Formula | C32H33N3O6 |
MW | 555.63 |
InChIKey | VGUJOAUPIQOIKH-VNGQLYDISA-N |
hba | 7 |
hbd | 1 |
lipinski_violations | 1 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 6 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.463664 |
logp | 3.59646 |
mw | 555.631 |
molecular_weight | 555.631 |
qed_score | 0.463664 |
tpsa | 105.25 |
s_m_entry_id | 647 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | COC(=O)[C@H]1[C@H](C(=O)OC)N2C(=O)[C@@H](NC(=O)c3ccccc3)[C@H](c3ccccc3)N2[C@H]1c1c(C)cc(C)cc1C |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325919 |
koda_racka_fkkt | 9 |
koda_viale | NUMB140294 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 64 |
pozicija_v_racku_in_rack | 9C3 |
raziskovalec | ? |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |