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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: (1S)-1-cyclopropyl-2-(3-thienyl)ethanamine (1S)-1-cyclopropyl-2-(3-thienyl)…

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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 4.48 -39.33 3 1 1 28 168.285 3 ↓

Analogs

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Popular Name: (1R)-1-cyclopropyl-2-(3-thienyl)ethanamine (1R)-1-cyclopropyl-2-(3-thienyl)…

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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 4.51 -39.75 3 1 1 28 168.285 3 ↓

Analogs

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Popular Name: (1R)-1-[(1S,2R)-2-methylcyclopropyl]-2-(3-thienyl)ethanamine (1R)-1-[(1S,2R)-2-methylcyclopro…

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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) 2.05 4.71 -40.73 3 1 1 28 182.312 3 ↓

Analogs

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Popular Name: (1R)-1-[(1S,2S)-2-methylcyclopropyl]-2-(3-thienyl)ethanamine (1R)-1-[(1S,2S)-2-methylcyclopro…

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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) 2.05 5.17 -39.87 3 1 1 28 182.312 3 ↓

Analogs

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Popular Name: (1R)-1-[(1R,2R)-2-methylcyclopropyl]-2-(3-thienyl)ethanamine (1R)-1-[(1R,2R)-2-methylcyclopro…

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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) 2.05 5.35 -40.45 3 1 1 28 182.312 3 ↓

Analogs

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Popular Name: (1R)-1-[(1R,2S)-2-methylcyclopropyl]-2-(3-thienyl)ethanamine (1R)-1-[(1R,2S)-2-methylcyclopro…

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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) 2.05 5.37 -38.36 3 1 1 28 182.312 3 ↓

Analogs

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Popular Name: (1S)-1-cyclopropyl-N-methyl-2-(3-thienyl)ethanamine (1S)-1-cyclopropyl-N-methyl-2-(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) 2.35 5.99 -35.15 2 1 1 17 182.312 4 ↓

Analogs

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Popular Name: (1R)-1-cyclopropyl-N-methyl-2-(3-thienyl)ethanamine (1R)-1-cyclopropyl-N-methyl-2-(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) 2.35 5.89 -34.86 2 1 1 17 182.312 4 ↓

Analogs

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Popular Name: (1R)-N-methyl-1-[(1S,2R)-2-methylcyclopropyl]-2-(3-thienyl)ethanamine (1R)-N-methyl-1-[(1S,2R)-2-methy…

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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) 2.96 6.39 -35.31 2 1 1 17 196.339 4 ↓

Analogs

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Popular Name: (1R)-N-methyl-1-[(1S,2S)-2-methylcyclopropyl]-2-(3-thienyl)ethanamine (1R)-N-methyl-1-[(1S,2S)-2-methy…

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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) 2.96 6.61 -35.24 2 1 1 17 196.339 4 ↓

Analogs

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Popular Name: (1R)-N-methyl-1-[(1R,2R)-2-methylcyclopropyl]-2-(3-thienyl)ethanamine (1R)-N-methyl-1-[(1R,2R)-2-methy…

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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) 2.96 6.63 -35.32 2 1 1 17 196.339 4 ↓

Analogs

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Popular Name: (1R)-N-methyl-1-[(1R,2S)-2-methylcyclopropyl]-2-(3-thienyl)ethanamine (1R)-N-methyl-1-[(1R,2S)-2-methy…

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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) 2.96 6.53 -35.1 2 1 1 17 196.339 4 ↓

Analogs

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Popular Name: (1S)-1-cyclopropyl-N-ethyl-2-(3-thienyl)ethanamine (1S)-1-cyclopropyl-N-ethyl-2-(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) 2.72 6.85 -33.98 2 1 1 17 196.339 5 ↓

Analogs

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Popular Name: (1R)-1-cyclopropyl-N-ethyl-2-(3-thienyl)ethanamine (1R)-1-cyclopropyl-N-ethyl-2-(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) 2.72 6.97 -33.63 2 1 1 17 196.339 5 ↓

Analogs

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Popular Name: (1S)-N-ethyl-1-[(1R,2S)-2-methylcyclopropyl]-2-(3-thienyl)ethanamine (1S)-N-ethyl-1-[(1R,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) 3.33 6.96 -34.1 2 1 1 17 210.366 5 ↓

Analogs

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Popular Name: (1R)-N-ethyl-1-[(1R,2S)-2-methylcyclopropyl]-2-(3-thienyl)ethanamine (1R)-N-ethyl-1-[(1R,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) 3.33 7.39 -33.62 2 1 1 17 210.366 5 ↓

Analogs

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Popular Name: (1S)-N-ethyl-1-[(1S,2S)-2-methylcyclopropyl]-2-(3-thienyl)ethanamine (1S)-N-ethyl-1-[(1S,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) 3.33 7.32 -34.67 2 1 1 17 210.366 5 ↓

Analogs

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Popular Name: (1R)-N-ethyl-1-[(1S,2S)-2-methylcyclopropyl]-2-(3-thienyl)ethanamine (1R)-N-ethyl-1-[(1S,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) 3.33 7.51 -34.1 2 1 1 17 210.366 5 ↓

Analogs

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Popular Name: N-[(1S)-1-cyclopropyl-2-(3-thienyl)ethyl]propan-1-amine N-[(1S)-1-cyclopropyl-2-(3-thien…

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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) 3.23 7.6 -34.67 2 1 1 17 210.366 6 ↓

Analogs

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Popular Name: N-[(1R)-1-cyclopropyl-2-(3-thienyl)ethyl]propan-1-amine N-[(1R)-1-cyclopropyl-2-(3-thien…

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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) 3.23 7.72 -34.35 2 1 1 17 210.366 6 ↓

Analogs

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Popular Name: N-[(1S)-1-[(1R,2S)-2-methylcyclopropyl]-2-(3-thienyl)ethyl]propan-1-amine N-[(1S)-1-[(1R,2S)-2-methylcyclo…

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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) 3.83 8.06 -34.84 2 1 1 17 224.393 6 ↓

Analogs

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Popular Name: N-[(1R)-1-[(1R,2S)-2-methylcyclopropyl]-2-(3-thienyl)ethyl]propan-1-amine N-[(1R)-1-[(1R,2S)-2-methylcyclo…

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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) 3.83 8.14 -34.3 2 1 1 17 224.393 6 ↓

Analogs

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Popular Name: N-[(1S)-1-[(1S,2S)-2-methylcyclopropyl]-2-(3-thienyl)ethyl]propan-1-amine N-[(1S)-1-[(1S,2S)-2-methylcyclo…

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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) 3.83 8.41 -35.02 2 1 1 17 224.393 6 ↓

Analogs

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Popular Name: N-[(1R)-1-[(1S,2S)-2-methylcyclopropyl]-2-(3-thienyl)ethyl]propan-1-amine N-[(1R)-1-[(1S,2S)-2-methylcyclo…

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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) 3.83 8.26 -34.79 2 1 1 17 224.393 6 ↓

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

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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 = 588130 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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