P435
Id | 435 |
Inchikey | BMRWUESAXGNPLO-KRWDZBQOSA-N |
Smiles | c1ccc([C@H](NCCCNc2ccncc2)c2ncc[nH]2)cc1 |
Mol |
|
Is_fingerprinted | False |
Origin | COMPUTED |
Inspiration_distance | 0.995842 |
Binding_energy | -18.414961 |
Ligand_energy | 20.92112650151919 |
Placement | Placement_435 "DNV2_NS5A-x0472 w/ C429" |