Ligand

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Ligand Name:   ETHYL DIMETHYL AMMONIO PROPANE SULFONATE
HET ID:   NDS PubChem:   5221296
DrugBank:   DB02618 ChEMBL:   CHEMBL1234674
Canonical SMILES:   CC[N+](CCCS(=O)(=O)[O-])(C)C
Standard InChI:   InChI=1S/C7H17NO3S/c1-4-8(2,3)6-5-7-12(9,10)11/h4-7H2,1-3H3
Molecular Formula:   C7H17NO3S Mol. Weight:   195.27979 Heavy Atoms:   12
Charge:   0 Is Chiral:   False logP:   1.0988
HBD:   0 HBA:   3 TPSA:   65.58
#Bonds:   11 #Rotatable Bonds:   5 Shape Complexity:   1.0
Stereocomplexity:   0.0
Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID Binding Affinity Binding Database Complex Card
Polycomb protein EED O75530 (EED_HUMAN) Homo sapiens 3IJC
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