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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: N-(3-furylmethyl)-2-morpholino-ethanamine N-(3-furylmethyl)-2-morpholino-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) 0.32 1.71 -42.46 2 4 1 42 211.285 5 ↓
Hi High (pH 8-9.5) 0.32 0.35 -4.45 1 4 0 38 210.277 5 ↓
Lo Low (pH 4.5-6) 0.32 3.96 -118.49 3 4 2 43 212.293 5 ↓

Analogs

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Popular Name: 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-(3-furylmethyl)ethanamine 2-[(2S,6R)-2,6-dimethylmorpholin…

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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) 1.04 3.2 -43.04 2 4 1 42 239.339 5 ↓
Hi High (pH 8-9.5) 1.04 1.84 -4.28 1 4 0 38 238.331 5 ↓
Lo Low (pH 4.5-6) 1.04 5.46 -121.54 3 4 2 43 240.347 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-N-(3-furylmethyl)ethanamine 2-[(2S,6S)-2,6-dimethylmorpholin…

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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) 1.04 3.5 -43.04 2 4 1 42 239.339 5 ↓
Hi High (pH 8-9.5) 1.04 2.14 -4.04 1 4 0 38 238.331 5 ↓
Lo Low (pH 4.5-6) 1.04 5.41 -120.82 3 4 2 43 240.347 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(3-furylmethyl)ethanamine 2-[(2R,6R)-2,6-dimethylmorpholin…

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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) 1.04 3.49 -42.99 2 4 1 42 239.339 5 ↓
Hi High (pH 8-9.5) 1.04 2.13 -4.01 1 4 0 38 238.331 5 ↓
Lo Low (pH 4.5-6) 1.04 5.43 -120.84 3 4 2 43 240.347 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-furylmethyl)-2-[(2R)-2-methylmorpholin-4-yl]ethanamine N-(3-furylmethyl)-2-[(2R)-2-meth…

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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) 0.68 2.45 -42.7 2 4 1 42 225.312 5 ↓
Hi High (pH 8-9.5) 0.68 1.1 -4.28 1 4 0 38 224.304 5 ↓
Lo Low (pH 4.5-6) 0.68 4.72 -119.98 3 4 2 43 226.32 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-furylmethyl)-2-[(2S)-2-methylmorpholin-4-yl]ethanamine N-(3-furylmethyl)-2-[(2S)-2-meth…

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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) 0.68 2.45 -42.73 2 4 1 42 225.312 5 ↓
Hi High (pH 8-9.5) 0.68 1.1 -4.45 1 4 0 38 224.304 5 ↓
Lo Low (pH 4.5-6) 0.68 4.72 -119.98 3 4 2 43 226.32 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-furylmethyl)-2-[(3R)-3-methylmorpholin-4-yl]ethanamine N-(3-furylmethyl)-2-[(3R)-3-meth…

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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) 0.65 2.31 -42.65 2 4 1 42 225.312 5 ↓
Hi High (pH 8-9.5) 0.65 0.95 -4.22 1 4 0 38 224.304 5 ↓
Lo Low (pH 4.5-6) 0.65 4.49 -116.99 3 4 2 43 226.32 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-furylmethyl)-2-[(3S)-3-methylmorpholin-4-yl]ethanamine N-(3-furylmethyl)-2-[(3S)-3-meth…

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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) 0.65 2.31 -42.61 2 4 1 42 225.312 5 ↓
Hi High (pH 8-9.5) 0.65 0.95 -4.4 1 4 0 38 224.304 5 ↓
Lo Low (pH 4.5-6) 0.65 4.49 -116.99 3 4 2 43 226.32 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2R,5R)-2,5-dimethylmorpholin-4-yl]-N-(3-furylmethyl)ethanamine 2-[(2R,5R)-2,5-dimethylmorpholin…

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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) 1.01 2.89 -42.81 2 4 1 42 239.339 5 ↓
Hi High (pH 8-9.5) 1.01 1.53 -4.07 1 4 0 38 238.331 5 ↓
Lo Low (pH 4.5-6) 1.01 5.06 -119.6 3 4 2 43 240.347 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-N-(3-furylmethyl)ethanamine 2-[(2S,5R)-2,5-dimethylmorpholin…

