BDBM38529 1-(4-Benzhydryl-piperazin-1-yl)-2-(4-pyrimidin-2-yl-piperazin-1-yl)-ethanone::1-(4-benzhydrylpiperazin-1-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone;hydrochloride::1-(4-benzhydrylpiperazino)-2-[4-(2-pyrimidyl)piperazino]ethanone;hydrochloride::1-[4-(diphenylmethyl)-1-piperazinyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone;hydrochloride::1-[4-(diphenylmethyl)piperazin-1-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone;hydrochloride::MLS000034828::SMR000008367::cid_6602525
SMILES: O=C(CN1CCN(CC1)c1ncccn1)N1CCN(CC1)C(c1ccccc1)c1ccccc1
InChI Key: InChIKey=CTQJCMKYFLZBIY-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
mevalonate kinase (Streptococcus pneumoniae D39) | BDBM38529 (1-(4-Benzhydryl-piperazin-1-yl)-2-(4-pyrimidin-2-y...) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | >1.00E+7 | n/a | n/a | n/a | n/a | n/a | n/a |
SRMLSC Curated by PubChem BioAssay | Assay Description Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C... | PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q27P8WSS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
mevalonate kinase (Streptococcus pneumoniae D39) | BDBM38529 (1-(4-Benzhydryl-piperazin-1-yl)-2-(4-pyrimidin-2-y...) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | >1.00E+7 | n/a | n/a | n/a | n/a | n/a | n/a |
SRMLSC Curated by PubChem BioAssay | Assay Description Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C... | PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q2CF9NG2 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
mevalonate kinase (Streptococcus pneumoniae D39) | BDBM38529 (1-(4-Benzhydryl-piperazin-1-yl)-2-(4-pyrimidin-2-y...) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 1.80E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
SRMLSC Curated by PubChem BioAssay | Assay Description Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C... | PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q23X852V | |||||||||||
More data for this Ligand-Target Pair |