Formula | C26H27N5O2 |
MW | 441.53 |
InChIKey | BIKKVGQQYVWEKI-HXUWFJFHSA-N |
hba | 5 |
hbd | 0 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 4 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.622519 |
logp | 3.0517 |
mw | 441.535 |
molecular_weight | 441.535 |
qed_score | 0.622519 |
tpsa | 69.64 |
s_m_entry_id | 3630 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CN1CCN(C(=O)c2cnc(-c3ccccc3)nc2[C@@H]2CC(=O)N(c3ccccc3)C2)CC1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | nu00325918 |
koda_racka_fkkt | 49 |
koda_viale | numb134822 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 0 |
pozicija_v_racku_in_rack | 49EE11 |
raziskovalec | Jurij Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |