Formula | C29H27Cl2N3O5 |
MW | 568.46 |
InChIKey | UYRPMCVAVKKWEY-LCIYGTCESA-N |
hba | 6 |
hbd | 2 |
lipinski_violations | 1 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 6 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.424272 |
logp | 4.535 |
mw | 568.457 |
molecular_weight | 568.457 |
qed_score | 0.424272 |
tpsa | 99.18 |
s_m_entry_id | 3852 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | KT27307 |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CC[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 | nuob207241 |
literaturno_znana_neznana_ali_komercialna_spojina | Z |
lokacija | FKKT hladilnik 1 |
masa_mg | 193 |
pozicija_v_racku_in_rack | 51F3 |
raziskovalec | Lidija Pezdirc |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |