| Formula | C15H15NO4S |
| MW | 305.35 |
| InChIKey | JQJGVKHWHGBCHJ-UHFFFAOYSA-N |
| hba | 6 |
| hbd | 0 |
| lipinski_violations | 0 |
| pains_match | 0 |
| reactivity | 0 |
| rotatable_bonds | 3 |
| veber_rule | 1 |
| b_m_subgroup_collapsed | 0 |
| drug_score | 0.815567 |
| logp | 3.00014 |
| mw | 305.355 |
| molecular_weight | 305.355 |
| qed_score | 0.815567 |
| tpsa | 65.49 |
| s_m_entry_id | 4019 |
| s_m_subgroup_title | test |
| s_m_subgroupid | test |
| nmr_koda | ni NMR podatkov |
| nova_ali_stara_spojina | FKKT-FFA knjiznica |
| smiles | COC(=O)c1cnc(-c2cc(C)sc2C)cc1C(=O)OC |
| dodaten_komentar | 0 |
| fizicna_ali_virtualna_spojina | fizicen vzorec |
| koda_racka_1_nunc | nu00380158 |
| koda_racka_fkkt | 53 |
| koda_viale | NUOB205623 |
| literaturno_znana_neznana_ali_komercialna_spojina | znana |
| lokacija | FKKT hladilnik 1 |
| masa_mg | 25 |
| pozicija_v_racku_in_rack | 53D3 |
| raziskovalec | Jure Bezenšek |
| raziskovalna_skupina | prof. dr. Jurij Svete |
| trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
| velikost_viale | 1 mL |