Ligand

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Ligand Name:   DECYLAMINE-N,N-DIMETHYL-N-OXIDE
HET ID:   DDQ PubChem:   62452
DrugBank:   DB02613 ChEMBL:   CHEMBL1232157
Canonical SMILES:   CCCCCCCCCC[N+](C)(C)[O-]
Standard InChI:   InChI=1S/C12H27NO/c1-4-5-6-7-8-9-10-11-12-13(2,3)14/h4-12H2,1-3H3
Molecular Formula:   C12H27NO Mol. Weight:   201.34888 Heavy Atoms:   14
Charge:   0 Is Chiral:   False logP:   3.7222
HBD:   0 HBA:   1 TPSA:   29.43
#Bonds:   13 #Rotatable Bonds:   9 Shape Complexity:   1.0
Stereocomplexity:   0.0
Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID Binding Affinity Binding Database Complex Card
Autolysin P06653 (ALYS_STRPN) Streptococcus pneumoniae serotype 4 1GVM
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