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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-N-[(1R)-1-methylpropyl]triazole-4-carboxamide 1-(2,3-dihydro-1,4-benzodioxin-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) 1.71 4.71 -10.14 1 7 0 78 316.361 4 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-N-[(1S)-1-methylpropyl]triazole-4-carboxamide 1-(2,3-dihydro-1,4-benzodioxin-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) 1.71 4.7 -10.12 1 7 0 78 316.361 4 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-N-pentyl-triazole-4-carboxamide 1-(2,3-dihydro-1,4-benzodioxin-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) 2.44 5.26 -9.97 1 7 0 78 330.388 6 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1S)-1,2-dimethylpropyl]-5-methyl-triazole-4-carboxamide 1-(2,3-dihydro-1,4-benzodioxin-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) 1.95 5.22 -10.13 1 7 0 78 330.388 4 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1R)-1,2-dimethylpropyl]-5-methyl-triazole-4-carboxamide 1-(2,3-dihydro-1,4-benzodioxin-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) 1.95 4.92 -10.06 1 7 0 78 330.388 4 ↓

Analogs

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Popular Name: N-(2-diethylaminoethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-triazole-4-carboxamide N-(2-diethylaminoethyl)-1-(2,3-d…

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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 5.61 -41.01 2 8 1 83 360.438 7 ↓
Hi High (pH 8-9.5) 1.28 3.48 -10.11 1 8 0 82 359.43 7 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-ethyl-N-(2-ethylbutyl)-5-methyl-triazole-4-carboxamide 1-(2,3-dihydro-1,4-benzodioxin-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) 3.25 9.06 -9.61 0 7 0 69 372.469 7 ↓

Analogs

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Popular Name: N-[(2R)-2-cyanopropyl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-ethyl-5-methyl-triazole-4-carboxamide N-[(2R)-2-cyanopropyl]-1-(2,3-di…

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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) 1.65 7.4 -12.73 0 8 0 93 355.398 5 ↓

Analogs

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Popular Name: N-[(2S)-2-cyanopropyl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-ethyl-5-methyl-triazole-4-carboxamide N-[(2S)-2-cyanopropyl]-1-(2,3-di…

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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) 1.65 7.36 -12.98 0 8 0 93 355.398 5 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-N-[2-[methyl-[(1R)-1-methylpropyl]amino]ethyl]triazole 1-(2,3-dihydro-1,4-benzodioxin-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) 1.74 6.01 -40.74 2 8 1 83 374.465 7 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-N-[2-[methyl-[(1S)-1-methylpropyl]amino]ethyl]triazole 1-(2,3-dihydro-1,4-benzodioxin-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) 1.74 6 -40.8 2 8 1 83 374.465 7 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-N-(1,1,3,3-tetramethylbutyl)triazole-4-carboxamide 1-(2,3-dihydro-1,4-benzodioxin-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) 3.28 7.29 -9.58 1 7 0 78 372.469 5 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N,5-dimethyl-N-[(1R)-1-methylpropyl]triazole-4-carboxamide 1-(2,3-dihydro-1,4-benzodioxin-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) 1.95 6.89 -10.45 0 7 0 69 330.388 4 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N,5-dimethyl-N-[(1S)-1-methylpropyl]triazole-4-carboxamide 1-(2,3-dihydro-1,4-benzodioxin-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) 1.95 6.9 -10.4 0 7 0 69 330.388 4 ↓

Analogs

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Popular Name: N-butyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-N-[(1S)-1-methylpropyl]triazole-4-carboxamide N-butyl-1-(2,3-dihydro-1,4-benzo…

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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) 3.39 9.35 -9.93 0 7 0 69 372.469 7 ↓

Analogs

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Popular Name: N-butyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-N-[(1R)-1-methylpropyl]triazole-4-carboxamide N-butyl-1-(2,3-dihydro-1,4-benzo…

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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) 3.39 9.24 -9.97 0 7 0 69 372.469 7 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N,N-diisobutyl-5-methyl-triazole-4-carboxamide 1-(2,3-dihydro-1,4-benzodioxin-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) 2.99 9.05 -9.96 0 7 0 69 372.469 6 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1S)-1,2-dimethylpropyl]-N-ethyl-5-methyl-triazole-4-carboxa 1-(2,3-dihydro-1,4-benzodioxin-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) 2.57 8.46 -9.96 0 7 0 69 358.442 5 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1R)-1,2-dimethylpropyl]-N-ethyl-5-methyl-triazole-4-carboxa 1-(2,3-dihydro-1,4-benzodioxin-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) 2.57 8.14 -10.16 0 7 0 69 358.442 5 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1,1-dimethylbutyl)-5-methyl-triazole-4-carboxamide 1-(2,3-dihydro-1,4-benzodioxin-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) 2.75 5.52 -9.58 1 7 0 78 344.415 5 ↓

Analogs

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Popular Name: N-(2,2-difluoroethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N,5-dimethyl-triazole-4-carboxamide N-(2,2-difluoroethyl)-1-(2,3-dih…

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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 5.53 -13.53 0 7 0 69 338.314 4 ↓

Analogs

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Popular Name: 2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)triazol-4-yl]propan-2-amine 2-[1-(2,3-dihydro-1,4-benzodioxi…

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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 2.69 -57.81 3 6 1 77 261.305 2 ↓
Hi High (pH 8-9.5) 1.28 2.43 -11.4 2 6 0 75 260.297 2 ↓

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Popular Name: [2-(dimethylamino)-2-oxo-ethyl] [2-(dimethylamino)-2-oxo-ethyl]

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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 5.65 -19.55 0 9 0 96 346.343 5 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-propyl-1H-1,2,3-triazole-4-carboxylic acid 1-(2,3-dihydro-1,4-benzodioxin-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) 1.96 5.83 -54.14 0 7 -1 89 288.283 4 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-ethyl-1H-1,2,3-triazole-4-carboxylic acid 1-(2,3-dihydro-1,4-benzodioxin-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) 1.45 5.05 -53.8 0 7 -1 89 274.256 3 ↓

Analogs

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Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid 1-(2,3-dihydro-1,4-benzodioxin-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) 0.88 4.35 -53.42 0 7 -1 89 260.229 2 ↓

Parameters Provided:

ring.id = 488748
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 = 488748 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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