(S)-Glycinyl-(S)-argininyl-(S)-glycinyl-(S)-glycine | SBID = 2167 | Compound | Custom Molecule

Struc Structure

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Molecular Properties

Interactions: 1
PubChem TPSA/Å2:
Ertl TPSA/Å2: 212.52
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3): -4.9
Charge: 0.0
Number of H-Bond Donors: 0.0
Number of H-Bond Acceptors: 0.0
Number of Stereogenic Bonds (E/Z):
Number of Stereogenic Atoms (R/S):
3D Volume/Å3:
Sum Formula: C12H23N7O5
M / g/mol: 345.35492
Complexity:
Number of Conformers:

Identifiers

  • Tags:
  • Name: (S)-Glycinyl-(S)-argininyl-(S)-glycinyl-(S)-glycine
  • Preferred Abbreviation: GRGG
  • IUPAC Name:
  • CAS:
  • CID: -953
  • InChiKey: JVZFLXJZSIBFED-UHFFFAOYSA-N
  • InChi: InChI=1S/C12H23N7O5/c13-4-8(20)19-7(2-1-3-16-12(14)15)11(24)18-5-9(21)17-6-10(22)23/h7H,1-6,13H2,(H,17,21)(H,18,24)(H,19,20)(H,22,23)(H4,14,15,16)
  • CanoSmiles: NCC(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)CCCNC(=N)N
  • IsoSmiles: O=C(O)CNC(CNC([C@H](CCCNC(N)=N)NC(CN)=O)=O)=O