Formula | C10H9N3O5 |
MW | 251.2 |
InChIKey | BZLSJOIMHBNIQV-UHFFFAOYSA-N |
hba | 7 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 2 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.728015 |
logp | -0.4042 |
mw | 251.198 |
molecular_weight | 251.198 |
qed_score | 0.728015 |
tpsa | 102.76 |
s_m_entry_id | 58 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ok06337 |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | COC(=O)c1c[nH]c2c(C(=O)OC)cnn2c1=O |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00246861 |
koda_racka_fkkt | 1 |
koda_viale | NUJD034194 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 171 |
pozicija_v_racku_in_rack | 1ee10 |
raziskovalec | Miha Drev |
raziskovalna_skupina | Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |