Formula | C28H27N3O4 |
MW | 469.54 |
InChIKey | PJHWOXBNMCSNBK-CBUXHAPBSA-N |
hba | 5 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 5 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.577262 |
logp | 3.6622 |
mw | 469.541 |
molecular_weight | 469.541 |
qed_score | 0.577262 |
tpsa | 78.95 |
s_m_entry_id | 854 |
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@@]1(C)C[C@H](c2ccccc2)N2[C@H](c3ccccc3)[C@@H](NC(=O)c3ccccc3)C(=O)N21 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325922 |
koda_racka_fkkt | 12 |
koda_viale | NUMB137519 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 11 |
pozicija_v_racku_in_rack | 12F7 |
raziskovalec | Ana Novak |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |