Formula | C30H34F3N3O4S2 |
MW | 621.74 |
InChIKey | KZKKOFOHHAOQHO-IXCJQBJRSA-N |
hba | 6 |
hbd | 1 |
lipinski_violations | 2 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 8 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.109237 |
logp | 6.4986 |
mw | 621.747 |
molecular_weight | 621.747 |
qed_score | 0.309237 |
tpsa | 86.79 |
s_m_entry_id | 3911 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | O=S(=O)(c1ccccc1)N(c1cc(C(F)(F)F)ccc1N[C@@H]1CCCC[C@H]1N1CCCCC1)S(=O)(=O)c1ccccc1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | nu00380159 |
koda_racka_fkkt | 52 |
koda_viale | NUOB206534 |
literaturno_znana_neznana_ali_komercialna_spojina | N |
lokacija | FKKT hladilnik 1 |
masa_mg | 54 |
pozicija_v_racku_in_rack | 52C3 |
raziskovalec | Klara Klemenčič |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |