Ligand Download |
||
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 |
- |
- |
SHOW |