Formula | C24H29N5O6S |
MW | 515.58 |
InChIKey | YEVGHNPKFXXYEV-XIDKLXSXSA-N |
hba | 9 |
hbd | 4 |
lipinski_violations | 1 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 12 |
veber_rule | 0 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.0431864 |
logp | 2.674 |
mw | 515.592 |
molecular_weight | 515.592 |
qed_score | 0.143186 |
tpsa | 159.61 |
s_m_entry_id | 3730 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CCOC(=O)c1cnc(SC)nc1N/C=C(\NC(=O)c1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | nu00325926 |
koda_racka_fkkt | 50 |
koda_viale | numb142900 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 30 |
pozicija_v_racku_in_rack | 50C12 |
raziskovalec | Jurij Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |