Formula | C34H40N4O6 |
MW | 600.71 |
InChIKey | WBPDGRYCMZJLRS-XNZDYLRFSA-N |
hba | 8 |
hbd | 2 |
lipinski_violations | 1 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 12 |
veber_rule | 0 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.111956 |
logp | 4.1656 |
mw | 600.716 |
molecular_weight | 600.716 |
qed_score | 0.211956 |
tpsa | 117.28 |
s_m_entry_id | 575 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CCOC(=O)/C(NC(=O)c1ccccc1)=C(C)/C=C/N1CCN(/C=C/C(C)=C(/NC(=O)c2ccccc2)C(=O)OCC)CC1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325919 |
koda_racka_fkkt | 9 |
koda_viale | NUMB141619 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 45 |
pozicija_v_racku_in_rack | 9A8 |
raziskovalec | ? |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |