Ligand |
||
Ligand Name: SNAP-Vista Green™ reagent | ||
Ligand Type: non-polymer | ||
Ligand ID: COVPDB771 | PubChem: - | |
Synonym(s): - | ||
DrugBank: - | ChEMBL: - | |
Canonical SMILES: Nc1nc(OCc2ccc(CNC(=O)c3ccc(c(c3)C(O)=O)-c3c4ccc(O)cc4oc4cc(=O)ccc34)cc2)c2nc[nH]c2n1 | ||
Standard InChI: InChI=1S/C34H24N6O7/c35-34-39-30-29(37-16-38-30)32(40-34)46-15-18-3-1-17(2-4-18)14-36-31(43)19-5-8-22(25(11-19)33(44)45)28-23-9-6-20(41)12-26(23)47-27-13-21(42)7-10-24(27)28/h1-13,16,41H,14-15H2,(H,36,43)(H,44,45)(H3,35,37,38,39,40) | ||
Molecular Formula: C34H24N6O7 | Mol. Weight: 628.17065 | logP: 4.7261 |
HBD: 5 | HBA: 10 | |
#Rotatable Bonds: 8 | TPSA: 206.55 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | HET Code | Binding Affinity | Binding Database | Complex Card |
Methylated-DNA--protein-cysteine methyltransferase | Q97VW7 (OGT_SACS2) | Saccharolobus solfataricus (strain ATCC 35092 / DSM 1617 / JCM 11322 / P2) (Sulfolobus solfataricus) | 6GA0 | ETW |
- |
- |
SHOW |