BDBM50074596 (6R,8S)-7-Allyl-6,8-dimethyl-6,7,8,9-tetrahydro-2H-2,7,9a-triaza-benzo[cd]azulene-1-thione::CHEMBL168177::R-84914

SMILES: C[C@H]1Cn2c3c(cccc3[nH]c2=S)[C@@H](C)N1CC=C

InChI Key: InChIKey=HYMWHCWYQWFBTD-WDEREUQCSA-N

Data: 1 EC50

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 = 50074596   

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)	BDBM50074596 ((6R,8S)-7-Allyl-6,8-dimethyl-6,7,8,9-tetrahydro-2H...) Show SMILES C[C@H]1Cn2c3c(cccc3[nH]c2=S)[C@@H](C)N1CC=C Show InChI InChI=1S/C15H19N3S/c1-4-8-17-10(2)9-18-14-12(11(17)3)6-5-7-13(14)16-15(18)19/h4-7,10-11H,1,8-9H2,2-3H3,(H,16,19)/t10-,11+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	790	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Effective concentration against HIV-1 reverse transcriptase				J Med Chem 42: 868-81 (1999) Article DOI: 10.1021/jm980277y BindingDB Entry DOI: 10.7270/Q2TB17KD
					More data for this Ligand-Target Pair