MID/PRD_000451

N(alpha)-(2-naphthylsulfonylglycyl)-4-amidinophenylalanine piperidide

MID/PRD_000451 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).

The representative PDB ID is 1PPC.

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Chemical Component Summary

NameN(alpha)-(2-naphthylsulfonylglycyl)-4-amidinophenylalanine piperidide
SynonymsNAPAP
IdentifiersN-[(2R)-3-(4-carbamimidoylphenyl)-1-oxo-1-piperidin-1-yl-propan-2-yl]-2-(naphthalen-2-ylsulfonylamino)ethanamide
FormulaC27 H31 N5 O4 S
Molecular Weight521.631
TypePEPTIDE-LIKE
Isomeric SMILES[H]/N=C(/c1ccc(cc1)C[C@H](C(=O)N2CCCCC2)NC(=O)CNS(=O)(=O)c3ccc4ccccc4c3)\N
InChIInChI=1S/C27H31N5O4S/c28-26(29)21-10-8-19(9-11-21)16-24(27(34)32-14-4-1-5-15-32)31-25(33)18-30-37(35,36)23-13-12-20-6-2-3-7-22(20)17-23/h2-3,6-13,17,24,30H,1,4-5,14-16,18H2,(H3,28,29)(H,31,33)/t24-/m1/s1
InChIKeyXXTWZTPVNIYSJZ-XMMPIXPASA-N
CompositionPolymer Sequences: NAS-GLY-APH-PIP
BIRD classINHIBITOR
Represented AsSINGLE MOLECULE
Compound Detailsn/a
Descriptionn/a

Chemical Details

Formal Charge0
Atom Count68
Chiral Atom Count1
Bond Count71
Aromatic Bond Count17

Related Resource References

Resource NameReference
Pharos CHEMBL51173
PubChem 445157
ChEMBL CHEMBL51173