Formula | C13H13IN4 |
MW | 352.18 |
InChIKey | YSHRCVQIYRUXNO-UHFFFAOYSA-M |
hba | 3 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 1 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.424325 |
logp | -1.588 |
mw | 352.179 |
molecular_weight | 352.179 |
qed_score | 0.424325 |
tpsa | 47.94 |
s_m_entry_id | 3402 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | Cn1c(-c2ccccc2)c[n+]2nc(N)ccc12.[I-] |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00329462 |
koda_racka_fkkt | 46 |
koda_viale | NUME537826 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 192 |
pozicija_v_racku_in_rack | 46H9 |
raziskovalec | Branko Stanovnik |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |