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Small molecule Experimental
AACT ChEMBL DrugBank PubChem

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Chemistry

Mol. Mass

365.4

ALogP

2.22

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: COc1cccc(OCCCN)c1-c1cc(Nc2cnc(C#N)cn2)n[nH]1
  • InChIKey: DOTGPNHGTYJDEP-UHFFFAOYSA-N
    InChI=1S/C18H19N7O2/c1-26-14-4-2-5-15(27-7-3-6-19)18(14)13-8-16(25-24-13)23-17-11-21-12(9-20)10-22-17/h2,4-5,8,10-11H,3,6-7,19H2,1H3,(H2,22,23,24,25)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3544911   ChEMBL
prexasertib

CHEMBL3545377   ChEMBL
ly-2606368

Prexasertib   Wikipedia

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