paliperidone (invega) Report issue

Small molecule Approved FDA
AACT ChEMBL DrugBank Drug Central Drugs@FDA KEGG MeSH PubChem repoDB

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Chemistry

Mol. Mass

664.91

ALogP

9.11

Rule of 5

No

Rule of 3

No
Details
  • SMILES: CCCCCCCCCCCCCCCC(=O)OC1CCCN2C(=O)C(=C(C)N=C12)CCN3CCC(CC3)c4noc5cc(F)ccc45
  • InChIKey: VOMKSBFLAZZBOW-UHFFFAOYSA-N
    InChI=1S/C39H57FN4O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-36(45)47-34-17-16-24-44-38(34)41-29(2)32(39(44)46)23-27-43-25-21-30(22-26-43)37-33-20-19-31(40)28-35(33)48-42-37/h19-20,28,30,34H,3-18,21-27H2,1-2H3
  • Chirality: Racemic Mixture
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2107360   ChEMBL
paliperidone palmitate *

CHEMBL1201732   ChEMBL

CHEMBL1621   ChEMBL
paliperidone

838F01T721   NCATS
paliperidone *

Paliperidone   Wikipedia

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