 |
| Ligand Name:
5-[2-(1H-pyrrol-1-yl)ethoxy]-1H-indole |
| HET ID: 00G |
PubChem:
44129621
|
| DrugBank: DB06828 |
ChEMBL: CHEMBL1229506 |
| Canonical SMILES: c1[nH]c2c(c1)cc(cc2)OCCn1cccc1 |
| Standard InChI: InChI=1S/C14H14N2O/c1-2-8-16(7-1)9-10-17-13-3-4-14-12(11-13)5-6-15-14/h1-8,11,15H,9-10H2 |
| Molecular Formula: C14H14N2O |
Mol. Weight: 226.27376 |
Heavy Atoms: 17 |
| Charge: 0 |
Is Chiral: False |
logP: 3.0484 |
| HBD: 1 |
HBA: 2 |
TPSA: 29.95 |
| #Bonds: 20 |
#Rotatable Bonds: 4 |
Shape Complexity: 0.14285715 |
| Stereocomplexity: 0.0 |
Ligand Type: Small Molecule |