BDBM51494 7-hydroxy-4-propyl-8-(1-pyrrolidinylmethyl)-1-benzopyran-2-one::7-hydroxy-4-propyl-8-(pyrrolidin-1-ylmethyl)chromen-2-one::7-hydroxy-4-propyl-8-(pyrrolidinomethyl)coumarin::7-oxidanyl-4-propyl-8-(pyrrolidin-1-ylmethyl)chromen-2-one::MLS000036894::SMR000042448::cid_5389391

SMILES: CCCc1cc(=O)oc2c(CN3CCCC3)c(O)ccc12

InChI Key: InChIKey=BFVNAFCRUSVXRA-UHFFFAOYSA-N

Data: 1 IC50

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 = 51494   

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
dTDP-4-dehydrorhamnose 3,5-epimerase RmlC (Mycobacterium tuberculosis H37Rv)	BDBM51494 (7-hydroxy-4-propyl-8-(1-pyrrolidinylmethyl)-1-benz...) Show SMILES CCCc1cc(=O)oc2c(CN3CCCC3)c(O)ccc12 Show InChI InChI=1S/C17H21NO3/c1-2-5-12-10-16(20)21-17-13(12)6-7-15(19)14(17)11-18-8-3-4-9-18/h6-7,10,19H,2-5,8-9,11H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	679	n/a	n/a	n/a	n/a	n/a	n/a
PCMD Curated by PubChem BioAssay					Assay Description Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Michael McNeil, Colorado State Universi...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2TD9VRT
					More data for this Ligand-Target Pair