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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL3184191
CHEMBL3184191
Compound Name
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula BaCl2

Additional synonyms for CHEMBL3184191 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [Cl-].[Cl-].[Ba+2]
Standard InChI InChI=1S/Ba.2ClH/h;2*1H/q+2;;/p-2
Standard InChI Key WDIHJSXYQDMJHN-UHFFFAOYSA-L

Sources

  • PubChem BioAssays

Alternate Forms of Compound in ChEMBL


CHEMBL3184191

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
208.2 207.843 - - - -


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 CHEMBL3184191

Compound Cross References

ChemSpider ChemSpider:WDIHJSXYQDMJHN-UHFFFAOYSA-L
PubChem SID: 144211332

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL3184191



ACToR 10361-37-2
Brenda 1275 210447
ChEBI 63317
ChemicalBook CB8398703
eMolecules 881000 475349
EPA CompTox Dashboard DTXSID7044508
FDA SRS 0VK51DA1T2
MolPort MolPort-006-109-671
Nikkaji J43.686K
PubChem 25204 5360350
PubChem: Thomson Pharma 15488148 16082430
SureChEMBL SCHEMBL24274

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