Ligand
Ligand Name:   N3-APAL-ep
Ligand Type:   peptide-like
Ligand ID:   COVPDB8 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   [N-]=[N+]=NCC(=O)N[C@@H](C)C(=O)N1[C@@H](CCC1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)[C@]2(C)CO2
Standard InChI:   InChI=1S/C22H35N7O6/c1-12(2)9-15(18(31)22(5)11-35-22)27-19(32)13(3)26-20(33)16-7-6-8-29(16)21(34)14(4)25-17(30)10-24-28-23/h12-16H,6-11H2,1-5H3,(H,25,30)(H,26,33)(H,27,32)/t13-,14-,15-,16-,22-/m0/s1
Molecular Formula:   C22H35N7O6 Mol. Weight:   493.2649 logP:   0.186
HBD:   3 HBA:   7
#Rotatable Bonds:   12 TPSA:   185.97

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) 4Y8H 05W
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