Formula | C27H28F9N3O |
MW | 581.54 |
InChIKey | BRJFUHITMZCGHD-FYYLOGMGSA-N |
hba | 3 |
hbd | 2 |
lipinski_violations | 2 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 5 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.15012 |
logp | 8.2043 |
mw | 581.523 |
molecular_weight | 581.523 |
qed_score | 0.35012 |
tpsa | 44.37 |
s_m_entry_id | 3918 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | O=C(Nc1ccc(C(F)(F)F)cc1N[C@@H]1CCCC[C@H]1N1CCCCC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | nu00380159 |
koda_racka_fkkt | 52 |
koda_viale | NUOB206312 |
literaturno_znana_neznana_ali_komercialna_spojina | N |
lokacija | FKKT hladilnik 1 |
masa_mg | 17 |
pozicija_v_racku_in_rack | 52C10 |
raziskovalec | Klara Klemenčič |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |