Ligand

Download

Ligand Name:   5-(aminomethyl)-1,3-dimethyl-benzimidazol-2-one
HET ID:   8W9 PubChem:   757168
DrugBank:   - ChEMBL:   -
Canonical SMILES:   NCc1ccc2c(c1)n(C)c(=O)n2C
Standard InChI:   InChI=1S/C10H13N3O/c1-12-8-4-3-7(6-11)5-9(8)13(2)10(12)14/h3-5H,6,11H2,1-2H3
Molecular Formula:   C10H13N3O Mol. Weight:   191.22972 Heavy Atoms:   14
Charge:   0 Is Chiral:   False logP:   1.036
HBD:   1 HBA:   4 TPSA:   52.95
#Bonds:   15 #Rotatable Bonds:   1 Shape Complexity:   0.3
Stereocomplexity:   0.0
Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID Binding Affinity Binding Database Complex Card
Tudor domain-containing protein 3 Q9H7E2 (TDRD3_HUMAN) Homo sapiens 5YJ8 Kd : 104000.0 nM Binding MOAD SHOW