alogabat Report issue

Small molecule Experimental

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Chemistry

Mol. Mass

409.45

ALogP

2.63

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: Cc1ccc(-c2noc(C)c2COc2ccc(C(=O)NC3CCOCC3)nn2)cn1
  • InChIKey: ACZCJTHHWMBFKC-UHFFFAOYSA-N
    InChI=1S/C21H23N5O4/c1-13-3-4-15(11-22-13)20-17(14(2)30-26-20)12-29-19-6-5-18(24-25-19)21(27)23-16-7-9-28-10-8-16/h3-6,11,16H,7-10,12H2,1-2H3,(H,23,27)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL5095259   ChEMBL
alogabat

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