Formula | C18H13N3O6 |
MW | 367.32 |
InChIKey | CALXVQBBFFBZTK-SOFGYWHQSA-N |
hba | 7 |
hbd | 3 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 6 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.605083 |
logp | 2.6611 |
mw | 367.317 |
molecular_weight | 367.317 |
qed_score | 0.605083 |
tpsa | 134.67 |
s_m_entry_id | 921 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | O=C(Nc1cc(C(=O)O)c(/C=C/Nc2ccon2)oc1=O)c1ccccc1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00321365 |
koda_racka_fkkt | 14 |
koda_viale | NULW764083 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 36 |
pozicija_v_racku_in_rack | 14F2 |
raziskovalec | J. Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 0,5 mL |