imatinib (gleevec) Report issue

Small molecule Orphan Drug FDA Approved FDA Fast Track FDA Accelerated Approval FDA Priority Review FDA
AACT ChEMBL DrugBank Drug Central Drugs@FDA KEGG MeSH PubChem repoDB

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Chemistry

Mol. Mass

493.62

ALogP

4.59

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
  • InChIKey: KTUFNOKKBVMGRW-UHFFFAOYSA-N
    InChI=1S/C29H31N7O/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36-16-14-35(2)15-17-36/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL941   ChEMBL
imatinib *

CHEMBL1642   ChEMBL
imatinib mesylate

CHEMBL5314918   ChEMBL
ikt-001pro

BKJ8M8G5HI   NCATS
imatinib *

Imatinib   Wikipedia

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