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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: 4-[[cyclopropylmethyl(ethyl)amino]methyl]tetrahydropyran-4-carbaldehyde 4-[[cyclopropylmethyl(ethyl)amin…

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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 6.42 -43.23 1 3 1 31 226.34 6 ↓
Hi High (pH 8-9.5) 1.87 5.19 -3.63 0 3 0 30 225.332 6 ↓

Analogs

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Popular Name: N-[[4-(aminomethyl)tetrahydropyran-4-yl]methyl]-N-(cyclopropylmethyl)ethanamine N-[[4-(aminomethyl)tetrahydropyr…

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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) 0.85 4.76 -111.3 4 3 2 41 228.38 6 ↓
Mid Mid (pH 6-8) 0.85 3.24 -45.08 3 3 1 40 227.372 6 ↓
Mid Mid (pH 6-8) 0.85 4.46 -34.3 3 3 1 40 227.372 6 ↓

Analogs

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Popular Name: [4-[[cyclopropylmethyl(ethyl)amino]methyl]tetrahydropyran-4-yl]methanol [4-[[cyclopropylmethyl(ethyl)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) 1.41 4.16 -37.46 2 3 1 34 228.356 6 ↓

Analogs

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Popular Name: N-(cyclopropylmethyl)-N-[[4-(methylaminomethyl)tetrahydropyran-4-yl]methyl]ethanamine N-(cyclopropylmethyl)-N-[[4-(met…

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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) 1.83 6.52 -105.39 3 3 2 30 242.407 7 ↓
Mid Mid (pH 6-8) 1.83 5.35 -34.15 2 3 1 26 241.399 7 ↓
Mid Mid (pH 6-8) 1.83 5.17 -39.61 2 3 1 29 241.399 7 ↓

Analogs

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Popular Name: N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]tetrahydropyran-4-yl]methyl]-2-methyl-propan-1-amine N-[[4-[[cyclopropylmethyl(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 8.84 -108.94 3 3 2 30 284.488 9 ↓
Mid Mid (pH 6-8) 2.60 7.46 -39.1 2 3 1 29 283.48 9 ↓

Analogs

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Popular Name: N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]tetrahydropyran-4-yl]methyl]ethanamine N-[[4-[[cyclopropylmethyl(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) 1.86 7.38 -107.12 3 3 2 30 256.434 8 ↓
Hi High (pH 8-9.5) 1.86 6.5 -33.7 2 3 1 26 255.426 8 ↓
Mid Mid (pH 6-8) 1.86 5.79 -38.05 2 3 1 29 255.426 8 ↓

Analogs

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Popular Name: N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]tetrahydropyran-4-yl]methyl]propan-1-amine N-[[4-[[cyclopropylmethyl(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) 2.36 8.14 -108.94 3 3 2 30 270.461 9 ↓
Hi High (pH 8-9.5) 2.36 7.27 -33.77 2 3 1 26 269.453 9 ↓
Mid Mid (pH 6-8) 2.36 6.54 -38.88 2 3 1 29 269.453 9 ↓

Analogs

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Popular Name: N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]tetrahydropyran-4-yl]methyl]propan-2-amine N-[[4-[[cyclopropylmethyl(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) 2.50 7.9 -104.69 3 3 2 30 270.461 8 ↓
Mid Mid (pH 6-8) 2.50 6.56 -36.73 2 3 1 29 269.453 8 ↓

Analogs

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Popular Name: N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]tetrahydropyran-4-yl]methyl]-2-methyl-propan-2-amine N-[[4-[[cyclopropylmethyl(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) 3.02 8.31 -103.21 3 3 2 30 284.488 8 ↓
Mid Mid (pH 6-8) 3.02 6.71 -34.79 2 3 1 29 283.48 8 ↓

Analogs

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Popular Name: 4-[[cyclopropylmethyl(ethyl)amino]methyl]tetrahydropyran-4-carboxylic 4-[[cyclopropylmethyl(ethyl)amin…

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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) 1.29 7.04 -37.58 1 4 0 54 241.331 6 ↓

Parameters Provided:

ring.id = 260501
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 = 260501 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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