P395
Id | 395 |
Inchikey | DOGOWZSMZXLRRH-VIFPVBQESA-N |
Smiles | C[C@@H](Cn1cccn1)NC1=NCCCS1 |
Mol |
|
Is_fingerprinted | False |
Origin | COMPUTED |
Inspiration_distance | 0.865995 |
Binding_energy | -28.112574 |
Ligand_energy | 21.385355670351643 |
Placement | Placement_395 "Zika_NS5A-x0892 w/ C395" |