Formula | C19H16N2O |
MW | 288.35 |
InChIKey | WRNXCQOKUCKHFJ-UHFFFAOYSA-N |
hba | 3 |
hbd | 0 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 3 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.673944 |
logp | 4.32162 |
mw | 288.35 |
molecular_weight | 288.35 |
qed_score | 0.673944 |
tpsa | 42.85 |
s_m_entry_id | 603 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CC(=O)c1ccc(-c2ccc(C)cc2-c2ncccn2)cc1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | R000045563 |
koda_racka_fkkt | 10 |
koda_viale | NA0019513600 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 7 |
pozicija_v_racku_in_rack | 10B3 |
raziskovalec | Miha Drev |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 2 mL |