Formula | C9H10ClN5O |
MW | 239.66 |
InChIKey | HOBHQHZABCETDQ-UHFFFAOYSA-N |
hba | 6 |
hbd | 2 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 3 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.815221 |
logp | 0.5225 |
mw | 239.666 |
molecular_weight | 239.666 |
qed_score | 0.815221 |
tpsa | 89.85 |
s_m_entry_id | 3620 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | NCCc1cnn(-c2ccc(Cl)nn2)c1O |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | nu00325918 |
koda_racka_fkkt | 49 |
koda_viale | nume541263 |
literaturno_znana_neznana_ali_komercialna_spojina | litearutrno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 26 |
pozicija_v_racku_in_rack | 49A10 |
raziskovalec | Jurij Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |