BDBM81745 Oryzalin Analogue, 4

SMILES: CCCN(CCC)c1c(cc(cc1C#N)S(=O)(=O)Nc1ccccc1)C#N

InChI Key: InChIKey=NLJRXVTWLRMZRA-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 81745   

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
Tubulin alpha-1A chain (Sus scrofa (Pig))	BDBM81745 (Oryzalin Analogue, 4) Show SMILES CCCN(CCC)c1c(cc(cc1C#N)S(=O)(=O)Nc1ccccc1)C#N Show InChI InChI=1S/C20H22N4O2S/c1-3-10-24(11-4-2)20-16(14-21)12-19(13-17(20)15-22)27(25,26)23-18-8-6-5-7-9-18/h5-9,12-13,23H,3-4,10-11H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University					Assay Description In vitro activity assay using leishmania tarentolae and porcine brain tubulin.				Chem Biol Drug Des 72: 513-24 (2008) Article DOI: 10.1111/j.1747-0285.2008.00729.x BindingDB Entry DOI: 10.7270/Q2SQ8XWV
					More data for this Ligand-Target Pair
Tubulin alpha chain (Leishmania tarentolae (Sauroleishmania tarentolae))	BDBM81745 (Oryzalin Analogue, 4) Show SMILES CCCN(CCC)c1c(cc(cc1C#N)S(=O)(=O)Nc1ccccc1)C#N Show InChI InChI=1S/C20H22N4O2S/c1-3-10-24(11-4-2)20-16(14-21)12-19(13-17(20)15-22)27(25,26)23-18-8-6-5-7-9-18/h5-9,12-13,23H,3-4,10-11H2,1-2H3	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University					Assay Description In vitro activity assay using leishmania tarentolae and porcine brain tubulin.				Chem Biol Drug Des 72: 513-24 (2008) Article DOI: 10.1111/j.1747-0285.2008.00729.x BindingDB Entry DOI: 10.7270/Q2SQ8XWV
					More data for this Ligand-Target Pair