Formula | C24H32Cl2N4O3 |
MW | 495.45 |
InChIKey | QAINCHRFTBVGKR-UHFFFAOYSA-N |
hba | 7 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 11 |
veber_rule | 0 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.222781 |
logp | 3.7752 |
mw | 495.451 |
molecular_weight | 495.451 |
qed_score | 0.322781 |
tpsa | 68.62 |
s_m_entry_id | 110 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | NOVA SPOJINA |
smiles | COC(=O)c1cnn(-c2ccccc2)c1CCNCc1ccc(OCCN(C)C)cc1.Cl.Cl |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00246861 |
koda_racka_fkkt | 1 |
koda_viale | NUMB140726 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 244 |
pozicija_v_racku_in_rack | 1H10 |
raziskovalec | ? |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |