BDBM50435886 CHEMBL2391084

SMILES: Oc1ccc(CC[C@@H](F)C[C@H]2CC=CC(=O)O2)cc1

InChI Key: InChIKey=BKRSPZUJZJIEKE-TZMCWYRMSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50435886   

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
Carbonic Anhydrase XIII (Mus musculus (mouse))	BDBM50435886 (CHEMBL2391084) Show SMILES Oc1ccc(CC[C@@H](F)C[C@H]2CC=CC(=O)O2)cc1 |r,c:12| Show InChI InChI=1S/C15H17FO3/c16-12(10-14-2-1-3-15(18)19-14)7-4-11-5-8-13(17)9-6-11/h1,3,5-6,8-9,12,14,17H,2,4,7,10H2/t12-,14-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	960	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Superacid Group in Organic Synthesis Team-Universit£ de Poitiers Curated by ChEMBL					Assay Description Inhibition of mouse carbonic anhydrase 13 preincubated for 15 mins by stopped flow CO2 hydrase assay				Bioorg Med Chem 21: 3790-4 (2013) Article DOI: 10.1016/j.bmc.2013.04.041 BindingDB Entry DOI: 10.7270/Q2RV0Q33
					More data for this Ligand-Target Pair