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Small molecule Experimental

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Chemistry

Mol. Mass

474.61

ALogP

3.5

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CC(C)N1CCN(c2ccc(Nc3ncc4cc5n(c4n3)C3(CCCCC3)CNC5=O)nc2)CC1
  • InChIKey: YPJRHEKCFKOVRT-UHFFFAOYSA-N
    InChI=1S/C26H34N8O/c1-18(2)32-10-12-33(13-11-32)20-6-7-22(27-16-20)30-25-28-15-19-14-21-24(35)29-17-26(8-4-3-5-9-26)34(21)23(19)31-25/h6-7,14-16,18H,3-5,8-13,17H2,1-2H3,(H,29,35)(H,27,28,30,31)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3904602   ChEMBL
lerociclib

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