Formula | C30H27N3O5 |
MW | 509.56 |
InChIKey | OISCGFKHWHDNBD-OYUWMTPXSA-N |
hba | 6 |
hbd | 1 |
lipinski_violations | 1 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 6 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.298159 |
logp | 4.5369 |
mw | 509.562 |
molecular_weight | 509.562 |
qed_score | 0.298159 |
tpsa | 91.67 |
s_m_entry_id | 3989 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | COC(=O)C1=CN2C(=O)[C@H](/N=C(\O)c3ccccc3)[C@@H](c3ccc(OC)cc3)N2[C@H](c2ccccc2)C=C1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | nu00380158 |
koda_racka_fkkt | 53 |
koda_viale | nuob207843 |
literaturno_znana_neznana_ali_komercialna_spojina | n |
lokacija | FKKT hladilnik 1 |
masa_mg | 18 |
pozicija_v_racku_in_rack | 53A9 |
raziskovalec | Ines Kulašić |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |