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Ac-GKG-NH2 | SBID = 2003 | Compound | Custom Molecule

Struc Structure

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Molecular Properties

Interactions: 1
PubChem TPSA/Å2:
Ertl TPSA/Å2:
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3):
Charge: 1.0
Number of H-Bond Donors: 6.0
Number of H-Bond Acceptors: 8.0
Number of Stereogenic Bonds (E/Z):
Number of Stereogenic Atoms (R/S):
3D Volume/Å3:
Sum Formula: C12H24N5O4+
M / g/mol: 302.35006
Complexity:
Number of Conformers:

Identifiers

  • Tags:
  • Name: Ac-GKG-NH2
  • Preferred Abbreviation: Ac-GKG-NH2
  • IUPAC Name:
  • CAS:
  • CID: -856
  • InChiKey: ABLUAJVSWXIBRT-UHFFFAOYSA-O
  • InChi: InChI=1S/C12H23N5O4/c1-8(18)15-7-11(20)17-9(4-2-3-5-13)12(21)16-6-10(14)19/h9H,2-7,13H2,1H3,(H2,14,19)(H,15,18)(H,16,21)(H,17,20)/p+1
  • CanoSmiles: [NH3+]CCCCC(C(=O)NCC(=O)N)NC(=O)CNC(=O)C
  • IsoSmiles: CC(NCC(NC(CCCC[NH3+])C(NCC(N)=O)=O)=O)=O