Formula | C33H39N3O9 |
MW | 621.69 |
InChIKey | LHQSJHMGUQVEMS-JHOUSYSJSA-N |
hba | 9 |
hbd | 1 |
lipinski_violations | 1 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 7 |
veber_rule | 0 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.17341 |
logp | 4.2153 |
mw | 621.687 |
molecular_weight | 621.687 |
qed_score | 0.27341 |
tpsa | 140.78 |
s_m_entry_id | 396 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | COC(=O)C1=CN(C(=O)OCc2ccccc2)[C@](COC(C)(C)C)([C@]2(NC(=O)OC(C)(C)C)C(=O)N(C)c3ccccc32)C1=O |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325925 |
koda_racka_fkkt | 4 |
koda_viale | NUME543793 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 15 |
pozicija_v_racku_in_rack | 4G12 |
raziskovalec | Luka Ciber |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |