Ligand

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Ligand Name:   5-(2,3-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyridin-2-amine
HET ID:   GN6 PubChem:   82556507
DrugBank:   - ChEMBL:   -
Canonical SMILES:   Nc1nn2c(n1)cccc2c1cccc(c1Cl)Cl
Standard InChI:   InChI=1S/C12H8Cl2N4/c13-8-4-1-3-7(11(8)14)9-5-2-6-10-16-12(15)17-18(9)10/h1-6H,(H2,15,17)
Molecular Formula:   C12H8Cl2N4 Mol. Weight:   279.12473 Heavy Atoms:   18
Charge:   0 Is Chiral:   False logP:   3.8665
HBD:   1 HBA:   4 TPSA:   56.21
#Bonds:   20 #Rotatable Bonds:   1 Shape Complexity:   0.0
Stereocomplexity:   0.0
Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID Binding Affinity Binding Database Complex Card
7,8-dihydro-8-oxoguanine triphosphatase P36639 (8ODP_HUMAN) Homo sapiens 6US4
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