Formula | C12H9Cl3N2O3 |
MW | 335.57 |
InChIKey | FDJPCYRJIAHPRS-UHFFFAOYSA-N |
hba | 5 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 3 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.868394 |
logp | 3.7148 |
mw | 335.574 |
molecular_weight | 335.574 |
qed_score | 0.868394 |
tpsa | 64.35 |
s_m_entry_id | 3792 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CCOC(=O)c1cnn(-c2c(Cl)cc(Cl)cc2Cl)c1O |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | nu00380160 |
koda_racka_fkkt | 51 |
koda_viale | nuob207551 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 65 |
pozicija_v_racku_in_rack | 51A2 |
raziskovalec | PRIYA KUMAR |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |