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Analogs

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Popular Name: 1,3-dimethyl-N-thiazol-2-yl-pyrazole-4-carboxamide 1,3-dimethyl-N-thiazol-2-yl-pyra…

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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) 0.48 3.5 -17.36 1 5 0 60 222.273 2 ↓

Analogs

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Popular Name: 1,3-dimethyl-N-(4-methylthiazol-2-yl)pyrazole-4-carboxamide 1,3-dimethyl-N-(4-methylthiazol-…

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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) 0.70 3.81 -12.46 1 5 0 60 236.3 2 ↓

Analogs

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Popular Name: 1-isopropyl-3-methyl-N-thiazol-2-yl-pyrazole-4-carboxamide 1-isopropyl-3-methyl-N-thiazol-2…

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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) 1.22 -0.3 -16.05 1 5 0 60 250.327 3 ↓

Analogs

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Popular Name: 1-isopropyl-3-methyl-N-(4-methylthiazol-2-yl)pyrazole-4-carboxamide 1-isopropyl-3-methyl-N-(4-methyl…

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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) 1.44 -0.28 -11.13 1 5 0 60 264.354 3 ↓

Analogs

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Popular Name: 3-tert-butyl-1-methyl-N-thiazol-2-yl-pyrazole-4-carboxamide 3-tert-butyl-1-methyl-N-thiazol-…

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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) 2.21 0.34 -15.13 1 5 0 60 264.354 3 ↓

Analogs

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Popular Name: 3-tert-butyl-1-methyl-N-(4-methylthiazol-2-yl)pyrazole-4-carboxamide 3-tert-butyl-1-methyl-N-(4-methy…

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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) 2.43 0.34 -11.09 1 5 0 60 278.381 3 ↓

Analogs

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Popular Name: 3-tert-butyl-1-isopropyl-N-thiazol-2-yl-pyrazole-4-carboxamide 3-tert-butyl-1-isopropyl-N-thiaz…

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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) 2.94 0.55 -13.84 1 5 0 60 292.408 4 ↓

Analogs

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Popular Name: 3,5-dimethyl-N-thiazol-2-yl-1H-pyrazole-4-carboxamide 3,5-dimethyl-N-thiazol-2-yl-1H-p…

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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) 0.64 2.57 -13.81 2 5 0 71 222.273 2 ↓
Hi High (pH 8-9.5) 0.70 0.92 -45.89 1 5 -1 77 221.265 2 ↓

Analogs

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Popular Name: 3,5-dimethyl-N-(5-methylthiazol-2-yl)-1H-pyrazole-4-carboxamide 3,5-dimethyl-N-(5-methylthiazol-…

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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) 0.86 3.41 -13.94 2 5 0 71 236.3 2 ↓

Analogs

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Popular Name: 3,5-dimethyl-N-(4-methylthiazol-2-yl)-1H-pyrazole-4-carboxamide 3,5-dimethyl-N-(4-methylthiazol-…

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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) 0.86 2.85 -9.56 2 5 0 71 236.3 2 ↓

Analogs

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Popular Name: 1-tert-butyl-N-(5-methylthiazol-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide 1-tert-butyl-N-(5-methylthiazol-…

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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) 2.80 6.12 -14.67 1 5 0 60 332.351 4 ↓

Analogs

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Popular Name: N-[4-(chloromethyl)thiazol-2-yl]-1H-pyrazole-4-carboxamide N-[4-(chloromethyl)thiazol-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) 1.01 2.36 -10.42 2 5 0 71 242.691 3 ↓

Analogs

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Popular Name: N-[5-(3-hydroxyprop-1-ynyl)thiazol-2-yl]-1H-pyrazole-4-carboxamide N-[5-(3-hydroxyprop-1-ynyl)thiaz…

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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) 0.00 0.52 -16.85 3 6 0 91 248.267 2 ↓

Analogs

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Popular Name: N-[5-(4-hydroxybut-1-ynyl)thiazol-2-yl]-1H-pyrazole-4-carboxamide N-[5-(4-hydroxybut-1-ynyl)thiazo…

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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) 0.27 1.29 -15.31 3 6 0 91 262.294 3 ↓

Analogs

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Popular Name: N-[5-(3-aminoprop-1-ynyl)thiazol-2-yl]-1H-pyrazole-4-carboxamide N-[5-(3-aminoprop-1-ynyl)thiazol…

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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) -0.56 0.82 -14.84 4 6 0 97 247.283 2 ↓
Mid Mid (pH 6-8) -0.56 1.23 -60.79 5 6 1 98 248.291 2 ↓

Analogs

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Popular Name: (E)-3-[2-(1H-pyrazole-4-carbonylamino)thiazol-5-yl]prop-2-enoic (E)-3-[2-(1H-pyrazole-4-carbonyl…

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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) 0.22 2.03 -58.84 2 7 -1 111 263.258 4 ↓

Analogs

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Popular Name: 5-methyl-N-(5-methylthiazol-2-yl)-1H-pyrazole-4-carboxamide 5-methyl-N-(5-methylthiazol-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) 0.64 2.9 -13.31 2 5 0 71 222.273 2 ↓

Analogs

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Popular Name: N-(4,5-dimethylthiazol-2-yl)-1,5-dimethyl-pyrazole-4-carboxamide N-(4,5-dimethylthiazol-2-yl)-1,5…

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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) 0.92 4.66 -14.64 1 5 0 60 250.327 2 ↓

Analogs

34961517
34961517

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Popular Name: 1,5-dimethyl-N-(4-methylthiazol-2-yl)pyrazole-4-carboxamide 1,5-dimethyl-N-(4-methylthiazol-…

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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) 0.70 3.61 -10.13 1 5 0 60 236.3 2 ↓

Analogs

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Popular Name: N-(4-isopropylthiazol-2-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide N-(4-isopropylthiazol-2-yl)-3,5-…

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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) 1.91 4.12 -9.2 2 5 0 71 264.354 3 ↓

Parameters Provided:

ring.id = 74407
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 = 74407 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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