Formula | C18H20N2O3 |
MW | 312.37 |
InChIKey | YELLTHPONFIWRV-FEAKQIBJSA-N |
hba | 4 |
hbd | 0 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 3 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.804124 |
logp | 2.3668 |
mw | 312.369 |
molecular_weight | 312.369 |
qed_score | 0.804124 |
tpsa | 49.85 |
s_m_entry_id | 3987 |
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)CC(C)(C)N2[C@H]1/C=C/c1ccccc1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | nu00380158 |
koda_racka_fkkt | 53 |
koda_viale | nuob207834 |
literaturno_znana_neznana_ali_komercialna_spojina | z |
lokacija | FKKT hladilnik 1 |
masa_mg | 5 |
pozicija_v_racku_in_rack | 53A7 |
raziskovalec | Ines Kulašić |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |