Ligand

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Ligand Name:   1-METHYLCYTOSINE
HET ID:   1MC PubChem:   79143
DrugBank:   DB04314 ChEMBL:   CHEMBL500883
Canonical SMILES:   Cn1ccc(nc1=O)N
Standard InChI:   InChI=1S/C5H7N3O/c1-8-3-2-4(6)7-5(8)9/h2-3H,1H3,(H2,6,7,9)
Molecular Formula:   C5H7N3O Mol. Weight:   125.12858 Heavy Atoms:   9
Charge:   0 Is Chiral:   False logP:   -0.0563
HBD:   1 HBA:   4 TPSA:   60.91
#Bonds:   9 #Rotatable Bonds:   0 Shape Complexity:   0.2
Stereocomplexity:   0.0
Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID Binding Affinity Binding Database Complex Card
Cap-specific mRNA (nucleoside-2'-O-)-methyltransferase P07617 (MCE_VACCW) Vaccinia virus 1BKY Kd : 144000.0 nM PDBBind SHOW
Cap-specific mRNA (nucleoside-2'-O-)-methyltransferase P07617 (MCE_VACCW) Vaccinia virus 1BKY Kd : 144000.0 nM Binding MOAD SHOW