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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: 3-(Pyridin-4-yl)morpholine 3-(Pyridin-4-yl)morpholine

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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) 0.24 0.77 -4.86 1 3 0 34 164.208 1 ↓
Mid Mid (pH 6-8) 0.24 2.07 -42.9 2 3 1 39 165.216 1 ↓

Analogs

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Popular Name: [(2R,3S)-4-methyl-3-(4-pyridyl)morpholin-2-yl]methanamine [(2R,3S)-4-methyl-3-(4-pyridyl)m…

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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 0.06 -43.19 3 4 1 53 208.285 2 ↓
Hi High (pH 8-9.5) -0.73 -0.39 -4.19 2 4 0 51 207.277 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3S)-4-methyl-3-(4-pyridyl)morpholin-2-yl]methanamine [(2S,3S)-4-methyl-3-(4-pyridyl)m…

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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 0.08 -42.48 3 4 1 53 208.285 2 ↓
Hi High (pH 8-9.5) -0.73 -0.3 -4.22 2 4 0 51 207.277 2 ↓

Analogs

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Popular Name: N-methyl-1-[(2R,3S)-4-methyl-3-(4-pyridyl)morpholin-2-yl]methanamine N-methyl-1-[(2R,3S)-4-methyl-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) 0.25 1.94 -38.13 2 4 1 42 222.312 3 ↓
Hi High (pH 8-9.5) 0.25 0.44 -3.91 1 4 0 37 221.304 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-1-[(2S,3S)-4-methyl-3-(4-pyridyl)morpholin-2-yl]methanamine N-methyl-1-[(2S,3S)-4-methyl-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) 0.25 1.93 -37.53 2 4 1 42 222.312 3 ↓
Hi High (pH 8-9.5) 0.25 0.5 -3.9 1 4 0 37 221.304 3 ↓

Analogs

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Popular Name: N-methyl-1-[(2R,3R)-4-methyl-3-(4-pyridyl)morpholin-2-yl]methanamine N-methyl-1-[(2R,3R)-4-methyl-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) 0.25 1.91 -37.59 2 4 1 42 222.312 3 ↓
Hi High (pH 8-9.5) 0.25 0.41 -4.35 1 4 0 37 221.304 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-1-[(2S,3R)-4-methyl-3-(4-pyridyl)morpholin-2-yl]methanamine N-methyl-1-[(2S,3R)-4-methyl-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) 0.25 2.07 -38.2 2 4 1 42 222.312 3 ↓
Hi High (pH 8-9.5) 0.25 0.64 -3.77 1 4 0 37 221.304 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,3S)-4-ethyl-3-(4-pyridyl)morpholin-2-yl]methanamine [(2R,3S)-4-ethyl-3-(4-pyridyl)mo…

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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) -0.35 0.82 -43.23 3 4 1 53 222.312 3 ↓
Hi High (pH 8-9.5) -0.35 0.46 -3.82 2 4 0 51 221.304 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3S)-4-ethyl-3-(4-pyridyl)morpholin-2-yl]methanamine [(2S,3S)-4-ethyl-3-(4-pyridyl)mo…

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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) -0.35 0.84 -42.44 3 4 1 53 222.312 3 ↓
Hi High (pH 8-9.5) -0.35 0.37 -4.39 2 4 0 51 221.304 3 ↓

Analogs

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Popular Name: N-[[(2R,3S)-4-methyl-3-(4-pyridyl)morpholin-2-yl]methyl]propan-2-amine N-[[(2R,3S)-4-methyl-3-(4-pyridy…

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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) 0.93 3.32 -35.66 2 4 1 42 250.366 4 ↓
Hi High (pH 8-9.5) 0.93 2.05 -3.58 1 4 0 37 249.358 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2S,3S)-4-methyl-3-(4-pyridyl)morpholin-2-yl]methyl]propan-2-amine N-[[(2S,3S)-4-methyl-3-(4-pyridy…

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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) 0.93 3.32 -35.14 2 4 1 42 250.366 4 ↓
Hi High (pH 8-9.5) 0.93 2.13 -3.65 1 4 0 37 249.358 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2R,3R)-4-methyl-3-(4-pyridyl)morpholin-2-yl]methyl]propan-2-amine N-[[(2R,3R)-4-methyl-3-(4-pyridy…

