Formula | C19H19ClN4O2 |
MW | 370.84 |
InChIKey | HSSNMVXWXZBTLD-NVIWZTKMSA-N |
hba | 6 |
hbd | 0 |
lipinski_violations | 1 |
pains_match | 1 |
reactivity | 0 |
rotatable_bonds | 2 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.422982 |
logp | 5.0025 |
mw | 370.84 |
molecular_weight | 370.84 |
qed_score | 0.422982 |
tpsa | 76.8 |
s_m_entry_id | 284 |
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)OC(=O)/C2=C/N=N/c1nnc(Cl)c2ccccc12 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325925 |
koda_racka_fkkt | 4 |
koda_viale | NUME544288 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 23 |
pozicija_v_racku_in_rack | 4ee4 |
raziskovalec | Uroš Grošelj |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |