Formula | C12H12ClN5O4 |
MW | 325.71 |
InChIKey | CCBAWCWKWRLAOA-UHFFFAOYSA-N |
hba | 8 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 1 |
veber_rule | 0 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.347735 |
logp | -3.953 |
mw | 325.712 |
molecular_weight | 325.712 |
qed_score | 0.447735 |
tpsa | 153.07 |
s_m_entry_id | 3412 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | Cn1nc(-c2ccccc2)[n+]2nc(N)ccc12.[O-][Cl+3]([O-])([O-])[O-] |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00329463 |
koda_racka_fkkt | 47 |
koda_viale | NUME537923 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 98 |
pozicija_v_racku_in_rack | 47A7 |
raziskovalec | Branko Stanovnik |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |