WV7J708X
Guide to Pharmacology 1742
Human Metabolome Database HMDB0001273
IBM Patent System DB699F09A38DDB2C7D114259A83C0795 BF450C0D6D4F24CD31AB02C35248D7C5
KEGG Ligand C00044
Metabolights MTBLC15996
Nikkaji J40.055F
PDBe GTP
PubChem 6830
PubChem: Thomson Pharma 15036026
SureChEMBL SCHEMBL15900104 SCHEMBL44408
ZINC ZINC000060094177

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