Ligand
Ligand Name:   N5-(1-iminopropyl)-L-ornithine
Ligand Type:   non-polymer
Ligand ID:   COVPDB1071 PubChem:   44593548
Synonym(s):  
  •   chembl507472
  • l-ipo, 13
  • bdbm152699
  • bdbm50254450
  • zinc40380536
  • n~5~-[(1z)-propanimidoyl]-l-ornithine
  • (s)-2-amino-5-propionimidamidopentanoic acid (8)
  • (s)-2-amino-5-propionimidoylamino-pentanoic acid
  • (2s)-2-azanyl-5-(propanimidoylamino)pentanoic acid
  • q27462619
show 9 synonym(s)
DrugBank:   - ChEMBL:   CHEMBL507472
Canonical SMILES:   CCC(=N)NCCC[C@H](N)C(O)=O
Standard InChI:   InChI=1S/C8H17N3O2/c1-2-7(10)11-5-3-4-6(9)8(12)13/h6H,2-5,9H2,1H3,(H2,10,11)(H,12,13)/t6-/m0/s1
Molecular Formula:   C8H17N3O2 Mol. Weight:   187.13208 logP:   0.15537
HBD:   4 HBA:   3
#Rotatable Bonds:   6 TPSA:   99.2

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 O94760 (DDAH1_HUMAN) Homo sapiens (Human) 3I4A LN5 IC50 : 300000 nM, Ki : 145000 nM, Ki : 52000 nM BindingDB SHOW