Ligand
Ligand Name:   C6Z inhibitor
Ligand Type:   peptide-like
Ligand ID:   COVPDB28 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(=O)N[C@@H](CCC(N)=O)C#N
Standard InChI:   InChI=1S/C19H34N6O4/c1-10(2)8-14(18(28)23-13(9-20)6-7-15(22)26)24-19(29)16(11(3)4)25-17(27)12(5)21/h10-14,16H,6-8,21H2,1-5H3,(H2,22,26)(H,23,28)(H,24,29)(H,25,27)/t12-,13-,14-,16-/m0/s1
Molecular Formula:   C19H34N6O4 Mol. Weight:   410.26416 logP:   -0.72082
HBD:   5 HBA:   6
#Rotatable Bonds:   12 TPSA:   180.2

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Replicase polyprotein 1a P0C6U8 (R1A_SARS) Severe acute respiratory syndrome coronavirus (SARS-CoV) 3VB6 0JU
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