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BDBM50135159 (20S,2'E)-20-(N,N-dimethylamino)-3beta-(3'-phenyl-2'-propenyl-N-methylamido)pregnane]::(E)-N-[(3S,5S,8R,9S,10S,13S,14S,17S)-17-((S)-1-Dimethylamino-ethyl)-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-3-yl]-N-methyl-3-phenyl-acrylamide::(E)-N-{(1S,6S,7S,11R,12S,15S,16S)-17-[(S)-1-((S)-Dimethyl-amino)-ethyl]-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-3-yl}-N-methyl-3-phenyl-acrylamide::CHEMBL409854
SMILES: C[C@@H]([C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)N(C)C(=O)\C=C\c1ccccc1)N(C)C
InChI Key: InChIKey=QRUDUXILSDZJOY-UHFFFAOYSA-N
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Acetylcholinesterase (Pacific electric ray) | BDBM50135159![]() ((E)-N-[(3S,5S,8R,9S,10S,13S,14S,17S)-17-((S)-1-Dim...) | GoogleScholar | UniChem | n/a | n/a | 1.99E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Cholinesterase (Human) | BDBM50135159![]() ((E)-N-[(3S,5S,8R,9S,10S,13S,14S,17S)-17-((S)-1-Dim...) | GoogleScholar | UniChem | n/a | n/a | 4.84E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Acetylcholinesterase (Human) | BDBM50135159![]() ((E)-N-[(3S,5S,8R,9S,10S,13S,14S,17S)-17-((S)-1-Dim...) | GoogleScholar | UniChem | n/a | n/a | 1.95E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Cholinesterase (Human) | BDBM50135159![]() ((E)-N-[(3S,5S,8R,9S,10S,13S,14S,17S)-17-((S)-1-Dim...) | GoogleScholar | UniChem | 6.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Acetylcholinesterase (Pacific electric ray) | BDBM50135159![]() ((E)-N-[(3S,5S,8R,9S,10S,13S,14S,17S)-17-((S)-1-Dim...) | GoogleScholar | UniChem | 1.22E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||