Formula | C11H20ClN3O2 |
MW | 261.75 |
InChIKey | IPRDEHBWXPJRQQ-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 | 0.834124 |
logp | 1.3477 |
mw | 261.753 |
molecular_weight | 261.753 |
qed_score | 0.834124 |
tpsa | 70.14 |
s_m_entry_id | 99 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | NOVA SPOJINA |
smiles | COC(=O)c1cnn(C(C)(C)C)c1CCN.Cl |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | R000045564 |
koda_racka_fkkt | 2 |
koda_viale | NA0019513074 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 684 |
pozicija_v_racku_in_rack | 2C4 |
raziskovalec | ? |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 2 mL |