Formula | C14H13Cl2N3O2 |
MW | 326.18 |
InChIKey | ICWQWOGQUTWOSS-FFSKBGEDSA-N |
hba | 3 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 3 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.525489 |
logp | 3.419 |
mw | 326.183 |
molecular_weight | 326.183 |
qed_score | 0.525489 |
tpsa | 61.77 |
s_m_entry_id | 738 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CC(C)/C=C1\NC(=O)N(/N=C/c2c(Cl)cccc2Cl)C1=O |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325922 |
koda_racka_fkkt | 12 |
koda_viale | NUMB138590 |
literaturno_znana_neznana_ali_komercialna_spojina | literatueni neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 138 |
pozicija_v_racku_in_rack | 12A1 |
raziskovalec | Ana Novak |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |