Formula | C17H14F6N2S |
MW | 392.37 |
InChIKey | PXRUOQFRZRQUJX-UHFFFAOYSA-N |
hba | 1 |
hbd | 2 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 4 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.572472 |
logp | 4.8885 |
mw | 392.368 |
molecular_weight | 392.368 |
qed_score | 0.572472 |
tpsa | 24.06 |
s_m_entry_id | 3525 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | FC(F)(F)c1cc(CNC(=S)NCc2ccccc2)cc(C(F)(F)F)c1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00329477 |
koda_racka_fkkt | 48 |
koda_viale | NUME540954 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 87 |
pozicija_v_racku_in_rack | 48B9 |
raziskovalec | Luka Ciber |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |