Formula | C18H17N5O7 |
MW | 415.36 |
InChIKey | XNFDROKFPMKQIE-SUIFULHWSA-N |
hba | 8 |
hbd | 5 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 9 |
veber_rule | 0 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.11727 |
logp | 0.2348 |
mw | 415.362 |
molecular_weight | 415.362 |
qed_score | 0.21727 |
tpsa | 183.79 |
s_m_entry_id | 3772 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | O=C(N[C@@H](CO)C(=O)O)/C(=C/Nc1ncccc1[N+](=O)[O-])NC(=O)c1ccccc1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | nu00325926 |
koda_racka_fkkt | 50 |
koda_viale | nume541148 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 20 |
pozicija_v_racku_in_rack | 50G6 |
raziskovalec | Jurij Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |