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
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