Formula | C13H16N4O2 |
MW | 260.3 |
InChIKey | RPSFNKPDLKPXSR-GHMZBOCLSA-N |
hba | 5 |
hbd | 2 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 3 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.639518 |
logp | 2.14828 |
mw | 260.297 |
molecular_weight | 260.297 |
qed_score | 0.639518 |
tpsa | 104.98 |
s_m_entry_id | 3904 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | N#Cc1ccc([N+](=O)[O-])c(N[C@@H]2CCCC[C@H]2N)c1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | nu00380159 |
koda_racka_fkkt | 52 |
koda_viale | numb135973 |
literaturno_znana_neznana_ali_komercialna_spojina | Z |
lokacija | FKKT hladilnik 1 |
masa_mg | 64 |
pozicija_v_racku_in_rack | 52B8 |
raziskovalec | Ana Golob |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |