Formula | C26H29N5O2 |
MW | 443.55 |
InChIKey | PPEGCWHXHKUERU-FQEVSTJZSA-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 | 0.54045 |
logp | 3.3456 |
mw | 443.551 |
molecular_weight | 443.551 |
qed_score | 0.54045 |
tpsa | 78.43 |
s_m_entry_id | 1071 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CN(C)CCCNC(=O)c1cnc(-c2ccccc2)nc1[C@H]1CC(=O)N(c2ccccc2)C1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | R000045565 |
koda_racka_fkkt | 13 |
koda_viale | NA0019512821 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 124 |
pozicija_v_racku_in_rack | 13D12 |
raziskovalec | J. Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Poltrdna spojina |
velikost_viale | 2 mL |