UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

9306234
9306234
6758513
6758513
6760045
6760045
6760313
6760313

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Popular Name: 6,7-dimethyl-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 6,7-dimethyl-1-[2-(1-piperidyl)e…

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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) 2.64 8.93 -45.74 1 4 1 44 287.383 3 ↓

Analogs

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Popular Name: 6-methoxy-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 6-methoxy-1-[2-(1-piperidyl)ethy…

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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 7.41 -43.53 1 5 1 53 289.355 4 ↓

Analogs

26779522
26779522
2495073
2495073

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Popular Name: 6-chloro-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 6-chloro-1-[2-(1-piperidyl)ethyl…

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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) 2.49 8.62 -43.73 1 4 1 44 293.774 3 ↓

Analogs

6760016
6760016
6759144
6759144
14112543
14112543
6760406
6760406
6759901
6759901

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Popular Name: 7-bromo-5-fluoro-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 7-bromo-5-fluoro-1-[2-(1-piperid…

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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 8.48 -37.77 1 4 1 44 356.215 3 ↓

Analogs

14112543
14112543
6760406
6760406
3149430
3149430

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Popular Name: 7-bromo-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 7-bromo-1-[2-(1-piperidyl)ethyl]…

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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) 2.60 8.42 -36.61 1 4 1 44 338.225 3 ↓

Analogs

2495073
2495073

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Popular Name: 4,6-dimethyl-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 4,6-dimethyl-1-[2-(1-piperidyl)e…

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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) 2.64 9.4 -45.37 1 4 1 44 287.383 3 ↓

Analogs

9306234
9306234
6760045
6760045
6758513
6758513

Draw Identity 99% 90% 80% 70%

Popular Name: 4,7-dimethyl-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 4,7-dimethyl-1-[2-(1-piperidyl)e…

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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) 2.64 8.92 -44.37 1 4 1 44 287.383 3 ↓

Analogs

6759534
6759534

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Popular Name: 7-chloro-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 7-chloro-1-[2-(1-piperidyl)ethyl…

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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) 2.47 8.37 -37.29 1 4 1 44 293.774 3 ↓

Analogs

6760016
6760016
6759144
6759144

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Popular Name: 5,7-difluoro-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 5,7-difluoro-1-[2-(1-piperidyl)e…

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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 8.14 -39.46 1 4 1 44 295.309 3 ↓

Analogs

6760016
6760016
6759144
6759144
6758513
6758513
9306234
9306234

Draw Identity 99% 90% 80% 70%

Popular Name: 7-fluoro-5-methyl-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 7-fluoro-5-methyl-1-[2-(1-piperi…

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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) 2.35 8.74 -37.8 1 4 1 44 291.346 3 ↓

Analogs

6760406
6760406
19966829
19966829
6759317
6759317

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Popular Name: 5-bromo-7-methyl-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 5-bromo-7-methyl-1-[2-(1-piperid…

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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 9.02 -46.79 1 4 1 44 352.252 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-7-fluoro-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 4-chloro-7-fluoro-1-[2-(1-piperi…

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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) 2.58 8.58 -41.23 1 4 1 44 311.764 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4,6-difluoro-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 4,6-difluoro-1-[2-(1-piperidyl)e…

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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) 2.07 8.24 -49.47 1 4 1 44 295.309 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-bromo-6-fluoro-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 5-bromo-6-fluoro-1-[2-(1-piperid…

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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) 2.71 8.76 -47.21 1 4 1 44 356.215 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-1-[2-(1-piperidyl)ethyl]indoline-2,3-dione 4-chloro-1-[2-(1-piperidyl)ethyl…

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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) 2.47 8.6 -51.02 1 4 1 44 293.774 3 ↓

Parameters Provided:

ring.id = 610922
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 = 610922 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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