Formula | C12H10ClN7 |
MW | 287.71 |
InChIKey | IFFNIHWCRZAGFB-HOTUBEGUSA-N |
hba | 7 |
hbd | 0 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 1 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.80335 |
logp | 1.9205 |
mw | 287.714 |
molecular_weight | 287.714 |
qed_score | 0.80335 |
tpsa | 80.68 |
s_m_entry_id | 2977 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | C[C@]1(c2ccccc2)N=N[C@@H]2C(Cl)=Nn3nnnc3[C@H]21 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | TS01040351 |
koda_racka_fkkt | 40 |
koda_viale | NA0031284735 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 790 |
pozicija_v_racku_in_rack | 40G1 |
raziskovalec | Branko Stanovnik |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 2 mL |