Ligand
Ligand Name:   BCL-1-(S)
Ligand Type:   non-polymer
Ligand ID:   COVPDB140 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   [O-][N+](=O)c1ccc(cc1)O[P@@](=O)(CCCCCC)OC[C@@H](C)Cc2ccccc2
Standard InChI:   InChI=1S/C22H30NO5P/c1-3-4-5-9-16-29(26,28-22-14-12-21(13-15-22)23(24)25)27-18-19(2)17-20-10-7-6-8-11-20/h6-8,10-15,19H,3-5,9,16-18H2,1-2H3/t19-,29+/m0/s1
Molecular Formula:   C22H30NO5P Mol. Weight:   419.18616 logP:   6.6424
HBD:   0 HBA:   5
#Rotatable Bonds:   13 TPSA:   78.67

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Triacylglycerol lipase P22088 (LIP_BURCE) Burkholderia cepacia (Pseudomonas cepacia) 1YS2 2HS
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