null
SMILES: CC[C@]1([C@@H](C)C1(Cl)Cl)C(=O)N[C@H](C)c1ccc(Cl)cc1
InChI Key: InChIKey=RXDMAYSSBPYBFW-RULNRJAQSA-N
PDB links: 2 PDB IDs match this monomer.
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Scytalone dehydratase (Magnaporthe grisea) | BDBM50086741 (((1RS,3SR)-2,2-DICHLORO-N-[(R)-1-(4-CHLOROPHENYL)E...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase CHEMBL KEGG MMDB PC cid PC sid PDB UniChem Patents Similars | MMDB PDB PubMed | 0.0300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
DuPont Central Research and Development Curated by ChEMBL | Assay Description Compound was evaluated for its inhibition constant against scytalone dehydratase (SD) | Bioorg Med Chem Lett 10: 491-4 (2000) BindingDB Entry DOI: 10.7270/Q2D799ND | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |