Formula | C28H29N3O5 |
MW | 487.55 |
InChIKey | BZTYJHHEYUCIRJ-VWLOTQADSA-N |
hba | 5 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 9 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.474434 |
logp | 4.6578 |
mw | 487.556 |
molecular_weight | 487.556 |
qed_score | 0.474434 |
tpsa | 88.18 |
s_m_entry_id | 714 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | O=C1C[C@H](CCN(Cc2ccccc2)C(=O)OCc2ccccc2)N(C(=O)OCc2ccccc2)N1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325919 |
koda_racka_fkkt | 9 |
koda_viale | NUMB140115 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 338 |
pozicija_v_racku_in_rack | 9G2 |
raziskovalec | ? |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Poltrdna spojina |
velikost_viale | 1 mL |