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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(1-cyclopropyl-4-piperidyl)ethanamine 2-(1-cyclopropyl-4-piperidyl)eth…

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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) 0.74 4.72 -88.31 4 2 2 32 170.3 3 ↓

Analogs

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Popular Name: (2R)-3-chloro-N-(1-cyclopropyl-4-piperidyl)-2-methyl-propanamide (2R)-3-chloro-N-(1-cyclopropyl-4…

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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) 1.56 6.46 -37.37 2 3 1 34 245.774 4 ↓

Analogs

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Popular Name: (2S)-3-chloro-N-(1-cyclopropyl-4-piperidyl)-2-methyl-propanamide (2S)-3-chloro-N-(1-cyclopropyl-4…

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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) 1.56 6.47 -37.38 2 3 1 34 245.774 4 ↓

Analogs

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Popular Name: N-(1-cyclopropyl-4-piperidyl)-3-(ethylamino)propanamide N-(1-cyclopropyl-4-piperidyl)-3-…

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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) 0.28 5.32 -85.29 4 4 2 50 241.379 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(1-cyclopropyl-4-piperidyl)-2-(ethylamino)-2-methyl-propanamide N-(1-cyclopropyl-4-piperidyl)-2-…

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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 5.76 -91.19 4 4 2 50 255.406 5 ↓
Hi High (pH 8-9.5) 1.18 4.54 -36.54 3 4 1 46 254.398 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(1-cyclopropyl-4-piperidyl)-2-methyl-2-(methylamino)propanamide N-(1-cyclopropyl-4-piperidyl)-2-…

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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) 0.80 4.95 -92.98 4 4 2 50 241.379 4 ↓
Hi High (pH 8-9.5) 0.80 3.72 -35.17 3 4 1 46 240.371 4 ↓

Analogs

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Popular Name: (2S)-2-bromo-N-(1-cyclopropyl-4-piperidyl)butanamide (2S)-2-bromo-N-(1-cyclopropyl-4-…

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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) 1.81 6.53 -37.95 2 3 1 34 290.225 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-bromo-N-(1-cyclopropyl-4-piperidyl)butanamide (2R)-2-bromo-N-(1-cyclopropyl-4-…

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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) 1.81 6.53 -37.55 2 3 1 34 290.225 4 ↓

Analogs

42812349
42812349

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(1-cyclopropyl-4-piperidyl)-3-propyl-urea 1-(1-cyclopropyl-4-piperidyl)-3-…

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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) 1.41 4.71 -37.79 3 4 1 46 226.344 4 ↓

Analogs

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Popular Name: 1-(1-cyclopropyl-4-piperidyl)-3-[2-[ethyl(methyl)amino]ethyl]urea 1-(1-cyclopropyl-4-piperidyl)-3-…

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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) 0.94 5.9 -82.61 4 5 2 50 270.421 6 ↓

Analogs

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Popular Name: 4-amino-N-(1-cyclopropyl-4-piperidyl)-4-methyl-pentanamide 4-amino-N-(1-cyclopropyl-4-piper…

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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) 0.97 4.35 -83.98 5 4 2 61 255.406 5 ↓

Analogs

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Popular Name: 2-[2-[(1-cyclopropyl-4-piperidyl)amino]-2-oxo-ethoxy]acetic 2-[2-[(1-cyclopropyl-4-piperidyl…

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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) -0.57 5.98 -75.73 2 6 0 83 256.302 6 ↓

Analogs

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Popular Name: 5-amino-N-(1-cyclopropyl-4-piperidyl)pentanamide 5-amino-N-(1-cyclopropyl-4-piper…

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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) 0.06 4.18 -86.83 5 4 2 61 241.379 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-4-amino-N-(1-cyclopropyl-4-piperidyl)pentanamide (4S)-4-amino-N-(1-cyclopropyl-4-…

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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) -0.05 4.11 -91.23 5 4 2 61 241.379 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-4-amino-N-(1-cyclopropyl-4-piperidyl)pentanamide (4R)-4-amino-N-(1-cyclopropyl-4-…

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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) -0.05 4.11 -91.84 5 4 2 61 241.379 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[2-[(1-cyclopropyl-4-piperidyl)amino]-2-oxo-ethyl]-2-methyl-butanamide (2R)-N-[2-[(1-cyclopropyl-4-pipe…

