Ligand
Ligand Name:   Delanzomib
Ligand Type:   non-polymer
Ligand ID:   COVPDB328 PubChem:   124645820
Synonym(s):  
  •   zinc206676736
DrugBank:   - ChEMBL:   -
Canonical SMILES:   CC(C)C[C@@H](B(O)O)NC(=O)[C@H]([C@H](C)O)NC(=O)c1cccc(n1)-c2ccccc2
Standard InChI:   InChI=1S/C21H28BN3O5/c1-13(2)12-18(22(29)30)24-21(28)19(14(3)26)25-20(27)17-11-7-10-16(23-17)15-8-5-4-6-9-15/h4-11,13-14,18-19,26,29-30H,12H2,1-3H3,(H,24,28)(H,25,27)/t14-,18-,19-/m0/s1
Molecular Formula:   C21H28BN3O5 Mol. Weight:   413.2122 logP:   0.7707
HBD:   5 HBA:   6
#Rotatable Bonds:   9 TPSA:   131.78

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Proteasome subunit beta type-6 P28072 (PSB6_HUMAN) Homo sapiens (Human) 5LF4 6V7
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