Formula | C35H31N3O7 |
MW | 605.65 |
InChIKey | DQQVCFQBFVQNGP-FENKJPMWSA-N |
hba | 8 |
hbd | 2 |
lipinski_violations | 1 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 7 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.238825 |
logp | 4.0573 |
mw | 605.647 |
molecular_weight | 605.647 |
qed_score | 0.238825 |
tpsa | 125.48 |
s_m_entry_id | 3849 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | COc1ccc([C@@H]2[C@@H](C(=O)OC(=O)c3ccccc3)[C@@](C)(O)N3C(=O)[C@@H](NC(=O)c4ccccc4)[C@@H](c4ccccc4)N23)cc1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00380160 |
koda_racka_fkkt | 51 |
koda_viale | NUOB207311 |
literaturno_znana_neznana_ali_komercialna_spojina | N |
lokacija | FKKT hladilnik 1 |
masa_mg | 278 |
pozicija_v_racku_in_rack | 51000000000000.0 |
raziskovalec | Lidija Pezdirc |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |