Formula | C27H15F3N2S |
MW | 456.49 |
InChIKey | WEJDCPWBSLCVNT-UHFFFAOYSA-N |
hba | 3 |
hbd | 0 |
lipinski_violations | 1 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 3 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.274388 |
logp | 8.18778 |
mw | 456.492 |
molecular_weight | 456.492 |
qed_score | 0.274388 |
tpsa | 36.68 |
s_m_entry_id | 1003 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | OK30829 |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | N#Cc1ccc(-c2cc(-c3ccc(C(F)(F)F)cc3)c(-c3ccc4ccccc4n3)s2)cc1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00321361 |
koda_racka_fkkt | 16 |
koda_viale | NULW760290 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 24 |
pozicija_v_racku_in_rack | 16B8 |
raziskovalec | Urša R. |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 0,5 mL |