Formula | C24H19N5O3 |
MW | 425.45 |
InChIKey | KQHMUJOPRRCGKG-FANOUHKGSA-N |
hba | 7 |
hbd | 2 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 6 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.462833 |
logp | 3.46472 |
mw | 425.448 |
molecular_weight | 425.448 |
qed_score | 0.462833 |
tpsa | 105.57 |
s_m_entry_id | 1234 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | Cc1ccnc(N/C=C2/N=C(/C(=C/c3ccccc3)NC(=O)c3ccccc3)OC2=O)n1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325920 |
koda_racka_fkkt | 15 |
koda_viale | NUMB134266 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 264 |
pozicija_v_racku_in_rack | 15G10 |
raziskovalec | J. Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |