| Formula | C21H18N6O4 |
| MW | 418.41 |
| InChIKey | BEDWMRXJPXJVCW-WBILKINKSA-N |
| hba | 8 |
| hbd | 2 |
| lipinski_violations | 0 |
| pains_match | 0 |
| reactivity | 0 |
| rotatable_bonds | 6 |
| veber_rule | 1 |
| b_m_subgroup_collapsed | 0 |
| drug_score | 0.458194 |
| logp | 1.8549 |
| mw | 418.413 |
| molecular_weight | 418.413 |
| qed_score | 0.458194 |
| tpsa | 130.17 |
| s_m_entry_id | 1406 |
| s_m_subgroup_title | test |
| s_m_subgroupid | test |
| nmr_koda | ni NMR podatkov |
| nova_ali_stara_spojina | FKKT-FFA knjiznica |
| smiles | O=C1/C(=C/Nc2nnn[nH]2)C(=O)N(C(=O)OCc2ccccc2)[C@H]1Cc1ccccc1 |
| dodaten_komentar | 0 |
| fizicna_ali_virtualna_spojina | fizicen vzorec |
| koda_racka_1_nunc | NU00321360 |
| koda_racka_fkkt | 22 |
| koda_viale | NULW759461 |
| literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
| lokacija | FKKT hladilnik 1 |
| masa_mg | 56 |
| pozicija_v_racku_in_rack | 22A3 |
| raziskovalec | J. Svete |
| raziskovalna_skupina | prof. dr. Jurij Svete |
| trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
| velikost_viale | 0,5 mL |