Formula | C30H29Cl2N3O5 |
MW | 582.48 |
InChIKey | KETZFZAKYASQKE-UWTOQXADSA-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 | 0.383933 |
logp | 4.9251 |
mw | 582.484 |
molecular_weight | 582.484 |
qed_score | 0.383933 |
tpsa | 99.18 |
s_m_entry_id | 3854 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | KT27438 |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CCC[C@]1(O)[C@H](C(=O)OC)[C@@H](c2ccc(Cl)cc2Cl)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 | nuob207737 |
literaturno_znana_neznana_ali_komercialna_spojina | z |
lokacija | FKKT hladilnik 1 |
masa_mg | 134 |
pozicija_v_racku_in_rack | 51F5 |
raziskovalec | Lidija Pezdirc |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |