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BDBM50290738 CHEMBL94726::[3-Benzo[1,3]dioxol-5-yl-3-(2-{4-[1-(4-fluoro-benzyl)-1H-benzoimidazole-2-carbonyl]-piperidin-1-yl}-ethyl)-pyrrolidin-1-yl]-(2,3,4-trimethoxy-phenyl)-methanone
SMILES: COc1ccc(C(=O)N2CCC(CCN3CCC(CC3)C(=O)c3nc4ccccc4n3Cc3ccc(F)cc3)(C2)c2ccc3OCOc3c2)c(OC)c1OC
InChI Key: InChIKey=CTPOZVITFCJCLL-UHFFFAOYSA-N
Data: 2 IC50
| Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Substance-P receptor (Guinea pig) | BDBM50290738![]() ([3-Benzo[1,3]dioxol-5-yl-3-(2-{4-[1-(4-fluoro-benz...) | GoogleScholar | UniChem | n/a | n/a | 6.40 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Histamine H1 receptor (Human) | BDBM50290738![]() ([3-Benzo[1,3]dioxol-5-yl-3-(2-{4-[1-(4-fluoro-benz...) | GoogleScholar | UniChem | n/a | n/a | 6.60 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||