Formula | C12H8N2S |
MW | 212.27 |
InChIKey | PGOHIRZWBFOSRW-UHFFFAOYSA-N |
hba | 3 |
hbd | 0 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 1 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.617793 |
logp | 3.3583 |
mw | 212.277 |
molecular_weight | 212.277 |
qed_score | 0.617793 |
tpsa | 25.78 |
s_m_entry_id | 964 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | OK30798 |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | c1csc(-c2ncc3ccccc3n2)c1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325920 |
koda_racka_fkkt | 15 |
koda_viale | NUMB137245 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 99 |
pozicija_v_racku_in_rack | 15A11 |
raziskovalec | Maša K. |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 0,5 mL |