desvenlafaxine (pristiq) Report issue

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

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Chemistry

Mol. Mass

397.47

ALogP

2.73

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CN(C)CC(c1ccc(O)cc1)C1(O)CCCCC1.O.O=C(O)/C=C/C(=O)O
  • InChIKey: YETWCSLOYUZBLK-JITBQSAISA-N
    InChI=1S/C16H25NO2.C4H4O4.H2O/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16;5-3(6)1-2-4(7)8;/h6-9,15,18-19H,3-5,10-12H2,1-2H3;1-2H,(H,5,6)(H,7,8);1H2/b;2-1+;
  • Chirality: Racemic Mixture
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3989861   ChEMBL
desvenlafaxine fumarate *

CHEMBL1118   ChEMBL
desvenlafaxine

CHEMBL1201728   ChEMBL
desvenlafaxine succinate

CHEMBL3039565   ChEMBL

NG99554ANW   NCATS
desvenlafaxine *

Desvenlafaxine   Wikipedia

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