Ligand
Ligand Name:   (2S)-N-{3-[(3-aminopropyl)disulfanyl]propyl}-2-{2-[(2R)-2-carbamimidamido-2-cyclohexylacetamido]acetamido}propanamide
Ligand Type:   non-polymer
Ligand ID:   COVPDB1145 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   C[C@H](NC(=O)CNC(=O)[C@H](NC(N)=N)C1CCCCC1)C(=O)NCCCSSCCCN
Standard InChI:   InChI=1S/C20H39N7O3S2/c1-14(18(29)24-10-6-12-32-31-11-5-9-21)26-16(28)13-25-19(30)17(27-20(22)23)15-7-3-2-4-8-15/h14-15,17H,2-13,21H2,1H3,(H,24,29)(H,25,30)(H,26,28)(H4,22,23,27)/t14-,17+/m0/s1
Molecular Formula:   C20H39N7O3S2 Mol. Weight:   489.25558 logP:   0.27577
HBD:   7 HBA:   7
#Rotatable Bonds:   15 TPSA:   175.22

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Interleukin-2 P60568 (IL2_HUMAN) Homo sapiens (Human) 1M4B NMP
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