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BDBM80453 1-methyl-1-[3-(2,5,5-trimethyl-3,4,4a,10b-tetrahydro-2H,5H-pyrano[3,2-c]chromen-2-yl)prop-2-ynyl]piperidinium::1-methyl-1-[3-(2,5,5-trimethyl-3,4,4a,10b-tetrahydropyrano[3,2-c][1]benzopyran-2-yl)prop-2-ynyl]piperidin-1-ium;iodide::1-methyl-1-[3-(2,5,5-trimethyl-3,4,4a,10b-tetrahydropyrano[3,2-c]chromen-2-yl)prop-2-ynyl]piperidin-1-ium;iodide::MLS000727625::SMR000306322::cid_16188602
SMILES: CC1(C)Oc2ccccc2C2OC(C)(CCC12)C#CC[N+]1(C)CCCCC1
InChI Key: InChIKey=RDKWTBULQNEFPV-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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| DNA dC->dU-editing enzyme APOBEC-3G (Human) | BDBM80453![]() (MLS000727625 | 1-methyl-1-[3-(2,5,5-trimethyl-3,4,...) | GoogleScholar | UniChem | n/a | n/a | 5.07E+3 | n/a | n/a | n/a | n/a | n/a | 25 | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| DNA dC->dU-editing enzyme APOBEC-3A (Human) | BDBM80453![]() (MLS000727625 | 1-methyl-1-[3-(2,5,5-trimethyl-3,4,...) | GoogleScholar | UniChem | n/a | n/a | 3.03E+3 | n/a | n/a | n/a | n/a | n/a | 25 | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||