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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: (R)-(1-methylimidazol-2-yl)-(5-quinolyl)methanamine (R)-(1-methylimidazol-2-yl)-(5-q…

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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) 1.32 4.56 -35.44 3 4 1 58 239.302 2 ↓
Mid Mid (pH 6-8) 1.32 4.08 -9.04 2 4 0 57 238.294 2 ↓
Lo Low (pH 4.5-6) 1.32 4.89 -123.81 4 4 2 60 240.31 2 ↓

Analogs

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Popular Name: (S)-(1-methylimidazol-2-yl)-(5-quinolyl)methanamine (S)-(1-methylimidazol-2-yl)-(5-q…

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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) 1.32 4.54 -36.36 3 4 1 58 239.302 2 ↓
Mid Mid (pH 6-8) 1.32 4.08 -11.93 2 4 0 57 238.294 2 ↓
Lo Low (pH 4.5-6) 1.32 4.9 -122.68 4 4 2 60 240.31 2 ↓

Analogs

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Popular Name: (R)-(1-ethylimidazol-2-yl)-(5-quinolyl)methanamine (R)-(1-ethylimidazol-2-yl)-(5-qu…

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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) 1.70 5.5 -34.28 3 4 1 58 253.329 3 ↓
Mid Mid (pH 6-8) 1.70 5.03 -9.44 2 4 0 57 252.321 3 ↓
Lo Low (pH 4.5-6) 1.70 5.82 -121.99 4 4 2 60 254.337 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(1-ethylimidazol-2-yl)-(5-quinolyl)methanamine (S)-(1-ethylimidazol-2-yl)-(5-qu…

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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) 1.70 6.05 -35.64 3 4 1 58 253.329 3 ↓
Mid Mid (pH 6-8) 1.70 5.24 -11.02 2 4 0 57 252.321 3 ↓
Lo Low (pH 4.5-6) 1.70 5.55 -54.66 3 4 1 58 253.329 3 ↓

Analogs

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Popular Name: (R)-(1-propylimidazol-2-yl)-(5-quinolyl)methanamine (R)-(1-propylimidazol-2-yl)-(5-q…

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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) 2.20 6.27 -35.04 3 4 1 58 267.356 4 ↓
Mid Mid (pH 6-8) 2.20 5.73 -8.13 2 4 0 57 266.348 4 ↓
Lo Low (pH 4.5-6) 2.20 6.57 -123.18 4 4 2 60 268.364 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(1-propylimidazol-2-yl)-(5-quinolyl)methanamine (S)-(1-propylimidazol-2-yl)-(5-q…

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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) 2.20 7.18 -34.71 3 4 1 58 267.356 4 ↓
Mid Mid (pH 6-8) 2.20 6.01 -10.21 2 4 0 57 266.348 4 ↓
Lo Low (pH 4.5-6) 2.20 7.12 -119.52 4 4 2 60 268.364 4 ↓

Analogs

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Popular Name: (1S)-N-methyl-1-(1-methylimidazol-2-yl)-1-(5-quinolyl)methanamine (1S)-N-methyl-1-(1-methylimidazo…

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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) 1.70 5.24 -32.32 2 4 1 44 253.329 3 ↓
Mid Mid (pH 6-8) 1.70 5.07 -12.04 1 4 0 43 252.321 3 ↓
Lo Low (pH 4.5-6) 1.70 6.67 -116.17 3 4 2 49 254.337 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-N-methyl-1-(1-methylimidazol-2-yl)-1-(5-quinolyl)methanamine (1R)-N-methyl-1-(1-methylimidazo…

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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) 1.70 6.15 -34.88 2 4 1 44 253.329 3 ↓
Mid Mid (pH 6-8) 1.70 4.98 -9.31 1 4 0 43 252.321 3 ↓
Lo Low (pH 4.5-6) 1.70 6.47 -115.46 3 4 2 49 254.337 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(S)-(1-methylimidazol-2-yl)-(5-quinolyl)methyl]ethanamine N-[(S)-(1-methylimidazol-2-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) 2.07 6.16 -32.39 2 4 1 44 267.356 4 ↓
Mid Mid (pH 6-8) 2.07 6.83 -43.57 2 4 1 47 267.356 4 ↓
Mid Mid (pH 6-8) 2.07 5.9 -11.94 1 4 0 43 266.348 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(R)-(1-methylimidazol-2-yl)-(5-quinolyl)methyl]ethanamine N-[(R)-(1-methylimidazol-2-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) 2.07 7.04 -34.92 2 4 1 44 267.356 4 ↓
Mid Mid (pH 6-8) 2.07 5.9 -9.12 1 4 0 43 266.348 4 ↓
Mid Mid (pH 6-8) 2.07 6.83 -40.49 2 4 1 47 267.356 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(S)-(1-methylimidazol-2-yl)-(5-quinolyl)methyl]propan-1-amine N-[(S)-(1-methylimidazol-2-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) 2.58 6.93 -32.53 2 4 1 44 281.383 5 ↓
Mid Mid (pH 6-8) 2.58 7.58 -44.04 2 4 1 47 281.383 5 ↓
Mid Mid (pH 6-8) 2.58 6.66 -11.76 1 4 0 43 280.375 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(R)-(1-methylimidazol-2-yl)-(5-quinolyl)methyl]propan-1-amine N-[(R)-(1-methylimidazol-2-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) 2.58 7.36 -35.68 2 4 1 44 281.383 5 ↓
Mid Mid (pH 6-8) 2.58 7.58 -40.83 2 4 1 47 281.383 5 ↓
Mid Mid (pH 6-8) 2.58 6.67 -8.96 1 4 0 43 280.375 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(1-ethylimidazol-2-yl)-N-methyl-1-(5-quinolyl)methanamine (1R)-1-(1-ethylimidazol-2-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) 2.07 7.81 -32.31 2 4 1 44 267.356 4 ↓
Mid Mid (pH 6-8) 2.07 6.05 -8.68 1 4 0 43 266.348 4 ↓
Lo Low (pH 4.5-6) 2.07 7.16 -113.72 3 4 2 49 268.364 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(1-ethylimidazol-2-yl)-N-methyl-1-(5-quinolyl)methanamine (1S)-1-(1-ethylimidazol-2-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) 2.07 6.53 -33.52 2 4 1 44 267.356 4 ↓
Mid Mid (pH 6-8) 2.07 6.03 -9.73 1 4 0 43 266.348 4 ↓
Lo Low (pH 4.5-6) 2.07 7.58 -111 3 4 2 49 268.364 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(S)-(1-ethylimidazol-2-yl)-(5-quinolyl)methyl]ethanamine N-[(S)-(1-ethylimidazol-2-yl)-(5…

