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Small molecule Experimental
AACT ChEMBL MeSH PubChem

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Chemistry

Mol. Mass

375.48

ALogP

3.17

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CN1CCN(CC1)c2cc(Nc3cc(C)[nH]n3)nc(\C=C\c4ccccc4)n2
  • InChIKey: BLQYVHBZHAISJM-CMDGGOBGSA-N
    InChI=1S/C21H25N7/c1-16-14-20(26-25-16)23-19-15-21(28-12-10-27(2)11-13-28)24-18(22-19)9-8-17-6-4-3-5-7-17/h3-9,14-15H,10-13H2,1-2H3,(H2,22,23,24,25,26)/b9-8+
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL482968   ChEMBL
enmd-2076

CHEMBL52885   ChEMBL
enmd-981693

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