P736
| Id | 736 |
| Inchikey | GYTSIWMUBRJWHK-JTQLQIEISA-N |
| Smiles | Cn1cc(C(=O)CNC(=O)[C@@H]2CCCO2)cn1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.965328 |
| Binding_energy | -32.736155 |
| Ligand_energy | 48.43274941486334 |
| Placement | Placement_737 "DNV2_NS5A-x0160 w/ C737" |