Formula | C22H18N4 |
MW | 338.41 |
InChIKey | OZMKQDQGTJVESD-UHFFFAOYSA-N |
hba | 4 |
hbd | 0 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 3 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.533826 |
logp | 4.88444 |
mw | 338.414 |
molecular_weight | 338.414 |
qed_score | 0.533826 |
tpsa | 51.56 |
s_m_entry_id | 115 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ok23359 |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | Cc1cccc(-c2cccc(-c3cccc(C)n3)c2-c2ncccn2)n1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325924 |
koda_racka_fkkt | 3 |
koda_viale | NUMB141150 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 6 |
pozicija_v_racku_in_rack | 3A1 |
raziskovalec | Miha Drev |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |