Ligand |
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Ligand Name: (2S)-2-amino-N-(5-bromopentyl)propanamide | ||
Ligand Type: L-peptide linking | ||
Ligand ID: COVPDB262 | PubChem: - | |
Synonym(s): - | ||
DrugBank: - | ChEMBL: - | |
Canonical SMILES: C[C@H](N)C(=O)NCCCCCBr | ||
Standard InChI: InChI=1S/C8H17BrN2O/c1-7(10)8(12)11-6-4-2-3-5-9/h7H,2-6,10H2,1H3,(H,11,12)/t7-/m0/s1 | ||
Molecular Formula: C8H17BrN2O | Mol. Weight: 236.05243 | logP: 1.015 |
HBD: 2 | HBA: 2 | |
#Rotatable Bonds: 6 | TPSA: 55.12 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | HET Code | Binding Affinity | Binding Database | Complex Card |
CDA peptide synthetase I | Q9Z4X6 (Q9Z4X6_STRCO) | Streptomyces coelicolor (strain ATCC BAA-471 / A3(2) / M145) | 5DUA | 5FQ |
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SHOW |