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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) 0.93 3.3 -35.24 2 4 1 42 250.366 4 ↓
Hi High (pH 8-9.5) 0.93 2.02 -4.06 1 4 0 37 249.358 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2S,3R)-4-methyl-3-(4-pyridyl)morpholin-2-yl]methyl]propan-2-amine N-[[(2S,3R)-4-methyl-3-(4-pyridy…

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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) 0.93 3.44 -35.67 2 4 1 42 250.366 4 ↓
Hi High (pH 8-9.5) 0.93 2.25 -3.55 1 4 0 37 249.358 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(2R,3S)-4-ethyl-3-(4-pyridyl)morpholin-2-yl]-N-methyl-methanamine 1-[(2R,3S)-4-ethyl-3-(4-pyridyl)…

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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) 0.63 2.71 -38.26 2 4 1 42 236.339 4 ↓
Hi High (pH 8-9.5) 0.63 1.28 -3.58 1 4 0 37 235.331 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(2S,3S)-4-ethyl-3-(4-pyridyl)morpholin-2-yl]-N-methyl-methanamine 1-[(2S,3S)-4-ethyl-3-(4-pyridyl)…

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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) 0.63 2.72 -37.47 2 4 1 42 236.339 4 ↓
Hi High (pH 8-9.5) 0.63 1.22 -4.09 1 4 0 37 235.331 4 ↓

Analogs

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Popular Name: [(2R,3S)-4-propyl-3-(4-pyridyl)morpholin-2-yl]methanamine [(2R,3S)-4-propyl-3-(4-pyridyl)m…

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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) 0.15 1.58 -43.44 3 4 1 53 236.339 4 ↓
Hi High (pH 8-9.5) 0.15 1.21 -3.71 2 4 0 51 235.331 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3S)-4-propyl-3-(4-pyridyl)morpholin-2-yl]methanamine [(2S,3S)-4-propyl-3-(4-pyridyl)m…

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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) 0.15 1.6 -42.48 3 4 1 53 236.339 4 ↓
Hi High (pH 8-9.5) 0.15 1.12 -4.26 2 4 0 51 235.331 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-1-[(2R,3S)-4-propyl-3-(4-pyridyl)morpholin-2-yl]methanamine N-methyl-1-[(2R,3S)-4-propyl-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) 1.13 3.46 -38.49 2 4 1 42 250.366 5 ↓
Hi High (pH 8-9.5) 1.13 2.03 -3.53 1 4 0 37 249.358 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-1-[(2S,3S)-4-propyl-3-(4-pyridyl)morpholin-2-yl]methanamine N-methyl-1-[(2S,3S)-4-propyl-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) 1.13 3.47 -37.59 2 4 1 42 250.366 5 ↓
Hi High (pH 8-9.5) 1.13 1.97 -3.97 1 4 0 37 249.358 5 ↓

Analogs

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Popular Name: [(2R,3S)-4-isopropyl-3-(4-pyridyl)morpholin-2-yl]methanamine [(2R,3S)-4-isopropyl-3-(4-pyridy…

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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) -0.05 1.27 -42.77 3 4 1 53 236.339 3 ↓
Hi High (pH 8-9.5) -0.05 0.81 -3.78 2 4 0 51 235.331 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3S)-4-isopropyl-3-(4-pyridyl)morpholin-2-yl]methanamine [(2S,3S)-4-isopropyl-3-(4-pyridy…

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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) -0.05 1.09 -42.09 3 4 1 53 236.339 3 ↓
Hi High (pH 8-9.5) -0.05 0.72 -3.75 2 4 0 51 235.331 3 ↓

Analogs

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Popular Name: 1-[(2R,3S)-4-isopropyl-3-(4-pyridyl)morpholin-2-yl]-N-methyl-methanamine 1-[(2R,3S)-4-isopropyl-3-(4-pyri…

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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) 0.93 3.16 -37.91 2 4 1 42 250.366 4 ↓
Hi High (pH 8-9.5) 0.93 1.71 -3.4 1 4 0 37 249.358 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(2S,3S)-4-isopropyl-3-(4-pyridyl)morpholin-2-yl]-N-methyl-methanamine 1-[(2S,3S)-4-isopropyl-3-(4-pyri…

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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) 0.93 2.97 -37.25 2 4 1 42 250.366 4 ↓
Hi High (pH 8-9.5) 0.93 1.48 -3.97 1 4 0 37 249.358 4 ↓

Parameters Provided:

ring.id = 25053
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 = 25053 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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