Formula | C20H14N2O4 |
MW | 346.34 |
InChIKey | OOXZDTFBMYUAHA-JMPLCFMRSA-N |
hba | 5 |
hbd | 0 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 3 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.280079 |
logp | 2.48328 |
mw | 346.342 |
molecular_weight | 346.342 |
qed_score | 0.280079 |
tpsa | 87.47 |
s_m_entry_id | 137 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | N#C/C=C1\C[C@@H](C(=O)Oc2ccccc2)N(C(=O)c2ccccc2)C1=O |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325924 |
koda_racka_fkkt | 3 |
koda_viale | NUMB141567 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 19 |
pozicija_v_racku_in_rack | 3B12 |
raziskovalec | ? |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |