Formula | C19H19N3O6 |
MW | 385.38 |
InChIKey | HAMJKYCLAYPDHK-CMDGGOBGSA-N |
hba | 7 |
hbd | 3 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 8 |
veber_rule | 0 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.47817 |
logp | 1.1144 |
mw | 385.376 |
molecular_weight | 385.376 |
qed_score | 0.57817 |
tpsa | 140.73 |
s_m_entry_id | 900 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CCOC(=O)c1cc(NC(=O)c2ccccc2)c(=O)oc1/C=C/NCC(N)=O |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325922 |
koda_racka_fkkt | 12 |
koda_viale | NUMB136990 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 255 |
pozicija_v_racku_in_rack | 12H8 |
raziskovalec | J. Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 0,5 mL |