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BDBM79207 MLS002153966::Methyl benzethonium chloride::SMR001233305::benzyl-dimethyl-[2-[2-[2-methyl-4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium;chloride::benzyl-dimethyl-[2-[2-[2-methyl-4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azanium;chloride::cid_5702238::dimethyl-[2-[2-[2-methyl-4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]-(phenylmethyl)ammonium;chloride::dimethyl-[2-[2-[2-methyl-4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]-(phenylmethyl)azanium;chloride
SMILES: Cc1cc(ccc1OCCOCC[N+](C)(C)Cc1ccccc1)C(C)(C)CC(C)(C)C
InChI Key: InChIKey=UQOOPIMXBSPVJI-UHFFFAOYSA-N
Data: 6 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Ubiquitin-conjugating enzyme E2 N (Human) | BDBM79207![]() (dimethyl-[2-[2-[2-methyl-4-(2,4,4-trimethylpentan-...) | GoogleScholar | UniChem | n/a | n/a | 8.92E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Ubiquitin-conjugating enzyme E2 N (Human) | BDBM79207![]() (dimethyl-[2-[2-[2-methyl-4-(2,4,4-trimethylpentan-...) | GoogleScholar | UniChem | n/a | n/a | 9.49E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Bcl-2-related protein A1 (Mouse) | BDBM79207![]() (dimethyl-[2-[2-[2-methyl-4-(2,4,4-trimethylpentan-...) | GoogleScholar | UniChem | n/a | n/a | 1.49E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Apoptotic protease-activating factor 1 (Human) | BDBM79207![]() (dimethyl-[2-[2-[2-methyl-4-(2,4,4-trimethylpentan-...) | GoogleScholar | UniChem | n/a | n/a | 2.13E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Apoptotic protease-activating factor 1 (Human) | BDBM79207![]() (dimethyl-[2-[2-[2-methyl-4-(2,4,4-trimethylpentan-...) | GoogleScholar | UniChem | n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Caspase-9 (Human) | BDBM79207![]() (dimethyl-[2-[2-[2-methyl-4-(2,4,4-trimethylpentan-...) | GoogleScholar | UniChem | n/a | n/a | 3.91E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||