Formula | C14H12F3N3O4 |
MW | 343.27 |
InChIKey | ALZKJDAZTVIJSA-JTQLQIEISA-N |
hba | 6 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 4 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.509052 |
logp | 1.04552 |
mw | 343.261 |
molecular_weight | 343.261 |
qed_score | 0.509052 |
tpsa | 89.77 |
s_m_entry_id | 1052 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | COC(=O)[C@@H](NC(=O)C(F)(F)F)C(=O)c1cnc2cc(C)ccn12 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | R000045565 |
koda_racka_fkkt | 13 |
koda_viale | NA0019512834 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 193 |
pozicija_v_racku_in_rack | 13G7 |
raziskovalec | J. Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 2 mL |