Ligand

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Ligand Name:   ~{N}-[(~{E})-(4-bromophenyl)methylideneamino]-2-(2~{H}-1,2,3,4-tetrazol-5-yl)ethanamide
HET ID:   FHQ PubChem:   9563325
DrugBank:   - ChEMBL:   -
Canonical SMILES:   C1=CC(=CC=C1C=NNC(=O)CC2=NNN=N2)Br
Standard InChI:   InChI=1S/C10H9BrN6O/c11-8-3-1-7(2-4-8)6-12-15-10(18)5-9-13-16-17-14-9/h1-4,6H,5H2,(H,15,18)(H,13,14,16,17)
Molecular Formula:   C10H9BrN6O Mol. Weight:   309.12207 Heavy Atoms:   18
Charge:   0 Is Chiral:   False logP:   1.0459
HBD:   2 HBA:   6 TPSA:   95.92
#Bonds:   19 #Rotatable Bonds:   5 Shape Complexity:   0.1
Stereocomplexity:   0.0
Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID Binding Affinity Binding Database Complex Card
Lysine-specific demethylase 4D Q6B0I6 (KDM4D_HUMAN) Homo sapiens 6H0Z
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