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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: (S)-1,2,4-oxadiazol-3-yl(8-quinolyl)methanamine (S)-1,2,4-oxadiazol-3-yl(8-quino…

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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) 0.72 1.27 -44.1 3 5 1 79 227.247 2 ↓
Mid Mid (pH 6-8) 0.72 0.96 -12.18 2 5 0 78 226.239 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-1,2,4-oxadiazol-3-yl(8-quinolyl)methanamine (R)-1,2,4-oxadiazol-3-yl(8-quino…

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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) 0.72 1.28 -44.71 3 5 1 79 227.247 2 ↓
Mid Mid (pH 6-8) 0.72 0.94 -11.4 2 5 0 78 226.239 2 ↓

Analogs

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Popular Name: (R)-(5-methyl-1,2,4-oxadiazol-3-yl)-(8-quinolyl)methanamine (R)-(5-methyl-1,2,4-oxadiazol-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) 0.94 2.02 -43.69 3 5 1 79 241.274 2 ↓
Mid Mid (pH 6-8) 0.94 1.69 -11.28 2 5 0 78 240.266 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(5-methyl-1,2,4-oxadiazol-3-yl)-(8-quinolyl)methanamine (S)-(5-methyl-1,2,4-oxadiazol-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) 0.94 2.02 -42.94 3 5 1 79 241.274 2 ↓
Mid Mid (pH 6-8) 0.94 1.71 -12.09 2 5 0 78 240.266 2 ↓

Analogs

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Popular Name: (R)-(5-ethyl-1,2,4-oxadiazol-3-yl)-(8-quinolyl)methanamine (R)-(5-ethyl-1,2,4-oxadiazol-3-y…

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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) 1.51 2.77 -43.11 3 5 1 79 255.301 3 ↓
Mid Mid (pH 6-8) 1.51 2.46 -11.59 2 5 0 78 254.293 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(5-ethyl-1,2,4-oxadiazol-3-yl)-(8-quinolyl)methanamine (S)-(5-ethyl-1,2,4-oxadiazol-3-y…

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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) 1.51 2.77 -42.64 3 5 1 79 255.301 3 ↓
Mid Mid (pH 6-8) 1.51 2.45 -10.8 2 5 0 78 254.293 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(5-propyl-1,2,4-oxadiazol-3-yl)-(8-quinolyl)methanamine (R)-(5-propyl-1,2,4-oxadiazol-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) 2.01 3.54 -42.95 3 5 1 79 269.328 4 ↓
Mid Mid (pH 6-8) 2.01 3.23 -11.1 2 5 0 78 268.32 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(5-propyl-1,2,4-oxadiazol-3-yl)-(8-quinolyl)methanamine (S)-(5-propyl-1,2,4-oxadiazol-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) 2.01 3.54 -42.45 3 5 1 79 269.328 4 ↓
Mid Mid (pH 6-8) 2.01 3.22 -10.34 2 5 0 78 268.32 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(5-isopropyl-1,2,4-oxadiazol-3-yl)-(8-quinolyl)methanamine (R)-(5-isopropyl-1,2,4-oxadiazol…

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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) 1.99 3.38 -42.85 3 5 1 79 269.328 3 ↓
Mid Mid (pH 6-8) 1.99 3.05 -10.46 2 5 0 78 268.32 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(5-isopropyl-1,2,4-oxadiazol-3-yl)-(8-quinolyl)methanamine (S)-(5-isopropyl-1,2,4-oxadiazol…

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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) 1.99 3.38 -42.18 3 5 1 79 269.328 3 ↓
Mid Mid (pH 6-8) 1.99 3.07 -11.26 2 5 0 78 268.32 3 ↓

Analogs

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Popular Name: (R)-(5-tert-butyl-1,2,4-oxadiazol-3-yl)-(8-quinolyl)methanamine (R)-(5-tert-butyl-1,2,4-oxadiazo…

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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) 2.66 3.9 -42.47 3 5 1 79 283.355 3 ↓
Mid Mid (pH 6-8) 2.66 3.58 -11.18 2 5 0 78 282.347 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(5-tert-butyl-1,2,4-oxadiazol-3-yl)-(8-quinolyl)methanamine (S)-(5-tert-butyl-1,2,4-oxadiazo…

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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) 2.66 3.9 -41.8 3 5 1 79 283.355 3 ↓
Mid Mid (pH 6-8) 2.66 3.58 -10.28 2 5 0 78 282.347 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-8-quinolyl-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]methanamine (S)-8-quinolyl-[5-(trifluorometh…

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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) 1.85 2.43 -45.16 3 5 1 79 295.244 3 ↓
Mid Mid (pH 6-8) 1.85 2.11 -7.27 2 5 0 78 294.236 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-8-quinolyl-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]methanamine (R)-8-quinolyl-[5-(trifluorometh…

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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) 1.85 2.44 -45.78 3 5 1 79 295.244 3 ↓
Mid Mid (pH 6-8) 1.85 2.11 -7.92 2 5 0 78 294.236 3 ↓

Parameters Provided:

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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 = 361263 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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