piperaquine Report issue

Small molecule Experimental
AACT ChEMBL Drug Central MeSH PubChem

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Chemistry

Mol. Mass

927.5

ALogP

5.42

Rule of 5

No

Rule of 3

No
Details
  • SMILES: OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O.Clc1ccc2c(ccnc2c1)N3CCN(CCCN4CCN(CC4)c5ccnc6cc(Cl)ccc56)CC3
  • InChIKey: OAKKJVUSSVZQRF-UHFFFAOYSA-N
    InChI=1S/C29H32Cl2N6.4H3O4P/c30-22-2-4-24-26(20-22)32-8-6-28(24)36-16-12-34(13-17-36)10-1-11-35-14-18-37(19-15-35)29-7-9-33-27-21-23(31)3-5-25(27)29;4*1-5(2,3)4/h2-9,20-21H,1,10-19H2;4*(H3,1,2,3,4)
  • Chirality: None
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1652442   ChEMBL
piperaquine tetraphosphate

CHEMBL303933   ChEMBL
piperaquine

CHEMBL539666   ChEMBL
piperaquine phosphate

Piperaquine   Wikipedia

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