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Small molecule Experimental
AACT ChEMBL PubChem

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Chemistry

Mol. Mass

440.87

ALogP

3.16

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: Cn1nccc1Nc1nccc(-c2ccn([C@H](CO)c3ccc(Cl)c(F)c3)c(=O)c2)n1
  • InChIKey: RZUOCXOYPYGSKL-GOSISDBHSA-N
    InChI=1S/C21H18ClFN6O2/c1-28-19(5-8-25-28)27-21-24-7-4-17(26-21)13-6-9-29(20(31)11-13)18(12-30)14-2-3-15(22)16(23)10-14/h2-11,18,30H,12H2,1H3,(H,24,26,27)/t18-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3544964   ChEMBL
ravoxertinib

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