Formula | C20H21N3O2 |
MW | 335.4 |
InChIKey | INTPRBGKOQIAPC-WSNIPZGUSA-N |
hba | 2 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 5 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.852719 |
logp | 3.2386 |
mw | 335.407 |
molecular_weight | 335.407 |
qed_score | 0.852719 |
tpsa | 63.28 |
s_m_entry_id | 684 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CCC/C=[N+]1\[N-]C(=O)[C@@H](NC(=O)c2ccccc2)[C@H]1c1ccccc1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325919 |
koda_racka_fkkt | 9 |
koda_viale | NUMB140337 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 32 |
pozicija_v_racku_in_rack | 9EE11 |
raziskovalec | ? |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |