Ligand
Ligand Name:   (1S)-1-[(2-{[2-(dimethylamino)ethyl]disulfanyl}ethyl)amino]-2,2-diphenylpropan-1-ol
Ligand Type:   non-polymer
Ligand ID:   COVPDB843 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   CN(C)CCSSCCNC(=O)C(C)(c1ccccc1)c1ccccc1
Standard InChI:   InChI=1S/C21H28N2OS2/c1-21(18-10-6-4-7-11-18,19-12-8-5-9-13-19)20(24)22-14-16-25-26-17-15-23(2)3/h4-13H,14-17H2,1-3H3,(H,22,24)
Molecular Formula:   C21H28N2OS2 Mol. Weight:   388.1643 logP:   4.0518
HBD:   1 HBA:   4
#Rotatable Bonds:   10 TPSA:   32.34

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
14-3-3 protein sigma P31947 (1433S_HUMAN) Homo sapiens (Human) 6HKF G8T
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