Formula | C14H18ClN5O3 |
MW | 339.78 |
InChIKey | RTLMRPGCPAZADQ-UHFFFAOYSA-N |
hba | 7 |
hbd | 2 |
lipinski_violations | 0 |
pains_match | 0 |
reactivity | 0 |
rotatable_bonds | 4 |
veber_rule | 1 |
b_m_subgroup_collapsed | 0 |
drug_score | 0.883832 |
logp | 2.0885 |
mw | 339.783 |
molecular_weight | 339.783 |
qed_score | 0.883832 |
tpsa | 102.16 |
s_m_entry_id | 1309 |
s_m_subgroup_title | test |
s_m_subgroupid | test |
nmr_koda | ni NMR podatkov |
nova_ali_stara_spojina | FKKT-FFA knjiznica |
smiles | CC(C)(C)OC(=O)NCCc1cnn(-c2ccc(Cl)nn2)c1O |
dodaten_komentar | 0 |
fizicna_ali_virtualna_spojina | fizicen vzorec |
koda_racka_1_nunc | NU00325920 |
koda_racka_fkkt | 15 |
koda_viale | NUMB134460 |
literaturno_znana_neznana_ali_komercialna_spojina | literaturno neznana |
lokacija | FKKT hladilnik 1 |
masa_mg | 157 |
pozicija_v_racku_in_rack | 15H8 |
raziskovalec | J. Svete |
raziskovalna_skupina | prof. dr. Jurij Svete |
trden_tekoc_vzorec_ali_raztopina | Trdna spojina |
velikost_viale | 1 mL |