conivaptan (vaprisol) Report issue

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

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Chemistry

Mol. Mass

498.59

ALogP

6.51

Rule of 5

No

Rule of 3

No
Details
  • SMILES: Cc1nc2c([nH]1)-c1ccccc1N(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)CC2
  • InChIKey: IKENVDNFQMCRTR-UHFFFAOYSA-N
    InChI=1S/C32H26N4O2/c1-21-33-28-19-20-36(29-14-8-7-13-27(29)30(28)34-21)32(38)23-15-17-24(18-16-23)35-31(37)26-12-6-5-11-25(26)22-9-3-2-4-10-22/h2-18H,19-20H2,1H3,(H,33,34)(H,35,37)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1755   ChEMBL
conivaptan *

CHEMBL1201108   ChEMBL
conivaptan hydrochloride

0NJ98Y462X   NCATS
conivaptan *

Conivaptan   Wikipedia

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