Formula | C18H22F6N2S |
MW | 412.44 |
InChIKey | YKSWVXNVXLEWLM-LSDHHAIUSA-N |
hba | 1 |
hbd | 2 |
lipinski_violations | 1 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 3 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.454912 |
logp | 6.2254 |
mw | 412.443 |
molecular_weight | 412.443 |
qed_score | 0.454912 |
tpsa | 24.06 |
s_m_entry_id | 3517 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CC(C)[C@@H]1CCCC[C@H]1NC(=S)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00329467 |
koda_racka_fkkt | 48 |
koda_viale | NUME541193 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 3 |
pozicija_v_racku_in_rack | 48A11 |
raziskovalec | Luka Ciber |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |