Ligand Download |
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Ligand Name: 2-methyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one | ||
HET ID: FDR | PubChem: 2807595 | |
DrugBank: - | ChEMBL: CHEMBL1300272 | |
Canonical SMILES: Cc1nc2sc3c(c2c(=O)[nH]1)CCC3 | ||
Standard InChI: InChI=1S/C10H10N2OS/c1-5-11-9(13)8-6-3-2-4-7(6)14-10(8)12-5/h2-4H2,1H3,(H,11,12,13) | ||
Molecular Formula: C10H10N2OS | Mol. Weight: 206.2642 | Heavy Atoms: 14 |
Charge: 0 | Is Chiral: False | logP: 1.7817 |
HBD: 1 | HBA: 3 | TPSA: 73.99 |
#Bonds: 17 | #Rotatable Bonds: 0 | Shape Complexity: 0.4 |
Stereocomplexity: 0.0 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | Binding Affinity | Binding Database | Complex Card |
Protein mono-ADP-ribosyltransferase PARP14 | Q460N5 (PAR14_HUMAN) | Homo sapiens | 3SMJ |
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