Formula | C27H17F3N2OS |
MW | 474.5 |
InChIKey | JZKKMCXHOMCFQV-UHFFFAOYSA-N |
hba | 4 |
hbd | 0 |
lipinski_violations | 1 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 4 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.248602 |
logp | 7.9137 |
mw | 474.507 |
molecular_weight | 474.507 |
qed_score | 0.248602 |
tpsa | 42.85 |
s_m_entry_id | 967 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | OK30820 |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CC(=O)c1ccc(-c2cc(-c3ccc(C(F)(F)F)cc3)sc2-c2ncc3ccccc3n2)cc1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00321365 |
koda_racka_fkkt | 14 |
koda_viale | NULW764311 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 10 |
pozicija_v_racku_in_rack | 14H5 |
raziskovalec | Maša K. |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 0,5 mL |