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Small molecule Experimental

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Chemistry

Mol. Mass

337.38

ALogP

2.45

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCc1nc(-c2ccc3c(c2)CC[C@H]3NC(=O)c2cnn(C)c2)no1
  • InChIKey: IOVAZWDIRCRMTM-OAHLLOKOSA-N
    InChI=1S/C18H19N5O2/c1-3-16-21-17(22-25-16)12-4-6-14-11(8-12)5-7-15(14)20-18(24)13-9-19-23(2)10-13/h4,6,8-10,15H,3,5,7H2,1-2H3,(H,20,24)/t15-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4847050   ChEMBL
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