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| Ligand Name: D-phenylalanyl-N-[(2S,3S)-6-{[amino(iminio)methyl]amino}-1-chloro-2-oxohexan-3-yl]-L-prolinamide |
| Ligand Type: peptide-like |
| Ligand ID: COVPDB17 |
PubChem:
5311176
|
Synonym(s):
- ppack
- d-phe-pro-age-cmk
- unii-n62ul02ww4
- chembl307440
- n62ul02ww4
- (s)-1-((r)-2-amino-3-phenylpropanoyl)-n-((s)-1-chloro-6-guanidino-2-oxohexan-3-yl)pyrrolidine-2-carboxamide
- (s)-1-(d-phenylalanyl)-n-((s)-1-chloro-6-guanidino-2-oxohexan-3-yl)pyrrolidine-2-carboxamide
- d-phe-pro-arg ch2cl
- phe-pro-arg-methyl chloride
- d-phe-pro-arg-chloromethylketone
- d-phe-pro-argch2cl
- phenylalanyl-prolyl-arginine methyl chloride
- d-phenylalanine-proline-arginine methyl chloride
- phe-pro-arg-chloromethylketone
- bdbm50287780
- zinc26376363
- ccg-207868
- l-prolinamide, d-phenylalanyl-n-(4-((aminoiminomethyl)amino)-1-(chloroacetyl)butyl)-, (s)-
- (2s)-1-[(2r)-2-amino-3-phenylpropanoyl]-n-[(3s)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide
- d-phe-pro-arg chloromethylketone (ppack)
- d-phenylalanyl-prolyl-arginyl chloromethane
- (s)-1-((r)-2-amino-3-phenyl-propionyl)-pyrrolidine-2-carboxylic acid [(s)-1-(2-chloro-acetyl)-4-guanidino-butyl]-amide
show 21 synonym(s)
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| DrugBank: - |
ChEMBL: CHEMBL307440 |
| Canonical SMILES: N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)CCl |
| Standard InChI: InChI=1S/C21H31ClN6O3/c22-13-18(29)16(8-4-10-26-21(24)25)27-19(30)17-9-5-11-28(17)20(31)15(23)12-14-6-2-1-3-7-14/h1-3,6-7,15-17H,4-5,8-13,23H2,(H,27,30)(H4,24,25,26)/t15-,16+,17+/m1/s1 |
| Molecular Formula: C21H31ClN6O3 |
Mol. Weight: 450.21463 |
logP: 0.10337 |
| HBD: 5 | HBA: 5 |
| #Rotatable Bonds: 11 | TPSA: 154.4 |