Formula | C27H22N2O2 |
MW | 406.48 |
InChIKey | VVYRJMHLLMAEMC-UHFFFAOYSA-N |
hba | 4 |
hbd | 0 |
lipinski_violations | 1 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 5 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.370758 |
logp | 6.19122 |
mw | 406.485 |
molecular_weight | 406.485 |
qed_score | 0.370758 |
tpsa | 59.92 |
s_m_entry_id | 561 |
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)c(-c3ccc(C(C)=O)cc3)c2-c2ncccn2)cc1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00329469 |
koda_racka_fkkt | 7 |
koda_viale | NUMB135742 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 28 |
pozicija_v_racku_in_rack | 7H6 |
raziskovalec | Miha Drev |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |