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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: 2-[(1,1-dioxothian-4-yl)amino]-N-phenyl-acetamide 2-[(1,1-dioxothian-4-yl)amino]-N…

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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) 1.06 2.11 -65.94 3 5 1 80 283.373 4 ↓
Hi High (pH 8-9.5) 1.06 0.92 -19.12 2 5 0 75 282.365 4 ↓

Analogs

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Popular Name: 2-[(1,1-dioxothian-4-yl)amino]-N-(4-methoxyphenyl)acetamide 2-[(1,1-dioxothian-4-yl)amino]-N…

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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) 1.12 1.4 -68.31 3 6 1 89 313.399 5 ↓
Hi High (pH 8-9.5) 1.12 0.2 -20.33 2 6 0 85 312.391 5 ↓

Analogs

37999670
37999670
37999671
37999671

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Popular Name: 2-[(1,1-dioxothian-4-yl)amino]-N-(2-fluorophenyl)acetamide 2-[(1,1-dioxothian-4-yl)amino]-N…

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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) 1.18 2.23 -64.7 3 5 1 80 301.363 4 ↓
Hi High (pH 8-9.5) 1.18 1.03 -17.49 2 5 0 75 300.355 4 ↓

Analogs

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Popular Name: N-(2-chlorophenyl)-2-[(1,1-dioxothian-4-yl)amino]acetamide N-(2-chlorophenyl)-2-[(1,1-dioxo…

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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) 1.69 2.73 -64.13 3 5 1 80 317.818 4 ↓
Hi High (pH 8-9.5) 1.69 1.54 -17.01 2 5 0 75 316.81 4 ↓

Analogs

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Popular Name: N-(2-bromophenyl)-2-[(1,1-dioxothian-4-yl)amino]acetamide N-(2-bromophenyl)-2-[(1,1-dioxot…

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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) 1.82 2.86 -64.04 3 5 1 80 362.269 4 ↓
Hi High (pH 8-9.5) 1.82 1.67 -16.88 2 5 0 75 361.261 4 ↓

Analogs

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Popular Name: 2-[(1,1-dioxothian-4-yl)amino]-N-(4-fluorophenyl)acetamide 2-[(1,1-dioxothian-4-yl)amino]-N…

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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) 1.22 2.17 -69.75 3 5 1 80 301.363 4 ↓
Hi High (pH 8-9.5) 1.22 0.97 -19.97 2 5 0 75 300.355 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-bromophenyl)-2-[(1,1-dioxothian-4-yl)amino]acetamide N-(4-bromophenyl)-2-[(1,1-dioxot…

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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) 1.87 2.73 -68.93 3 5 1 80 362.269 4 ↓
Hi High (pH 8-9.5) 1.87 1.53 -19.3 2 5 0 75 361.261 4 ↓

Analogs

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Popular Name: 2-[(1,1-dioxothian-4-yl)amino]-N-(3-fluorophenyl)acetamide 2-[(1,1-dioxothian-4-yl)amino]-N…

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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) 1.20 2.17 -68.39 3 5 1 80 301.363 4 ↓
Hi High (pH 8-9.5) 1.20 0.99 -18.61 2 5 0 75 300.355 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-chlorophenyl)-2-[(1,1-dioxothian-4-yl)amino]acetamide N-(4-chlorophenyl)-2-[(1,1-dioxo…

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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) 1.74 2.62 -68.82 3 5 1 80 317.818 4 ↓
Hi High (pH 8-9.5) 1.74 1.42 -19.34 2 5 0 75 316.81 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1,1-dioxothian-4-yl)amino]-N-(3-methoxyphenyl)acetamide 2-[(1,1-dioxothian-4-yl)amino]-N…

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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) 1.09 1.4 -67.41 3 6 1 89 313.399 5 ↓
Hi High (pH 8-9.5) 1.09 0.21 -19.82 2 6 0 85 312.391 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1,1-dioxothian-4-yl)amino]-N-(2-methoxyphenyl)acetamide 2-[(1,1-dioxothian-4-yl)amino]-N…

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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) 1.07 1.55 -63.99 3 6 1 89 313.399 5 ↓
Hi High (pH 8-9.5) 1.07 0.36 -18.51 2 6 0 85 312.391 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-chlorophenyl)-2-[(1,1-dioxothian-4-yl)amino]acetamide N-(3-chlorophenyl)-2-[(1,1-dioxo…

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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) 1.71 2.64 -67.53 3 5 1 80 317.818 4 ↓
Hi High (pH 8-9.5) 1.71 1.44 -18.17 2 5 0 75 316.81 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-bromophenyl)-2-[(1,1-dioxothian-4-yl)amino]acetamide N-(3-bromophenyl)-2-[(1,1-dioxot…

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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) 1.84 2.73 -67.44 3 5 1 80 362.269 4 ↓
Hi High (pH 8-9.5) 1.84 1.54 -18.09 2 5 0 75 361.261 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1,1-dioxothian-4-yl)amino]-N-(p-tolyl)acetamide 2-[(1,1-dioxothian-4-yl)amino]-N…

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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 2.78 -65.9 3 5 1 80 297.4 4 ↓
Hi High (pH 8-9.5) 1.51 1.58 -19.29 2 5 0 75 296.392 4 ↓

Analogs

37999656
37999656
37999657
37999657

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1,1-dioxothian-4-yl)amino]-N-(m-tolyl)acetamide 2-[(1,1-dioxothian-4-yl)amino]-N…

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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) 1.48 2.79 -65.9 3 5 1 80 297.4 4 ↓
Hi High (pH 8-9.5) 1.48 1.58 -19.24 2 5 0 75 296.392 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1,1-dioxothian-4-yl)amino]-N-(o-tolyl)acetamide 2-[(1,1-dioxothian-4-yl)amino]-N…

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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) 1.46 3.02 -66.48 3 5 1 80 297.4 4 ↓
Hi High (pH 8-9.5) 1.46 1.82 -19.27 2 5 0 75 296.392 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[(1,1-dioxothian-4-yl)amino]-N-phenyl-propanamide (2S)-2-[(1,1-dioxothian-4-yl)ami…

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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) 1.02 2.63 -60.74 3 5 1 80 297.4 4 ↓

Analogs

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Popular Name: (2R)-2-[(1,1-dioxothian-4-yl)amino]-N-phenyl-propanamide (2R)-2-[(1,1-dioxothian-4-yl)ami…

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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) 1.02 2.6 -60.81 3 5 1 80 297.4 4 ↓

Parameters Provided:

ring.id = 89565
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 = 89565 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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