trimetrexate (neutrexin) Report issue

Small molecule Orphan Drug FDA Approved FDA Priority Review FDA

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Chemistry

Mol. Mass

369.43

ALogP

2.74

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: COc1cc(NCc2ccc3nc(N)nc(N)c3c2C)cc(OC)c1OC
  • InChIKey: NOYPYLRCIDNJJB-UHFFFAOYSA-N
    InChI=1S/C19H23N5O3/c1-10-11(5-6-13-16(10)18(20)24-19(21)23-13)9-22-12-7-14(25-2)17(27-4)15(8-12)26-3/h5-8,22H,9H2,1-4H3,(H4,20,21,23,24)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL119   ChEMBL
trimetrexate *

CHEMBL2218878   ChEMBL
trimetrexate glucuronate

UPN4ITI8T4   NCATS
trimetrexate *

Trimetrexate   Wikipedia

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