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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) 1.01 3.06 -42.99 2 4 1 42 239.339 5 ↓
Hi High (pH 8-9.5) 1.01 1.69 -4.24 1 4 0 38 238.331 5 ↓
Lo Low (pH 4.5-6) 1.01 5.24 -118.39 3 4 2 43 240.347 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2R)-2-ethylmorpholin-4-yl]-N-(3-furylmethyl)ethanamine 2-[(2R)-2-ethylmorpholin-4-yl]-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) 1.18 3.29 -42.5 2 4 1 42 239.339 6 ↓
Hi High (pH 8-9.5) 1.18 1.93 -4.12 1 4 0 38 238.331 6 ↓
Lo Low (pH 4.5-6) 1.18 5.54 -121.01 3 4 2 43 240.347 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S)-2-ethylmorpholin-4-yl]-N-(3-furylmethyl)ethanamine 2-[(2S)-2-ethylmorpholin-4-yl]-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) 1.18 3.29 -42.6 2 4 1 42 239.339 6 ↓
Hi High (pH 8-9.5) 1.18 1.93 -4.26 1 4 0 38 238.331 6 ↓
Lo Low (pH 4.5-6) 1.18 5.54 -121.01 3 4 2 43 240.347 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2,2-dimethylmorpholin-4-yl)-N-(3-furylmethyl)ethanamine 2-(2,2-dimethylmorpholin-4-yl)-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) 1.13 3.37 -42.96 2 4 1 42 239.339 5 ↓
Hi High (pH 8-9.5) 1.13 2.01 -4.31 1 4 0 38 238.331 5 ↓
Lo Low (pH 4.5-6) 1.13 5.32 -120.74 3 4 2 43 240.347 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3R)-3-ethylmorpholin-4-yl]-N-(3-furylmethyl)ethanamine 2-[(3R)-3-ethylmorpholin-4-yl]-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) 1.18 2.95 -42.93 2 4 1 42 239.339 6 ↓
Hi High (pH 8-9.5) 1.18 1.59 -4.11 1 4 0 38 238.331 6 ↓
Lo Low (pH 4.5-6) 1.18 5.1 -118.93 3 4 2 43 240.347 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3S)-3-ethylmorpholin-4-yl]-N-(3-furylmethyl)ethanamine 2-[(3S)-3-ethylmorpholin-4-yl]-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) 1.18 2.96 -42.94 2 4 1 42 239.339 6 ↓
Hi High (pH 8-9.5) 1.18 1.6 -4.3 1 4 0 38 238.331 6 ↓
Lo Low (pH 4.5-6) 1.18 5.12 -119 3 4 2 43 240.347 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-furylmethyl)-2-[(6R)-2,2,6-trimethylmorpholin-4-yl]ethanamine N-(3-furylmethyl)-2-[(6R)-2,2,6-…

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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) 1.49 4.1 -43.3 2 4 1 42 253.366 5 ↓
Hi High (pH 8-9.5) 1.49 2.74 -4.3 1 4 0 38 252.358 5 ↓
Lo Low (pH 4.5-6) 1.49 6.05 -122.25 3 4 2 43 254.374 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-furylmethyl)-2-[(6S)-2,2,6-trimethylmorpholin-4-yl]ethanamine N-(3-furylmethyl)-2-[(6S)-2,2,6-…

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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) 1.49 4.1 -43.28 2 4 1 42 253.366 5 ↓
Hi High (pH 8-9.5) 1.49 2.73 -4.12 1 4 0 38 252.358 5 ↓
Lo Low (pH 4.5-6) 1.49 6.06 -122.32 3 4 2 43 254.374 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2R,5R)-5-ethyl-2-methyl-morpholin-4-yl]-N-(3-furylmethyl)ethanamine 2-[(2R,5R)-5-ethyl-2-methyl-morp…

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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 3.97 -43.29 2 4 1 42 253.366 6 ↓
Hi High (pH 8-9.5) 1.55 2.62 -3.78 1 4 0 38 252.358 6 ↓
Lo Low (pH 4.5-6) 1.55 5.81 -119.71 3 4 2 43 254.374 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2R,5S)-5-ethyl-2-methyl-morpholin-4-yl]-N-(3-furylmethyl)ethanamine 2-[(2R,5S)-5-ethyl-2-methyl-morp…

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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 3.71 -43.28 2 4 1 42 253.366 6 ↓
Hi High (pH 8-9.5) 1.55 2.35 -4.28 1 4 0 38 252.358 6 ↓
Lo Low (pH 4.5-6) 1.55 5.88 -120.35 3 4 2 43 254.374 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S,5R)-5-ethyl-2-methyl-morpholin-4-yl]-N-(3-furylmethyl)ethanamine 2-[(2S,5R)-5-ethyl-2-methyl-morp…

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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 3.7 -43.24 2 4 1 42 253.366 6 ↓
Hi High (pH 8-9.5) 1.55 2.34 -4.05 1 4 0 38 252.358 6 ↓
Lo Low (pH 4.5-6) 1.55 5.86 -120.32 3 4 2 43 254.374 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S,5S)-5-ethyl-2-methyl-morpholin-4-yl]-N-(3-furylmethyl)ethanamine 2-[(2S,5S)-5-ethyl-2-methyl-morp…

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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 3.99 -43.32 2 4 1 42 253.366 6 ↓
Hi High (pH 8-9.5) 1.55 2.63 -4.02 1 4 0 38 252.358 6 ↓
Lo Low (pH 4.5-6) 1.55 5.84 -119.77 3 4 2 43 254.374 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3,3-dimethylmorpholin-4-yl)-N-(3-furylmethyl)ethanamine 2-(3,3-dimethylmorpholin-4-yl)-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) 1.13 2.69 -42.74 2 4 1 42 239.339 5 ↓
Hi High (pH 8-9.5) 1.13 1.34 -3.83 1 4 0 38 238.331 5 ↓
Lo Low (pH 4.5-6) 1.13 4.78 -116.67 3 4 2 43 240.347 5 ↓

Parameters Provided:

ring.id = 47394
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 = 47394 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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