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Chemistry

Mol. Mass

534.57

ALogP

4.49

Rule of 5

No

Rule of 3

No
Details
  • SMILES: N[C@H]1[C@@H](CC[C@@H](OC(=O)N2CCC(CC2)N3C(=O)Nc4ncccc34)c5ncccc15)c6cccc(F)c6F
  • InChIKey: KRNAOFGYEFKHPB-ANJVHQHFSA-N
    InChI=1S/C28H28F2N6O3/c29-20-6-1-4-17(23(20)30)18-8-9-22(25-19(24(18)31)5-2-12-32-25)39-28(38)35-14-10-16(11-15-35)36-21-7-3-13-33-26(21)34-27(36)37/h1-7,12-13,16,18,22,24H,8-11,14-15,31H2,(H,33,34,37)/t18-,22+,24-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2178422   ChEMBL
rimegepant

Rimegepant   Wikipedia

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