Warning: session_write_close() [function.session-write-close]: open(/tmp/session/sess_t3m7p6lkej4g3rl7794glue2v0, 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

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-1-[4-(2,4-difluorophenyl)sulfonylpiperazine-1-carbonyl]-2-methyl-propyl]-4-methoxy-benzamide N-[(1S)-1-[4-(2,4-difluorophenyl…

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) 2.70 6.36 -14.29 1 8 0 96 495.548 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-hydroxy-N-[2-[4-[4-[(1R)-1-methylpropyl]phenyl]sulfonylpiperazin-1-yl]-2-oxo-ethyl]benzamide 4-hydroxy-N-[2-[4-[4-[(1R)-1-met…

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) 2.66 4.62 -16.19 2 8 0 107 459.568 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-hydroxy-N-[2-[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazin-1-yl]-2-oxo-ethyl]benzamide 4-hydroxy-N-[2-[4-[4-[(1S)-1-met…

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) 2.66 4.62 -16.23 2 8 0 107 459.568 7 ↓

Analogs

25128799
25128799
6237086
6237086

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-2-fluoro-benzamide N-[2-[4-(2,5-dimethylphenyl)sulf…

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) 2.22 5.93 -18.35 1 7 0 87 433.505 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-fluoro-N-[2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]benzamide 2-fluoro-N-[2-[4-(2-fluorophenyl…

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) 1.51 4.84 -19.3 1 7 0 87 423.441 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-3-methyl-benzamide N-[2-[4-(3,4-dimethylphenyl)sulf…

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) 2.53 6.77 -15.71 1 7 0 87 429.542 5 ↓

Analogs

14228066
14228066
26540886
26540886
26541525
26541525
36892318
36892318

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methoxy-N-[(1S)-2-methyl-1-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]propyl]benzamide 4-methoxy-N-[(1S)-2-methyl-1-[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) 2.90 6.6 -14.63 1 8 0 96 473.595 7 ↓

Analogs

26540886
26540886
26541525
26541525
36892318
36892318
14228063
14228063

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methoxy-N-[(1R)-2-methyl-1-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]propyl]benzamide 4-methoxy-N-[(1R)-2-methyl-1-[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) 2.90 7.02 -14.73 1 8 0 96 473.595 7 ↓

Analogs

14242017
14242017

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-1-methyl-2-oxo-ethyl]-3-methyl-benzamide N-[(1R)-2-[4-(4-bromophenyl)sulf…

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) 2.85 6.89 -14.8 1 7 0 87 494.411 5 ↓

Analogs

14242016
14242016

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-1-methyl-2-oxo-ethyl]-3-methyl-benzamide N-[(1S)-2-[4-(4-bromophenyl)sulf…

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) 2.85 6.81 -14.77 1 7 0 87 494.411 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-3-fluoro-benzamide N-[2-[4-(2,5-dimethylphenyl)sulf…

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) 2.25 5.92 -16.31 1 7 0 87 433.505 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-chloro-N-[2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]benzamide 2-chloro-N-[2-[4-(2-chlorophenyl…

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) 2.54 5.46 -16.76 1 7 0 87 456.351 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-4-methoxy-3-nitro-benzamide N-[2-[4-(2-chlorophenyl)sulfonyl…

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) 1.86 5.7 -23.12 1 11 0 142 496.929 7 ↓

Analogs

15699507
15699507

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-1-[4-(2-chlorophenyl)sulfonylpiperazine-1-carbonyl]-3-methyl-butyl]-2-methyl-benzamide N-[(1R)-1-[4-(2-chlorophenyl)sul…

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) 3.95 8.67 -14.07 1 7 0 87 492.041 7 ↓

Analogs

15699505
15699505

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-1-[4-(2-chlorophenyl)sulfonylpiperazine-1-carbonyl]-3-methyl-butyl]-2-methyl-benzamide N-[(1S)-1-[4-(2-chlorophenyl)sul…

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) 3.95 8.5 -13.73 1 7 0 87 492.041 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-4-fluoro-benzamide N-[2-[4-(3,4-dimethylphenyl)sulf…

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) 2.27 6.15 -14.81 1 7 0 87 433.505 5 ↓

Analogs

6928388
6928388

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-4-methyl-benzamide N-[2-[4-(3,4-dimethylphenyl)sulf…

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) 2.56 6.76 -15.27 1 7 0 87 429.542 5 ↓

Analogs

25447863
25447863

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[4-(2,3-dichlorophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]benzamide N-[2-[4-(2,3-dichlorophenyl)sulf…

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) 2.54 5.42 -16.05 1 7 0 87 456.351 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4,5-trimethoxy-N-[2-oxo-2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethyl]benzamide 3,4,5-trimethoxy-N-[2-oxo-2-[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) 1.76 5.51 -23.19 1 10 0 114 545.536 9 ↓

Parameters Provided:

ring.id = 143168
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 = 143168 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?ring.id=143168&filter.purchasability=annotated

Embed Link to Results