Ligand |
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Ligand Name: Ac-APLL-ep | ||
Ligand Type: peptide-like | ||
Ligand ID: COVPDB7 | PubChem: - | |
Synonym(s): - | ||
DrugBank: - | ChEMBL: - | |
Canonical SMILES: O=C(C)N[C@@H](C)C(=O)N1[C@@H](CCC1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)[C@]2(C)CO2 | ||
Standard InChI: InChI=1S/C25H42N4O6/c1-14(2)11-18(21(31)25(7)13-35-25)27-22(32)19(12-15(3)4)28-23(33)20-9-8-10-29(20)24(34)16(5)26-17(6)30/h14-16,18-20H,8-13H2,1-7H3,(H,26,30)(H,27,32)(H,28,33)/t16-,18-,19-,20-,25-/m0/s1 | ||
Molecular Formula: C25H42N4O6 | Mol. Weight: 494.31042 | logP: 0.9218 |
HBD: 3 | HBA: 6 | |
#Rotatable Bonds: 12 | TPSA: 137.21 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | HET Code | Binding Affinity | Binding Database | Complex Card |
Proteasome subunit beta type-5 | P30656 (PSB5_YEAST) | Saccharomyces cerevisiae (strain ATCC 204508 / S288c) (Baker's yeast) | 4Y8L | 05W |
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