Ligand |
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Ligand Name: MOR-LEU-HPQ | ||
Ligand Type: peptide-like | ||
Ligand ID: COVPDB19 | PubChem: - | |
Synonym(s): - | ||
DrugBank: - | ChEMBL: - | |
Canonical SMILES: CC(C)[C@H](NC(=O)CCC(O)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](CCCCN)P(=O)(Oc1ccccc1)Oc1ccccc1 | ||
Standard InChI: InChI=1S/C31H43N4O8P/c1-22(2)29(33-26(36)18-19-28(37)38)31(40)35-21-11-16-25(35)30(39)34-27(17-9-10-20-32)44(41,42-23-12-5-3-6-13-23)43-24-14-7-4-8-15-24/h3-8,12-15,22,25,27,29H,9-11,16-21,32H2,1-2H3,(H,33,36)(H,34,39)(H,37,38)/t25-,27-,29-/m0/s1 | ||
Molecular Formula: C31H43N4O8P | Mol. Weight: 630.28186 | logP: 3.9054 |
HBD: 4 | HBA: 8 | |
#Rotatable Bonds: 17 | TPSA: 177.36 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | HET Code | Binding Affinity | Binding Database | Complex Card |
Cathepsin G | P08311 (CATG_HUMAN) | Homo sapiens (Human) | 1AU8 | 0H8 |
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