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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL15768
CHEMBL15768
Compound Name
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula C10H16O

Additional synonyms for CHEMBL15768 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CC1(C)C2CCC1(C)C(=O)C2
Standard InChI InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H ...
Download InChI
Standard InChI Key DSSYKIVIOFKYAU-UHFFFAOYSA-N

Sources

  • PubChem BioAssays

Alternate Forms of Compound in ChEMBL


CHEMBL15768

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
152.2 152.1201 2.08 0 17.07 -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
1 0 0 1 0 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - 2.09 2.09 0 11 0.52

Structural Alerts

There are 1 structural alerts for CHEMBL15768. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:DSSYKIVIOFKYAU-UHFFFAOYSA-N
PubChem SID: 144207435
Wikipedia Camphor

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL15768



ACToR 464-49-3 464-48-2 21368-68-3 76-22-2
Brenda 10609
ChEBI 36773
DrugCentral 470
eMolecules 711328 925036
EPA CompTox Dashboard DTXSID5030955
Guide to Pharmacology 2422
IBM Patent System 7B2AF9250D4D332B8501EBBA5C2AE713
KEGG Ligand C18369 C00809
LipidMaps LMPR0102120001
Mcule MCULE-2476865084
Metabolights MTBLC36773
MolPort MolPort-002-506-944
Nikkaji J4.364H
NMRShiftDB 20253146
PubChem 2537
PubChem: Thomson Pharma 15146886
SureChEMBL SCHEMBL16068

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