| Formula | C22H20N6S |
| MW | 400.5 |
| InChIKey | IXTFRNUBGGMAFK-BUHFOSPRSA-N |
| hba | 6 |
| hbd | 2 |
| lipinski_violations | 0 |
| pains_match | 0 |
| reactivity | 0 |
| rotatable_bonds | 3 |
| veber_rule | 1 |
| b_m_subgroup_collapsed | 0 |
| drug_score | 0.594406 |
| logp | 4.3453 |
| mw | 400.511 |
| molecular_weight | 400.511 |
| qed_score | 0.594406 |
| tpsa | 64.71 |
| s_m_entry_id | 2994 |
| s_m_subgroup_title | test |
| s_m_subgroupid | test |
| nmr_koda | ni NMR podatkov |
| nova_ali_stara_spojina | FKKT-FFA knjiznica |
| smiles | CC1(C)N=NC2=C1C1=[SH]N=C(c3ccccc3)N1N=C2N/C=C/c1ccccc1 |
| dodaten_komentar | 0 |
| fizicna_ali_virtualna_spojina | fizicen vzorec |
| koda_racka_1_nunc | TS01040351 |
| koda_racka_fkkt | 40 |
| koda_viale | NA0031284739 |
| literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
| lokacija | FKKT hladilnik 1 |
| masa_mg | 959 |
| pozicija_v_racku_in_rack | 41G9 |
| raziskovalec | Branko Stanovnik |
| raziskovalna_skupina | prof. dr. Jurij Svete |
| trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
| velikost_viale | 2 mL |