rocuronium (zemuron) Report issue

Small molecule Approved FDA
AACT ChEMBL DrugBank Drug Central Drugs@FDA KEGG MeSH PubChem

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Chemistry

Mol. Mass

529.79

ALogP

4.41

Rule of 5

No

Rule of 3

No
Details
  • SMILES: CC(=O)O[C@H]1[C@H](C[C@H]2[C@@H]3CC[C@H]4C[C@H](O)[C@H](C[C@]4(C)[C@H]3CC[C@]12C)N5CCOCC5)[N+]6(CC=C)CCCC6
  • InChIKey: YXRDKMPIGHSVRX-OOJCLDBCSA-N
    InChI=1S/C32H53N2O4/c1-5-14-34(15-6-7-16-34)28-20-26-24-9-8-23-19-29(36)27(33-12-17-37-18-13-33)21-32(23,4)25(24)10-11-31(26,3)30(28)38-22(2)35/h5,23-30,36H,1,6-21H2,2-4H3/q+1/t23-,24+,25-,26-,27-,28-,29-,30-,31-,32-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1201244   ChEMBL
rocuronium *

CHEMBL1200648   ChEMBL
rocuronium bromide

WRE554RFEZ   NCATS
rocuronium *

National Basketball Association   Wikipedia

Rocuronium bromide   Wikipedia

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