Formula | C23H25N3O |
MW | 359.47 |
InChIKey | KVHWVEANYOIQEQ-FCHUYYIVSA-N |
hba | 4 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 4 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.732617 |
logp | 4.71262 |
mw | 359.473 |
molecular_weight | 359.473 |
qed_score | 0.732617 |
tpsa | 40.76 |
s_m_entry_id | 3172 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CC1=NN(C)[C@H](c2ccccc2)[C@H]1Cc1c(C)cn(-c2ccccc2)c1O |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | TS01040335 |
koda_racka_fkkt | 42 |
koda_viale | NA0031284145 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 568 |
pozicija_v_racku_in_rack | 42G11 |
raziskovalec | Branko Stanovnik |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 2 mL |