Warning: session_write_close() [function.session-write-close]: open(/tmp/session/sess_ph9hijc1ram3n8d41a7l545k87, 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

36640851
36640851

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzhydryl-2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]-N-methyl-acetamide N-benzhydryl-2-[(4S)-4-(4-chloro…

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) 4.41 12.19 -15.65 1 6 0 70 461.949 6 ↓

Analogs

36640849
36640849

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzhydryl-2-[(4R)-4-(4-chlorophenyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]-N-methyl-acetamide N-benzhydryl-2-[(4R)-4-(4-chloro…

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) 4.41 12.19 -14.48 1 6 0 70 461.949 6 ↓

Analogs

36640880
36640880
36859440
36859440
16245984
16245984
36185704
36185704
3466771
3466771

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzhydryl-N-methyl-2-[(4S)-4-methyl-2,5-dioxo-4-phenyl-imidazolidin-1-yl]acetamide N-benzhydryl-N-methyl-2-[(4S)-4-…

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) 3.73 11.67 -15.91 1 6 0 70 427.504 6 ↓

Analogs

36859440
36859440
16245984
16245984
36640878
36640878
36185704
36185704
3466771
3466771

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzhydryl-N-methyl-2-[(4R)-4-methyl-2,5-dioxo-4-phenyl-imidazolidin-1-yl]acetamide N-benzhydryl-N-methyl-2-[(4R)-4-…

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) 3.73 11.67 -14.76 1 6 0 70 427.504 6 ↓

Analogs

36640884
36640884
14268751
14268751
12916870
12916870
12916875
12916875

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzhydryl-N-methyl-2-[(4R)-4-methyl-2,5-dioxo-4-(p-tolyl)imidazolidin-1-yl]acetamide N-benzhydryl-N-methyl-2-[(4R)-4-…

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) 4.18 12.37 -14.63 1 6 0 70 441.531 6 ↓

Analogs

36640882
36640882
14268751
14268751
12916870
12916870

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzhydryl-N-methyl-2-[(4S)-4-methyl-2,5-dioxo-4-(p-tolyl)imidazolidin-1-yl]acetamide N-benzhydryl-N-methyl-2-[(4S)-4-…

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) 4.18 12.37 -15.9 1 6 0 70 441.531 6 ↓

Analogs

36640993
36640993
3464367
3464367
3464372
3464372

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzhydryl-2-[(4S)-4-(4-chlorophenyl)-4-ethyl-2,5-dioxo-imidazolidin-1-yl]-N-methyl-acetamide N-benzhydryl-2-[(4S)-4-(4-chloro…

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) 4.91 13.27 -15.32 1 6 0 70 475.976 7 ↓

Analogs

36640990
36640990
3464367
3464367
3464372
3464372

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzhydryl-2-[(4R)-4-(4-chlorophenyl)-4-ethyl-2,5-dioxo-imidazolidin-1-yl]-N-methyl-acetamide N-benzhydryl-2-[(4R)-4-(4-chloro…

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) 4.91 13.17 -14.15 1 6 0 70 475.976 7 ↓

Analogs

36641007
36641007

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzhydryl-2-[(4S)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxo-imidazolidin-1-yl]-N-methyl-acetamide N-benzhydryl-2-[(4S)-4-ethyl-4-(…

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) 4.40 12.82 -15.83 1 6 0 70 459.521 7 ↓

Analogs

36641005
36641005

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzhydryl-2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxo-imidazolidin-1-yl]-N-methyl-acetamide N-benzhydryl-2-[(4R)-4-ethyl-4-(…

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) 4.40 12.72 -14.54 1 6 0 70 459.521 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzhydryl-2-[(4R)-4-(2-bromophenyl)-2,5-diketo-4-methyl-imidazolidin-1-yl]acetamide N-benzhydryl-2-[(4R)-4-(2-bromop…

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) 4.75 -1.17 -15.58 2 6 0 78 492.373 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzhydryl-2-[(4S)-4-(2-bromophenyl)-2,5-diketo-4-methyl-imidazolidin-1-yl]acetamide N-benzhydryl-2-[(4S)-4-(2-bromop…

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) 4.75 -1.21 -16.7 2 6 0 78 492.373 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4R)-4-methyl-2,5-dioxo-4-phenyl-imidazolidin-1-yl]-N-[(R)-phenyl(p-tolyl)methyl]acetamide 2-[(4R)-4-methyl-2,5-dioxo-4-phe…

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) 4.44 11.04 -16.3 2 6 0 79 427.504 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4R)-4-methyl-2,5-dioxo-4-phenyl-imidazolidin-1-yl]-N-[(S)-phenyl(p-tolyl)methyl]acetamide 2-[(4R)-4-methyl-2,5-dioxo-4-phe…

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) 4.44 11.04 -16.53 2 6 0 79 427.504 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4S)-4-methyl-2,5-dioxo-4-phenyl-imidazolidin-1-yl]-N-[(R)-phenyl(p-tolyl)methyl]acetamide 2-[(4S)-4-methyl-2,5-dioxo-4-phe…

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) 4.44 11.04 -15.15 2 6 0 79 427.504 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4S)-4-methyl-2,5-dioxo-4-phenyl-imidazolidin-1-yl]-N-[(S)-phenyl(p-tolyl)methyl]acetamide 2-[(4S)-4-methyl-2,5-dioxo-4-phe…

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) 4.44 11.04 -15.21 2 6 0 79 427.504 6 ↓

Parameters Provided:

ring.id = 106391
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 = 106391 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?ring.id=106391&filter.purchasability=annotated

Embed Link to Results