Formula | C15H11ClN4O2 |
MW | 314.73 |
InChIKey | RYSUSHLGXHYCMY-DHZHZOJOSA-N |
hba | 6 |
hbd | 1 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 3 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.535279 |
logp | 2.69532 |
mw | 314.732 |
molecular_weight | 314.732 |
qed_score | 0.535279 |
tpsa | 76.47 |
s_m_entry_id | 1221 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | Cc1cc(Cl)nc(N/C=C2/N=C(c3ccccc3)OC2=O)n1 |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | R000045557 |
koda_racka_fkkt | 17 |
koda_viale | NA0019512745 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno znana |
lokacija | FKKT hladilnik 1 |
masa_mg | 716 |
pozicija_v_racku_in_rack | 17G5 |
raziskovalec | J. Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 2 mL |