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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL3183103
CHEMBL3183103
Compound Name
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula Cl3OP

Additional synonyms for CHEMBL3183103 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES ClP(=O)(Cl)Cl
Standard InChI InChI=1S/Cl3OP/c1-5(2,3)4
Standard InChI Key XHXFXVLFKHQFAL-UHFFFAOYSA-N

Sources

  • PubChem BioAssays

Alternate Forms of Compound in ChEMBL


CHEMBL3183103

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
153.3 151.8752 2.81 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
- - .36 .36 0 5 0.49

Structural Alerts

There are 8 structural alerts for CHEMBL3183103. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:XHXFXVLFKHQFAL-UHFFFAOYSA-N
PubChem SID: 144208012

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL3183103



ACToR 10025-87-3
ChEBI 30336
ChemicalBook CB5218244
eMolecules 475932
EPA CompTox Dashboard DTXSID5029710
FDA SRS 9XM78OL22K
Human Metabolome Database HMDB0034789
Nikkaji J95.147A
PubChem 24813
PubChem: Thomson Pharma 14793882
SureChEMBL SCHEMBL98
ZINC ZINC000245224492

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