Formula | C28H31N5O2 |
MW | 469.59 |
InChIKey | RTOWLLKDJIFPIG-JOCHJYFZSA-N |
hba | 5 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 8 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.506797 |
logp | 3.8798 |
mw | 469.589 |
molecular_weight | 469.589 |
qed_score | 0.506797 |
tpsa | 78.43 |
s_m_entry_id | 1073 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | O=C(NCCCN1CCCC1)c1cnc(-c2ccccc2)nc1[C@@H]1CC(=O)N(c2ccccc2)C1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325920 |
koda_racka_fkkt | 15 |
koda_viale | NUMB136750 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 1 |
pozicija_v_racku_in_rack | 15B8 |
raziskovalec | J. Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Poltrdna spojina |
velikost_viale | 1 mL |