Formula | C23H20N4O2 |
MW | 384.44 |
InChIKey | AXGMGSUSJJZGOF-UHFFFAOYSA-N |
hba | 5 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 5 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.574786 |
logp | 3.1277 |
mw | 384.439 |
molecular_weight | 384.439 |
qed_score | 0.574786 |
tpsa | 68.92 |
s_m_entry_id | 274 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | O=C(NC1CC1)c1cn(-c2ccccc2)c(=O)c2cnn(Cc3ccccc3)c12 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325925 |
koda_racka_fkkt | 4 |
koda_viale | NUMB141655 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 61 |
pozicija_v_racku_in_rack | 4C11 |
raziskovalec | ? |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |