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BDBM32743 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid [2-(methylamino)-2-oxoethyl] ester::4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid [2-keto-2-(methylamino)ethyl] ester::MLS000565788::SMR000152883::[2-(methylamino)-2-oxidanylidene-ethyl] 4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxylate::[2-(methylamino)-2-oxoethyl] 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate::cid_2120212
SMILES: CNC(=O)COC(=O)c1[nH]c(C)c(C(C)=O)c1C
InChI Key: InChIKey=RYBHVWCNMHCFMJ-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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Coagulation factor XI (Human) | BDBM32743![]() (SMR000152883 | [2-(methylamino)-2-oxoethyl] 4-acet...) | GoogleScholar | UniChem | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | 7.4 | 23 | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Coagulation factor XI (Human) | BDBM32743![]() (SMR000152883 | [2-(methylamino)-2-oxoethyl] 4-acet...) | GoogleScholar | UniChem | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||