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Chemistry

Mol. Mass

294.36

ALogP

2.41

Rule of 5

Yes

Rule of 3

Yes
Details
  • SMILES: Cc1[nH]cnc1CN2CCc3c(C2=O)c4ccccc4n3C
  • InChIKey: JSWZEAMFRNKZNL-UHFFFAOYSA-N
    InChI=1S/C17H18N4O/c1-11-13(19-10-18-11)9-21-8-7-15-16(17(21)22)12-5-3-4-6-14(12)20(15)2/h3-6,10H,7-9H2,1-2H3,(H,18,19)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1110   ChEMBL
alosetron *

CHEMBL1200885   ChEMBL
alosetron hydrochloride

CHEMBL628   ChEMBL
pentoxifylline

13Z9HTH115   NCATS
alosetron *

Alosetron   Wikipedia

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