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

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[3-aminopropyl(cyclopentyl)amino]-1-morpholino-propan-1-one (2S)-2-[3-aminopropyl(cyclopenty…

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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) 0.34 1.4 -53.8 3 5 1 60 284.424 6 ↓
Hi High (pH 8-9.5) 0.34 3.33 -32.45 3 5 1 60 284.424 6 ↓

Analogs

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Popular Name: (2R)-2-[3-aminopropyl(cyclopentyl)amino]-1-morpholino-propan-1-one (2R)-2-[3-aminopropyl(cyclopenty…

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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) 0.34 1.52 -53.1 3 5 1 60 284.424 6 ↓
Hi High (pH 8-9.5) 0.34 3.42 -34.35 3 5 1 60 284.424 6 ↓

Analogs

37826833
37826833

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[3-aminopropyl(cyclopentyl)amino]-1-morpholino-ethanone 2-[3-aminopropyl(cyclopentyl)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) 0.01 1.78 -44.72 3 5 1 60 270.397 6 ↓
Mid Mid (pH 6-8) 0.01 3.04 -39.04 3 5 1 60 270.397 6 ↓

Analogs

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Popular Name: 2-(cyclopentylamino)-1-[(6R)-2,2,6-trimethylmorpholin-4-yl]ethanone 2-(cyclopentylamino)-1-[(6R)-2,2…

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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) 1.87 5.7 -42.22 2 4 1 46 255.382 3 ↓
Hi High (pH 8-9.5) 1.87 4.48 -6.93 1 4 0 42 254.374 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(cyclopentylamino)-1-[(6S)-2,2,6-trimethylmorpholin-4-yl]ethanone 2-(cyclopentylamino)-1-[(6S)-2,2…

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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) 1.87 5.7 -42.21 2 4 1 46 255.382 3 ↓
Hi High (pH 8-9.5) 1.87 4.48 -6.86 1 4 0 42 254.374 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[cyclopentyl-[(1S)-1-methyl-2-morpholino-2-oxo-ethyl]amino]acetic 2-[cyclopentyl-[(1S)-1-methyl-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) -0.40 6.43 -23.77 1 6 0 74 284.356 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[cyclopentyl-[(1R)-1-methyl-2-morpholino-2-oxo-ethyl]amino]acetic 2-[cyclopentyl-[(1R)-1-methyl-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) -0.40 5.61 -37.93 1 6 0 74 284.356 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[cyclopentyl-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-oxo-ethyl]amino]acetic 2-[cyclopentyl-[2-[(2S,6R)-2,6-d…

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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) 0.00 7.06 -28.71 1 6 0 74 298.383 5 ↓
Hi High (pH 8-9.5) 0.00 5.28 -59.26 0 6 -1 73 297.375 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[cyclopentyl-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-oxo-ethyl]amino]acetic 2-[cyclopentyl-[2-[(2S,6S)-2,6-d…

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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) 0.00 7.37 -29.83 1 6 0 74 298.383 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[cyclopentyl-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-oxo-ethyl]amino]acetic 2-[cyclopentyl-[2-[(2R,6R)-2,6-d…

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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) 0.00 7.37 -30.03 1 6 0 74 298.383 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[cyclopentyl-(2-morpholino-2-oxo-ethyl)amino]acetic 2-[cyclopentyl-(2-morpholino-2-o…

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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) -0.73 5.59 -29.18 1 6 0 74 270.329 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[cyclopentyl-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxo-ethyl]amino]acetic 2-[cyclopentyl-[2-[(2R)-2-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) -0.36 6.31 -28.91 1 6 0 74 284.356 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[cyclopentyl-[2-[(2S)-2-methylmorpholin-4-yl]-2-oxo-ethyl]amino]acetic 2-[cyclopentyl-[2-[(2S)-2-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) -0.36 6.32 -29.26 1 6 0 74 284.356 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(cyclopentylamino)-1-(3,3-dimethylmorpholin-4-yl)ethanone 2-(cyclopentylamino)-1-(3,3-dime…

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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) 1.50 4.66 -41.12 2 4 1 46 241.355 3 ↓
Hi High (pH 8-9.5) 1.50 3.49 -6.49 1 4 0 42 240.347 3 ↓

Parameters Provided:

ring.id = 41752
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 = 41752 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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