BDBM50036569 7-Cyclopropylmethyl-8,9-dimethyl-6,7,8,9-tetrahydro-2H-2,7,9a-triaza-benzo[cd]azulene-1-thione::CHEMBL68933

SMILES: CC1C(C)n2c3c(CN1CC1CC1)cccc3[nH]c2=S

InChI Key: InChIKey=QKENLRCEOGQNQI-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 = 50036569   

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
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50036569 (7-Cyclopropylmethyl-8,9-dimethyl-6,7,8,9-tetrahydr...) Show SMILES CC1C(C)n2c3c(CN1CC1CC1)cccc3[nH]c2=S Show InChI InChI=1S/C16H21N3S/c1-10-11(2)19-15-13(9-18(10)8-12-6-7-12)4-3-5-14(15)17-16(19)20/h3-5,10-12H,6-9H2,1-2H3,(H,17,20)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.34E+4	n/a	n/a	n/a	n/a	n/a	n/a
IBM Thomas J. Watson Research Center Curated by ChEMBL					Assay Description Inhibitory concentration against HIV-1 replication by interfering with virus reverse transcriptase				J Med Chem 39: 2129-40 (1996) Article DOI: 10.1021/jm950589q BindingDB Entry DOI: 10.7270/Q2697471
					More data for this Ligand-Target Pair