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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1161865
CHEMBL1161865
Compound Name ADENOSINE DIPHOSPHATE RIBOSE
ChEMBL Synonyms ADP-ribose
Max Phase 0
Trade Names
Molecular Formula C15H23N5O14P2

Additional synonyms for CHEMBL1161865 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Nc1ncnc2c1ncn2[C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OCC4OC(O)[C@H ...
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Standard InChI InChI=1S/C15H23N5O14P2/c16-12-7-13(18-3-17-12)20(4-19-7)14-1 ...
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Standard InChI Key SRNWOUGRCWSEMX-VIKJUHFYSA-N

Alternate Forms of Compound in ChEMBL


CHEMBL1161865

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
559.3 559.0717 -3.85 9 311.14 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
18 8 3 19 9 2


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
1.13 3.82 -3.65 -8.15 2 36 0.14

Structural Alerts

There are 11 structural alerts for CHEMBL1161865. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:SRNWOUGRCWSEMX-VIKJUHFYSA-N
Wikipedia Adenosine_diphosphate_ribose

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1161865



PubChem 44415180

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