Warning: session_write_close() [function.session-write-close]: open(/tmp/session/sess_nkad6okiofejsbefq1ci0768c6, O_RDWR) failed: No such file or directory (2) in /domains/zinc12/htdocs/lib/zinc/user/ZincAuthentication.php on line 109

Warning: session_write_close() [function.session-write-close]: Failed to write session data (files). Please verify that the current setting of session.save_path is correct (/tmp/session) in /domains/zinc12/htdocs/lib/zinc/user/ZincAuthentication.php on line 109
Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

33686230
33686230
16648237
16648237
16648288
16648288

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(1H-indol-3-yl)ethyl]-2-(2-oxo-3-phenyl-imidazolidin-1-yl)acetamide N-[2-(1H-indol-3-yl)ethyl]-2-(2-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.36 9.11 -24.02 2 6 0 68 362.433 6 ↓

Analogs

33686230
33686230
33763717
33763717
16646439
16646439

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(1H-indol-3-yl)ethyl]-2-[2-oxo-3-(p-tolyl)imidazolidin-1-yl]acetamide N-[2-(1H-indol-3-yl)ethyl]-2-[2-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.81 9.79 -24.06 2 6 0 68 376.46 6 ↓

Analogs

33697088
33697088
33738619
33738619
16646404
16646404

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[3-(4-fluorophenyl)-2-oxo-imidazolidin-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide 2-[3-(4-fluorophenyl)-2-oxo-imid…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.52 9.18 -22.49 2 6 0 68 380.423 6 ↓

Analogs

16648243
16648243
16648309
16648309
16648345
16648345

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[3-(2-fluorophenyl)-2-oxo-imidazolidin-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide 2-[3-(2-fluorophenyl)-2-oxo-imid…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.47 9.46 -23.48 2 6 0 68 380.423 6 ↓

Analogs

33591151
33591151
33733572
33733572
16646437
16646437

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[3-(3-chlorophenyl)-2-oxo-imidazolidin-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide 2-[3-(3-chlorophenyl)-2-oxo-imid…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.01 9.63 -20.79 2 6 0 68 396.878 6 ↓

Analogs

33697088
33697088
16646399
16646399
16646407
16646407

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[3-(3,4-difluorophenyl)-2-oxo-imidazolidin-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide 2-[3-(3,4-difluorophenyl)-2-oxo-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.61 9.24 -20.99 2 6 0 68 398.413 6 ↓

Analogs

33580277
33580277
33678958
33678958
33700418
33700418

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(1H-indol-3-yl)ethyl]-2-[3-(4-methoxyphenyl)-2-oxo-imidazolidin-1-yl]acetamide N-[2-(1H-indol-3-yl)ethyl]-2-[3-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.42 8.41 -24.35 2 7 0 78 392.459 7 ↓

Analogs

33717313
33717313
33785554
33785554
16648262
16648262

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(1H-indol-3-yl)ethyl]-2-[3-(2-methoxyphenyl)-2-oxo-imidazolidin-1-yl]acetamide N-[2-(1H-indol-3-yl)ethyl]-2-[3-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.37 8.76 -25.51 2 7 0 78 392.459 7 ↓

Analogs

33580277
33580277
33678958
33678958
33700418
33700418

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[3-(4-ethoxyphenyl)-2-oxo-imidazolidin-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide 2-[3-(4-ethoxyphenyl)-2-oxo-imid…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.79 9.33 -24.17 2 7 0 78 406.486 8 ↓

Analogs

33580277
33580277
16646445
16646445

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[3-(3,4-dimethoxyphenyl)-2-oxo-imidazolidin-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide 2-[3-(3,4-dimethoxyphenyl)-2-oxo…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.01 8.32 -26.12 2 8 0 87 422.485 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[3-(2,5-dimethoxyphenyl)-2-oxo-imidazolidin-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide 2-[3-(2,5-dimethoxyphenyl)-2-oxo…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.40 8.05 -27.6 2 8 0 87 422.485 8 ↓

Analogs

33686230
33686230
33763717
33763717
16648237
16648237

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(1H-indol-3-yl)ethyl]-2-[3-(4-isopropylphenyl)-2-oxo-imidazolidin-1-yl]acetamide N-[2-(1H-indol-3-yl)ethyl]-2-[3-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.87 11.03 -23.71 2 6 0 68 404.514 7 ↓

Parameters Provided:

ring.id = 558504
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 558504 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?ring.id=558504&filter.purchasability=annotated

Embed Link to Results