Formula | C32H22N4O2S2 |
MW | 558.67 |
InChIKey | APDMLHVLCCMXJK-UHFFFAOYSA-N |
hba | 8 |
hbd | 0 |
lipinski_violations | 2 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 7 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0 |
logp | 8.1298 |
mw | 558.688 |
molecular_weight | 558.688 |
qed_score | 0.183928 |
tpsa | 85.7 |
s_m_entry_id | 611 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ok23464 |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CC(=O)c1ccc(-c2cccc(-c3cccc(-c4ccc(C(C)=O)s4)c3-c3ncccn3)c2-c2ncccn2)s1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | R000045563 |
koda_racka_fkkt | 10 |
koda_viale | NA0019513562 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 2 |
pozicija_v_racku_in_rack | 10C8 |
raziskovalec | Miha Drev |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 2 mL |