| Formula | C32H27N9O9 |
| MW | 681.62 |
| InChIKey | TVKHFMGJWHJPKV-KHYBXSLHSA-N |
| hba | 13 |
| hbd | 3 |
| lipinski_violations | 2 |
| pains_match | 0 |
| reactivity | 0 |
| rotatable_bonds | 9 |
| veber_rule | 0 |
| b_m_subgroup_collapsed | 0 |
| drug_score | 0 |
| logp | 2.3881 |
| mw | 681.622 |
| molecular_weight | 681.622 |
| qed_score | 0.127359 |
| tpsa | 239.98 |
| s_m_entry_id | 634 |
| s_m_subgroup_title | test |
| s_m_subgroupid | test |
| nmr_koda | ni NMR podatkov |
| nova_ali_stara_spojina | FKKT-FFA knjiznica |
| smiles | CC[C@]12C(C)=C[C@](NC(=O)c3ccccc3)([C@@H]3C(=O)N(Nc4ncccc4[N+](=O)[O-])C(=O)[C@@H]31)[C@H]1C(=O)N(Nc3ncccc3[N+](=O)[O-])C(=O)[C@H]12 |
| dodaten_komentar | 0 |
| fizicna_ali_virtualna_spojina | fizicen vzorec |
| koda_racka_1_nunc | NU00325919 |
| koda_racka_fkkt | 9 |
| koda_viale | NUMB142043 |
| literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
| lokacija | FKKT hladilnik 1 |
| masa_mg | 112 |
| pozicija_v_racku_in_rack | 9B3 |
| raziskovalec | Jernej Ekar |
| raziskovalna_skupina | prof. dr. Janez KoĊĦmrlj |
| trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
| velikost_viale | 1 mL |