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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) 1.44 5.06 -39.98 3 5 1 63 282.408 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[2-[(1-cyclopropyl-4-piperidyl)amino]-2-oxo-ethyl]-2-methyl-butanamide (2S)-N-[2-[(1-cyclopropyl-4-pipe…

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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) 1.44 5.06 -40.03 3 5 1 63 282.408 6 ↓

Analogs

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Popular Name: (1-Cyclopropyl-piperidin-4-yl)-propyl-amine (1-Cyclopropyl-piperidin-4-yl)-p…

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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) 1.76 4.45 -36.06 2 2 1 20 183.319 4 ↓
Lo Low (pH 4.5-6) 1.76 6.65 -97.68 3 2 2 21 184.327 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1-Cyclopropyl-piperidin-4-yl)-ethyl-amine (1-Cyclopropyl-piperidin-4-yl)-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) 1.26 4.71 -29.2 2 2 1 16 169.292 3 ↓
Mid Mid (pH 6-8) 1.26 3.69 -35.21 2 2 1 20 169.292 3 ↓
Lo Low (pH 4.5-6) 1.26 5.89 -95.81 3 2 2 21 170.3 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1-Cyclopropyl-piperidin-4-yl)-methyl-amine (1-Cyclopropyl-piperidin-4-yl)-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) 0.88 3.78 -29.23 2 2 1 16 155.265 2 ↓
Mid Mid (pH 6-8) 0.88 2.84 -36.5 2 2 1 20 155.265 2 ↓
Lo Low (pH 4.5-6) 0.88 5.04 -95.26 3 2 2 21 156.273 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-cyclopropyl-N-[(1R)-1-methylpentyl]piperidin-4-amine 1-cyclopropyl-N-[(1R)-1-methylpe…

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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) 3.16 6.56 -34.83 2 2 1 20 225.4 6 ↓
Mid Mid (pH 6-8) 3.16 7.89 -29.42 2 2 1 16 225.4 6 ↓
Lo Low (pH 4.5-6) 3.16 8.76 -98.56 3 2 2 21 226.408 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-cyclopropyl-N-[(1S)-1-methylpentyl]piperidin-4-amine 1-cyclopropyl-N-[(1S)-1-methylpe…

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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) 3.16 6.58 -34.8 2 2 1 20 225.4 6 ↓
Mid Mid (pH 6-8) 3.16 7.75 -29.56 2 2 1 16 225.4 6 ↓
Lo Low (pH 4.5-6) 3.16 8.79 -98.5 3 2 2 21 226.408 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-cyclopropyl-N-[(1S)-1-ethyl-2-methyl-propyl]piperidin-4-amine 1-cyclopropyl-N-[(1S)-1-ethyl-2-…

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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) 2.87 5.8 -33.16 2 2 1 20 225.4 5 ↓
Mid Mid (pH 6-8) 2.87 7.55 -29.51 2 2 1 16 225.4 5 ↓
Lo Low (pH 4.5-6) 2.87 8.4 -97.94 3 2 2 21 226.408 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-cyclopropyl-N-[(1R)-1-ethyl-2-methyl-propyl]piperidin-4-amine 1-cyclopropyl-N-[(1R)-1-ethyl-2-…

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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) 2.87 5.83 -34.78 2 2 1 20 225.4 5 ↓
Mid Mid (pH 6-8) 2.87 7.89 -29.86 2 2 1 16 225.4 5 ↓
Lo Low (pH 4.5-6) 2.87 8.32 -96.98 3 2 2 21 226.408 5 ↓

Analogs

43498669
43498669
43498672
43498672
43498702
43498702
43498705
43498705

Draw Identity 99% 90% 80% 70%

Popular Name: 1-cyclopropyl-N-(1-pentylhexyl)piperidin-4-amine 1-cyclopropyl-N-(1-pentylhexyl)p…

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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) 5.77 10.12 -36.6 2 2 1 20 295.535 11 ↓
Mid Mid (pH 6-8) 5.77 12.33 -104.1 3 2 2 21 296.543 11 ↓

Parameters Provided:

ring.id = 25227
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 = 25227 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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