Formula | C13H12ClF3N4O4 |
MW | 380.71 |
InChIKey | XXVXINSOHSWWLE-BQBZGAKWSA-N |
hba | 7 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 5 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.694524 |
logp | 0.3705 |
mw | 380.71 |
molecular_weight | 380.71 |
qed_score | 0.694524 |
tpsa | 100.43 |
s_m_entry_id | 1228 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | COC(=O)[C@H](CC(=O)[C@@H]1CN=C2C=CC(Cl)=NN21)NC(=O)C(F)(F)F |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | R000045557 |
koda_racka_fkkt | 17 |
koda_viale | NA0019512746 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 554 |
pozicija_v_racku_in_rack | 17H4 |
raziskovalec | J. Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 2 mL |