elimusertib Report issue

Small molecule Experimental
AACT PubChem

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Chemistry

Mol. Mass

375.44

ALogP

2.65

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: C[C@@H]1COCCN1c1cc(-c2ccnn2C)c2ccnc(-c3ccn[nH]3)c2n1
  • InChIKey: YBXRSCXGRPSTMW-CYBMUJFWSA-N
    InChI=1S/C20H21N7O/c1-13-12-28-10-9-27(13)18-11-15(17-5-8-23-26(17)2)14-3-6-21-20(19(14)24-18)16-4-7-22-25-16/h3-8,11,13H,9-10,12H2,1-2H3,(H,22,25)/t13-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4647810   ChEMBL
elimusertib

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