BDBM2130 1-[2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl]-3-[5-(trifluoromethyl)-1,3-thiazol-2-yl]thiourea::LY300046HCl Analog 15::N-[2-(2-Chloro-3-ethoxy-6-fluorophenethyl)]-N-[2-(5-(trifluoromethyl)thiazolyl)]thiourea::PETT deriv.
SMILES: CCOc1ccc(F)c(CCNC(=S)Nc2ncc(s2)C(F)(F)F)c1Cl
InChI Key: InChIKey=MFJMKWIDCDUHBK-UHFFFAOYSA-N
Data: 3 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
HIV-1 Reverse Transcriptase (Human immunodeficiency virus type 1) | BDBM2130 (1-[2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl]-3-[5...) | PDB MMDB B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 47 | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories | Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro. | J Med Chem 39: 4261-74 (1996) Article DOI: 10.1021/jm950639r BindingDB Entry DOI: 10.7270/Q2542KSN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
HIV-1 Reverse Transcriptase Mutant (Y181C) (Human immunodeficiency virus type 1) | BDBM2130 (1-[2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl]-3-[5...) | PDB MMDB B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 7.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories | Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro. | J Med Chem 39: 4261-74 (1996) Article DOI: 10.1021/jm950639r BindingDB Entry DOI: 10.7270/Q2542KSN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
HIV-1 Reverse Transcriptase Mutant (L100I) (Human immunodeficiency virus type 1) | BDBM2130 (1-[2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl]-3-[5...) | PDB MMDB B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 7.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories | Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro. | J Med Chem 39: 4261-74 (1996) Article DOI: 10.1021/jm950639r BindingDB Entry DOI: 10.7270/Q2542KSN | |||||||||||
More data for this Ligand-Target Pair |