Ligand

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Ligand Name:   4-[5-(7-fluoranylquinolin-4-yl)-1-methyl-imidazol-4-yl]-3,5-dimethyl-1,2-oxazole
HET ID:   EHW PubChem:   138115348
DrugBank:   - ChEMBL:   -
Canonical SMILES:   Fc1ccc2c(c1)nccc2c1n(C)cnc1c1c(C)noc1C
Standard InChI:   InChI=1S/C18H15FN4O/c1-10-16(11(2)24-22-10)17-18(23(3)9-21-17)14-6-7-20-15-8-12(19)4-5-13(14)15/h4-9H,1-3H3
Molecular Formula:   C18H15FN4O Mol. Weight:   322.3363 Heavy Atoms:   24
Charge:   0 Is Chiral:   False logP:   4.0462
HBD:   0 HBA:   5 TPSA:   56.74
#Bonds:   27 #Rotatable Bonds:   2 Shape Complexity:   0.16666667
Stereocomplexity:   0.0
Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID Binding Affinity Binding Database Complex Card
Histone-lysine N-methyltransferase NSD3 Q9BZ95 (NSD3_HUMAN) Homo sapiens 6G2F
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