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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) 2.45 7.46 -34.76 2 4 1 44 281.383 5 ↓
Mid Mid (pH 6-8) 2.45 8.06 -45.38 2 4 1 47 281.383 5 ↓
Mid Mid (pH 6-8) 2.45 6.97 -8.72 1 4 0 43 280.375 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(R)-(1-ethylimidazol-2-yl)-(5-quinolyl)methyl]ethanamine N-[(R)-(1-ethylimidazol-2-yl)-(5…

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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) 2.45 7.6 -33.13 2 4 1 44 281.383 5 ↓
Mid Mid (pH 6-8) 2.45 7.69 -39.46 2 4 1 47 281.383 5 ↓
Mid Mid (pH 6-8) 2.45 6.98 -9.39 1 4 0 43 280.375 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-N-methyl-1-(1-propylimidazol-2-yl)-1-(5-quinolyl)methanamine (1R)-N-methyl-1-(1-propylimidazo…

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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) 2.58 8.58 -32.31 2 4 1 44 281.383 5 ↓
Mid Mid (pH 6-8) 2.58 6.81 -8.27 1 4 0 43 280.375 5 ↓
Lo Low (pH 4.5-6) 2.58 7.91 -114.63 3 4 2 49 282.391 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-N-methyl-1-(1-propylimidazol-2-yl)-1-(5-quinolyl)methanamine (1S)-N-methyl-1-(1-propylimidazo…

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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) 2.58 7.28 -33.54 2 4 1 44 281.383 5 ↓
Mid Mid (pH 6-8) 2.58 6.92 -9.47 1 4 0 43 280.375 5 ↓
Lo Low (pH 4.5-6) 2.58 7.98 -47.64 2 4 1 47 281.383 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(1-methylimidazol-2-yl)-(5-quinolyl)methanol (R)-(1-methylimidazol-2-yl)-(5-q…

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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) 1.28 4.66 -38.11 2 4 1 52 240.286 2 ↓
Mid Mid (pH 6-8) 1.28 4.76 -11.06 1 4 0 51 239.278 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(1-methylimidazol-2-yl)-(5-quinolyl)methanol (S)-(1-methylimidazol-2-yl)-(5-q…

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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) 1.28 4.52 -38.67 2 4 1 52 240.286 2 ↓
Mid Mid (pH 6-8) 1.28 3.97 -12.26 1 4 0 51 239.278 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(1-ethylimidazol-2-yl)-(5-quinolyl)methanol (R)-(1-ethylimidazol-2-yl)-(5-qu…

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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) 1.66 5.47 -36.85 2 4 1 52 254.313 3 ↓
Mid Mid (pH 6-8) 1.66 5.03 -11.51 1 4 0 51 253.305 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(1-ethylimidazol-2-yl)-(5-quinolyl)methanol (S)-(1-ethylimidazol-2-yl)-(5-qu…

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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) 1.66 6.36 -36.26 2 4 1 52 254.313 3 ↓
Mid Mid (pH 6-8) 1.66 5.73 -10.59 1 4 0 51 253.305 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(1-propylimidazol-2-yl)-(5-quinolyl)methanol (R)-(1-propylimidazol-2-yl)-(5-q…

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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) 2.16 6.21 -36.87 2 4 1 52 268.34 4 ↓
Mid Mid (pH 6-8) 2.16 5.79 -11.11 1 4 0 51 267.332 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(1-propylimidazol-2-yl)-(5-quinolyl)methanol (S)-(1-propylimidazol-2-yl)-(5-q…

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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) 2.16 7.13 -36.12 2 4 1 52 268.34 4 ↓
Mid Mid (pH 6-8) 2.16 6.47 -10.27 1 4 0 51 267.332 4 ↓

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

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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 = 215038 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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