Formula | C30H28N2O6 |
MW | 512.56 |
InChIKey | CIOSGVVNATUUIH-UDYUQVTMSA-N |
hba | 7 |
hbd | 1 |
lipinski_violations | 1 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 9 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.265536 |
logp | 3.6036 |
mw | 512.562 |
molecular_weight | 512.562 |
qed_score | 0.265536 |
tpsa | 102.01 |
s_m_entry_id | 1175 |
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](Cc1ccccc1)N/C=C1\C(=O)[C@H](Cc2ccccc2)N(C(=O)OCc2ccccc2)C1=O |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325920 |
koda_racka_fkkt | 15 |
koda_viale | NUMB136945 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 79 |
pozicija_v_racku_in_rack | 15F10 |
raziskovalec | J. Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Poltrdna spojina |
velikost_viale | 1 mL |