methylsamidorphan Report issue

Small molecule Experimental
AACT ChEMBL PubChem

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Chemistry

Mol. Mass

385.48

ALogP

1.4

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: C[N@+]1(CC2CC2)CC[C@]23CC(=O)CC[C@@]2(O)[C@H]1Cc1ccc(C(N)=O)c(O)c13
  • InChIKey: ATCVVCBJNHXIEX-ZAHKBLQYSA-O
    InChI=1S/C22H28N2O4/c1-24(12-13-2-3-13)9-8-21-11-15(25)6-7-22(21,28)17(24)10-14-4-5-16(20(23)27)19(26)18(14)21/h4-5,13,17,28H,2-3,6-12H2,1H3,(H2-,23,26,27)/p+1/t17-,21-,22-,24-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2364619   ChEMBL
methylsamidorphan

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