Formula | C16H16N6O3 |
MW | 340.34 |
InChIKey | VTAYZDZEJPMERC-QBFSEMIESA-N |
hba | 9 |
hbd | 3 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 7 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.335454 |
logp | 1.2438 |
mw | 340.343 |
molecular_weight | 340.343 |
qed_score | 0.335454 |
tpsa | 101.81 |
s_m_entry_id | 1195 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | COC(=O)/C(=C/NNc1ccc2nccn2n1)NOc1ccccc1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325920 |
koda_racka_fkkt | 15 |
koda_viale | NUMB136848 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 139 |
pozicija_v_racku_in_rack | 15G4 |
raziskovalec | J. Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |