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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: N-(3-furylmethyl)-N-methyl-1-[(3S)-3-methylpyrrolidin-3-yl]methanamine N-(3-furylmethyl)-N-methyl-1-[(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) 1.22 3.62 -40.83 2 3 1 33 209.313 4 ↓
Mid Mid (pH 6-8) 1.22 5.39 -103.23 3 3 2 34 210.321 4 ↓

Analogs

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Popular Name: N-(3-furylmethyl)-N-methyl-1-[(3R)-3-methylpyrrolidin-3-yl]methanamine N-(3-furylmethyl)-N-methyl-1-[(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) 1.22 3.89 -39.85 2 3 1 33 209.313 4 ↓
Mid Mid (pH 6-8) 1.22 5.56 -100.8 3 3 2 34 210.321 4 ↓

Analogs

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Popular Name: 1-[(3S)-3-ethylpyrrolidin-3-yl]-N-(3-furylmethyl)-N-methyl-methanamine 1-[(3S)-3-ethylpyrrolidin-3-yl]-…

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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) 1.55 4.29 -39.53 2 3 1 33 223.34 5 ↓
Mid Mid (pH 6-8) 1.55 6.05 -104.54 3 3 2 34 224.348 5 ↓

Analogs

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Popular Name: 1-[(3R)-3-ethylpyrrolidin-3-yl]-N-(3-furylmethyl)-N-methyl-methanamine 1-[(3R)-3-ethylpyrrolidin-3-yl]-…

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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) 1.55 4.2 -38.75 2 3 1 33 223.34 5 ↓
Mid Mid (pH 6-8) 1.55 5.9 -102.55 3 3 2 34 224.348 5 ↓

Analogs

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Popular Name: N-(3-furylmethyl)-N-methyl-1-[(3S)-3-propylpyrrolidin-3-yl]methanamine N-(3-furylmethyl)-N-methyl-1-[(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) 2.11 5.07 -39.79 2 3 1 33 237.367 6 ↓
Mid Mid (pH 6-8) 2.11 6.8 -106.36 3 3 2 34 238.375 6 ↓

Analogs

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Popular Name: N-(3-furylmethyl)-N-methyl-1-[(3R)-3-propylpyrrolidin-3-yl]methanamine N-(3-furylmethyl)-N-methyl-1-[(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) 2.11 4.96 -39.01 2 3 1 33 237.367 6 ↓
Mid Mid (pH 6-8) 2.11 6.63 -104.69 3 3 2 34 238.375 6 ↓

Analogs

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Popular Name: N-methyl-1-(2-methyl-3-furyl)-N-[[(3R)-3-methylpyrrolidin-3-yl]methyl]methanamine N-methyl-1-(2-methyl-3-furyl)-N-…

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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 4.63 -41.82 2 3 1 33 223.34 4 ↓
Mid Mid (pH 6-8) 1.44 6.29 -102.13 3 3 2 34 224.348 4 ↓

Analogs

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Popular Name: N-methyl-1-(2-methyl-3-furyl)-N-[[(3S)-3-methylpyrrolidin-3-yl]methyl]methanamine N-methyl-1-(2-methyl-3-furyl)-N-…

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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 4.56 -39.1 2 3 1 33 223.34 4 ↓
Mid Mid (pH 6-8) 1.44 6.27 -102.88 3 3 2 34 224.348 4 ↓

Analogs

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Popular Name: 1-[(3S)-3-ethylpyrrolidin-3-yl]-N-methyl-N-[(2-methyl-3-furyl)methyl]methanamine 1-[(3S)-3-ethylpyrrolidin-3-yl]-…

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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) 1.77 5.57 -37.03 2 3 1 33 237.367 5 ↓
Mid Mid (pH 6-8) 1.77 6.63 -105.57 3 3 2 34 238.375 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3R)-3-ethylpyrrolidin-3-yl]-N-methyl-N-[(2-methyl-3-furyl)methyl]methanamine 1-[(3R)-3-ethylpyrrolidin-3-yl]-…

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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) 1.77 6.74 -40.52 2 3 1 33 237.367 5 ↓
Mid Mid (pH 6-8) 1.77 6.65 -103.73 3 3 2 34 238.375 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-N-[(2-methyl-3-furyl)methyl]-1-[(3S)-3-propylpyrrolidin-3-yl]methanamine N-methyl-N-[(2-methyl-3-furyl)me…

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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) 2.34 6.34 -37.46 2 3 1 33 251.394 6 ↓
Mid Mid (pH 6-8) 2.34 7.4 -107.46 3 3 2 34 252.402 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-N-[(2-methyl-3-furyl)methyl]-1-[(3R)-3-propylpyrrolidin-3-yl]methanamine N-methyl-N-[(2-methyl-3-furyl)me…

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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) 2.34 5.73 -39.47 2 3 1 33 251.394 6 ↓
Mid Mid (pH 6-8) 2.34 7.29 -105.65 3 3 2 34 252.402 6 ↓

Parameters Provided:

ring.id = 306679
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 = 306679 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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