Formula | C10H16N2O |
MW | 180.25 |
InChIKey | DOZDZBJNXFSROS-SDQBBNPISA-N |
hba | 1 |
hbd | 0 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 1 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.568403 |
logp | 2.0335 |
mw | 180.251 |
molecular_weight | 180.251 |
qed_score | 0.568403 |
tpsa | 34.18 |
s_m_entry_id | 3992 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CC(C)=C/C=[N+]1\[N-]C(=O)CC1(C)C |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | nu00380158 |
koda_racka_fkkt | 53 |
koda_viale | NUOB205137 |
literaturno_znana_neznana_ali_komercialna_spojina | n |
lokacija | FKKT hladilnik 1 |
masa_mg | 50 |
pozicija_v_racku_in_rack | 53A12 |
raziskovalec | Ines Kulašić |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |