Formula | C24H29ClN6O8 |
MW | 564.98 |
InChIKey | OYKKNKNAZADUIJ-DEOSSOPVSA-N |
hba | 14 |
hbd | 0 |
lipinski_violations | 2 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 9 |
veber_rule | 0 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.0204879 |
logp | 1.6988 |
mw | 564.983 |
molecular_weight | 564.983 |
qed_score | 0.320488 |
tpsa | 154.76 |
s_m_entry_id | 3197 |
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[C@@]1(C(=O)OCC)C(C(=O)OCC)=C(C(=O)OCC)N2c3c(Cl)nn4ncnc4c3C(C)(C)N21 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00329467 |
koda_racka_fkkt | 44 |
koda_viale | NUME541917 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 124 |
pozicija_v_racku_in_rack | 44A6 |
raziskovalec | Branko Stanovnik |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |