| Formula | C18H13ClN4O |
| MW | 336.78 |
| InChIKey | QOVLSFRORBDOIX-UHFFFAOYSA-N |
| hba | 4 |
| hbd | 1 |
| lipinski_violations | 0 |
| pains_match | 0 |
| reactivity | 0 |
| rotatable_bonds | 3 |
| veber_rule | 1 |
| b_m_subgroup_collapsed | 0 |
| drug_score | 0.796209 |
| logp | 3.42398 |
| mw | 336.782 |
| molecular_weight | 336.782 |
| qed_score | 0.796209 |
| tpsa | 70.71 |
| s_m_entry_id | 878 |
| s_m_subgroup_title | test |
| s_m_subgroupid | test |
| nmr_koda | ni NMR podatkov |
| nova_ali_stara_spojina | FKKT-FFA knjiznica |
| smiles | CNC(=O)c1c(C#N)c(-c2ccc(Cl)cc2)nn1-c1ccccc1 |
| dodaten_komentar | 0 |
| fizicna_ali_virtualna_spojina | fizicen vzorec |
| koda_racka_1_nunc | NU00321365 |
| koda_racka_fkkt | 14 |
| koda_viale | NULW764269 |
| literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
| lokacija | FKKT hladilnik 1 |
| masa_mg | 15 |
| pozicija_v_racku_in_rack | 14C1 |
| raziskovalec | Uroš Grošelj |
| raziskovalna_skupina | prof. dr. Jurij Svete |
| trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
| velikost_viale | 0,5 mL |