Ligand

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Ligand Name:   (~{S})-phenyl-[(2~{S})-pyrrolidin-2-yl]methanol
HET ID:   M5E PubChem:   12628020
DrugBank:   - ChEMBL:   -
Canonical SMILES:   C1CC(NC1)C(C2=CC=CC=C2)O
Standard InChI:   InChI=1S/C11H15NO/c13-11(10-7-4-8-12-10)9-5-2-1-3-6-9/h1-3,5-6,10-13H,4,7-8H2
Molecular Formula:   C11H15NO Mol. Weight:   177.2429 Heavy Atoms:   13
Charge:   0 Is Chiral:   True logP:   1.8008
HBD:   2 HBA:   2 TPSA:   32.26
#Bonds:   14 #Rotatable Bonds:   2 Shape Complexity:   0.45454547
Stereocomplexity:   0.18181819
Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID Binding Affinity Binding Database Complex Card
YTH domain-containing protein 1 Q96MU7 (YTDC1_HUMAN) Homo sapiens 6T02
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