Formula | C11H17NO |
MW | 179.26 |
InChIKey | WBNRGDQZHBTRKB-RQXUWAFZSA-N |
hba | 2 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 0 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.576624 |
logp | 1.8542 |
mw | 179.263 |
molecular_weight | 179.263 |
qed_score | 0.576624 |
tpsa | 43.09 |
s_m_entry_id | 1218 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CC1(C)[C@@H]2CC[C@@]1(C)C(=O)/C2=C\N |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00321366 |
koda_racka_fkkt | 18 |
koda_viale | NULW764889 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 13 |
pozicija_v_racku_in_rack | 18B4 |
raziskovalec | J. Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 0,5 mL |