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

10519045
10519045

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Popular Name: 1-[(5-chloro-2-thienyl)sulfonyl]-2-methyl-indoline-5-sulfonamide 1-[(5-chloro-2-thienyl)sulfonyl]…

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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) 2.69 -9.63 -15.29 2 6 0 97 392.911 3 ↓

Analogs

10519044
10519044

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(5-chloro-2-thienyl)sulfonyl]-2-methyl-indoline-5-sulfonamide 1-[(5-chloro-2-thienyl)sulfonyl]…

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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) 2.69 -9.93 -15.31 2 6 0 97 392.911 3 ↓

Analogs

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Popular Name: 1-[[5-(acetamidomethyl)-2-thienyl]sulfonyl]indoline-5-carboxylic 1-[[5-(acetamidomethyl)-2-thieny…

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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) 1.93 4.22 -58.31 1 7 -1 107 379.439 5 ↓

Analogs

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Popular Name: 1-(2-thienylsulfonyl)indoline-5-carboxylic 1-(2-thienylsulfonyl)indoline-5-…

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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) 2.78 5.02 -56.86 0 5 -1 78 308.36 3 ↓

Analogs

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Popular Name: 1-[[3,5-bis(methoxycarbonyl)-4-methyl-2-thienyl]sulfonyl]indoline-5-carboxylic 1-[[3,5-bis(methoxycarbonyl)-4-m…

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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) 2.98 7.12 -55.58 0 9 -1 130 438.459 7 ↓

Analogs

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Popular Name: 1-[(5-chloro-2-thienyl)sulfonyl]indoline-5-carboxylic 1-[(5-chloro-2-thienyl)sulfonyl]…

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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) 3.58 5.65 -52.49 0 5 -1 78 342.805 3 ↓

Analogs

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Popular Name: 1-[(5-bromo-2-thienyl)sulfonyl]indoline-5-carboxylic 1-[(5-bromo-2-thienyl)sulfonyl]i…

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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) 3.71 5.75 -52.44 0 5 -1 78 387.256 3 ↓

Analogs

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Popular Name: 1-[(5-methyl-2-thienyl)sulfonyl]indoline-5-carboxylic 1-[(5-methyl-2-thienyl)sulfonyl]…

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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) 3.00 5.86 -55.3 0 5 -1 78 322.387 3 ↓

Analogs

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Popular Name: 1-[(4-carboxy-2-thienyl)sulfonyl]indoline-5-carboxylic 1-[(4-carboxy-2-thienyl)sulfonyl…

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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) 2.28 4.64 -113.08 0 7 -2 118 351.361 4 ↓

Analogs

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Popular Name: N-[2-[5-(7-ethylindolin-1-yl)sulfonyl-2-thienyl]ethyl]acetamide N-[2-[5-(7-ethylindolin-1-yl)sul…

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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) 3.32 6.55 -17.32 1 5 0 66 378.519 6 ↓

Analogs

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Popular Name: (3R)-1-[(5-ethyl-2-thienyl)sulfonyl]indoline-3-carboxamide (3R)-1-[(5-ethyl-2-thienyl)sulfo…

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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) 2.21 3.68 -17.54 2 5 0 80 336.438 4 ↓

Analogs

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Popular Name: (3S)-1-[(5-ethyl-2-thienyl)sulfonyl]indoline-3-carboxamide (3S)-1-[(5-ethyl-2-thienyl)sulfo…

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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) 2.21 3.68 -15.45 2 5 0 80 336.438 4 ↓

Analogs

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Popular Name: 5-bromo-1-[(5-ethyl-2-thienyl)sulfonyl]indoline 5-bromo-1-[(5-ethyl-2-thienyl)su…

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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) 4.47 7.64 -9.4 0 3 0 37 372.309 3 ↓

Analogs

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Popular Name: 5-bromo-1-[(5-methyl-2-thienyl)sulfonyl]indoline 5-bromo-1-[(5-methyl-2-thienyl)s…

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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) 3.90 6.85 -9.79 0 3 0 37 358.282 2 ↓

Analogs

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Popular Name: 5-indolin-1-ylsulfonyl-3-methyl-thiophene-2-carboxylic 5-indolin-1-ylsulfonyl-3-methyl-…

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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) 3.08 6.67 -48.93 0 5 -1 78 322.387 3 ↓

Analogs

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Popular Name: 5-bromo-1-[(5-chloro-2-thienyl)sulfonyl]indoline 5-bromo-1-[(5-chloro-2-thienyl)s…

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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) 4.47 6.64 -7.97 0 3 0 37 378.7 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-bromo-1-(2-thienylsulfonyl)indoline 5-bromo-1-(2-thienylsulfonyl)ind…

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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) 3.67 6.01 -9.83 0 3 0 37 344.255 2 ↓

Parameters Provided:

ring.id = 10318
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 = 10318 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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