BDBM50113825 1-[5-Guanidino-2-(3-methyl-1,2,3,4-tetrahydro-quinoline-8-sulfonylamino)-pentanoyl]-4-methyl-piperidine-2-carboxylicacid anion::CHEMBL315611
SMILES: CC1CCN(C(C1)C([O-])=O)C(=O)C(CCCNC(N)=[NH2+])NS(=O)(=O)c1cccc2C[C@@H](C)CNc12
InChI Key: InChIKey=KXNPVXPOPUZYGB-YCPQDUGXSA-N
Data: 1 KI
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Thrombin (Bos taurus (Bovine)) | BDBM50113825 (1-[5-Guanidino-2-(3-methyl-1,2,3,4-tetrahydro-quin...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 1.90E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Parma Curated by ChEMBL | Assay Description Binding affinity against bovine Thrombin | J Med Chem 45: 2469-83 (2002) BindingDB Entry DOI: 10.7270/Q28916J7 | |||||||||||
More data for this Ligand-Target Pair |