Formula | C18H24N4O2 |
MW | 328.41 |
InChIKey | BIPDAQBJPLAKHQ-NONDJZLBSA-N |
hba | 6 |
hbd | 4 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 0 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.521873 |
logp | 0.6198 |
mw | 328.416 |
molecular_weight | 328.416 |
qed_score | 0.521873 |
tpsa | 82.26 |
s_m_entry_id | 3723 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | O=C1/C2=C\NCCN/C=C3/CC/C(=C/NCCN/C=C\1CC2)C3=O |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | nu00325926 |
koda_racka_fkkt | 50 |
koda_viale | numb142803 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 42 |
pozicija_v_racku_in_rack | 50C4 |
raziskovalec | Jurij Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |