Formula | C30H31N3O5 |
MW | 513.59 |
InChIKey | KJZCIFBSKWWSRZ-CAVUDBOASA-N |
hba | 6 |
hbd | 2 |
lipinski_violations | 1 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 7 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.468524 |
logp | 3.6183 |
mw | 513.594 |
molecular_weight | 513.594 |
qed_score | 0.468524 |
tpsa | 99.18 |
s_m_entry_id | 3870 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | KT27381 |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CCC[C@@]1(O)[C@H](C(=O)OC)[C@@H](c2ccccc2)N2[C@@H](c3ccccc3)[C@H](NC(=O)c3ccccc3)C(=O)N21 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00380160 |
koda_racka_fkkt | 51 |
koda_viale | nuob206969 |
literaturno_znana_neznana_ali_komercialna_spojina | Z |
lokacija | FKKT hladilnik 1 |
masa_mg | 24 |
pozicija_v_racku_in_rack | 51G9 |
raziskovalec | Lidija Pezdirc |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |