Formula | C16H21N3O2 |
MW | 287.36 |
InChIKey | QPVGBZXFVVQMTQ-FFSVYQOJSA-N |
hba | 3 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 2 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.896043 |
logp | 1.4739 |
mw | 287.363 |
molecular_weight | 287.363 |
qed_score | 0.896043 |
tpsa | 52.65 |
s_m_entry_id | 91 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | kt57930 |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CNC(=O)[C@]1(C)C[C@@H](c2ccccc2)N2[C@H](C)CC(=O)N21 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00246861 |
koda_racka_fkkt | 1 |
koda_viale | NUMB140692 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 85 |
pozicija_v_racku_in_rack | 1G9 |
raziskovalec | Andraž Oštrek |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | poltrdna spojina |
velikost_viale | 1 mL |