Formula | C15H10N4O4 |
MW | 310.27 |
InChIKey | NHIPZVSXUIFEKT-UHFFFAOYSA-N |
hba | 6 |
hbd | 0 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 4 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.542518 |
logp | 3.3557 |
mw | 310.269 |
molecular_weight | 310.269 |
qed_score | 0.542518 |
tpsa | 104.1 |
s_m_entry_id | 109 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | NOVA SPOJINA |
smiles | O=[N+]([O-])c1ccc(-n2nccc2-c2ccccc2[N+](=O)[O-])cc1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00246861 |
koda_racka_fkkt | 1 |
koda_viale | NUMB140744 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 2 |
pozicija_v_racku_in_rack | 1H8 |
raziskovalec | ? |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |