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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: N-(2-isopentyloxyethyl)-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide N-(2-isopentyloxyethyl)-2-(1-met…

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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) 2.23 4.37 -12.25 1 6 0 69 322.434 8 ↓

Analogs

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Popular Name: 2-(1-methylpyrazol-4-yl)-N-[3-oxo-3-(propylamino)propyl]thiazole-5-carboxamide 2-(1-methylpyrazol-4-yl)-N-[3-ox…

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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) 0.85 2.28 -19.51 2 7 0 89 321.406 7 ↓

Analogs

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Popular Name: N-[3-(ethylsulfonylamino)propyl]-2-(1-methylpyrazol-4-yl)thiazole-5-carboxamide N-[3-(ethylsulfonylamino)propyl]…

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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) 0.40 0.18 -20.33 2 8 0 106 357.461 8 ↓

Analogs

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Popular Name: N-[(1S)-1-cyano-3-methyl-butyl]-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide N-[(1S)-1-cyano-3-methyl-butyl]-…

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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) 2.02 5.01 -13.41 1 6 0 84 303.391 5 ↓

Analogs

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Popular Name: N-[(1R)-1-cyano-3-methyl-butyl]-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide N-[(1R)-1-cyano-3-methyl-butyl]-…

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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) 2.02 4.98 -13.42 1 6 0 84 303.391 5 ↓

Analogs

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Popular Name: tert-butyl tert-butyl

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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 4.75 -16.25 1 8 0 89 365.459 7 ↓

Analogs

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Popular Name: N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-(1-methylpyrazol-4-yl)thiazole-5-carboxamide N-[2-[2-methoxyethyl(methyl)amin…

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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) 0.61 3.52 -46.33 2 7 1 73 324.43 8 ↓
Hi High (pH 8-9.5) 0.61 1.1 -12.98 1 7 0 72 323.422 8 ↓

Analogs

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Popular Name: tert-butyl tert-butyl

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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) 2.04 5.81 -15.89 1 8 0 89 379.486 8 ↓

Analogs

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Popular Name: N-[2-[methyl-[(1R)-1-methylpropyl]amino]ethyl]-2-(1-methylpyrazol-4-yl)thiazole-5-carboxamide N-[2-[methyl-[(1R)-1-methylpropy…

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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) 1.84 5.47 -44.37 2 6 1 64 322.458 7 ↓
Hi High (pH 8-9.5) 1.84 3.48 -10.84 1 6 0 63 321.45 7 ↓

Analogs

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Popular Name: N-[2-[methyl-[(1S)-1-methylpropyl]amino]ethyl]-2-(1-methylpyrazol-4-yl)thiazole-5-carboxamide N-[2-[methyl-[(1S)-1-methylpropy…

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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) 1.84 5.45 -44.35 2 6 1 64 322.458 7 ↓
Hi High (pH 8-9.5) 1.84 3.5 -10.8 1 6 0 63 321.45 7 ↓

Analogs

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Popular Name: tert-butyl tert-butyl

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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) 1.69 2.92 -16.32 2 8 0 98 365.459 8 ↓

Analogs

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Popular Name: N-(2-dimethylaminoethyl)-N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)thiazole-5-carboxamide N-(2-dimethylaminoethyl)-N-(2-me…

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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 5.35 -43.61 1 7 1 65 338.457 8 ↓
Hi High (pH 8-9.5) 0.86 2.87 -13.38 0 7 0 63 337.449 8 ↓

Analogs

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Popular Name: butyl butyl

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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) 1.90 5 -10.55 1 7 0 86 322.39 8 ↓

Analogs

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Popular Name: 2-[butyl-[[2-(1-methylpyrazol-4-yl)thiazol-4-yl]methyl]amino]acetamide 2-[butyl-[[2-(1-methylpyrazol-4-…

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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) 1.38 4.59 -38.46 3 6 1 78 308.431 8 ↓
Mid Mid (pH 6-8) 1.38 1.98 -11.35 2 6 0 77 307.423 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[methyl-[(1R)-1-methylpropyl]amino]ethyl]-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide N-[2-[methyl-[(1R)-1-methylpropy…

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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) 1.84 5.26 -39.4 2 6 1 64 322.458 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[methyl-[(1S)-1-methylpropyl]amino]ethyl]-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide N-[2-[methyl-[(1S)-1-methylpropy…

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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) 1.84 5.28 -39.67 2 6 1 64 322.458 7 ↓

Analogs

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Popular Name: N'-(3,3-dimethylbutanoyl)-2-(1-methylpyrazol-4-yl)thiazole-5-carbohydrazide N'-(3,3-dimethylbutanoyl)-2-(1-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) 1.65 3.75 -11.67 2 7 0 89 321.406 5 ↓

Analogs

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Popular Name: 1-[4-methyl-2-(1-methylpyrazol-4-yl)thiazol-5-yl]ethanone 1-[4-methyl-2-(1-methylpyrazol-4…

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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) 1.52 4.41 -9.55 0 4 0 48 221.285 2 ↓

Analogs

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Popular Name: 1-[[2-(1-methylpyrazol-4-yl)thiazole-5-carbonyl]amino]-3-propyl-thiourea 1-[[2-(1-methylpyrazol-4-yl)thia…

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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) 1.43 4.26 -16.82 3 7 0 84 324.435 7 ↓

Analogs

44814561
44814561

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Popular Name: N-isopropyl-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide N-isopropyl-2-(1-methylpyrazol-4…

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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) 1.27 3.04 -11.52 1 5 0 60 250.327 3 ↓

Analogs

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Popular Name: 2-(1-methylpyrazol-4-yl)-N-propyl-thiazole-4-carboxamide 2-(1-methylpyrazol-4-yl)-N-propy…

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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) 1.48 2.98 -11.37 1 5 0 60 250.327 4 ↓

Analogs

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Popular Name: N-[(1R)-1,2-dimethylpropyl]-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide N-[(1R)-1,2-dimethylpropyl]-2-(1…

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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) 2.05 4.54 -11.19 1 5 0 60 278.381 4 ↓

Analogs

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Popular Name: N-[(1S)-1,2-dimethylpropyl]-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide N-[(1S)-1,2-dimethylpropyl]-2-(1…

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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) 2.05 4.26 -11.22 1 5 0 60 278.381 4 ↓

Analogs

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Popular Name: N-[2-(dimethylamino)-2-methyl-propyl]-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide N-[2-(dimethylamino)-2-methyl-pr…

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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 4.68 -38.3 2 6 1 64 308.431 5 ↓

Analogs

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Popular Name: 1-allyl-3-[[2-(1-methylpyrazol-4-yl)thiazole-5-carbonyl]amino]thiourea 1-allyl-3-[[2-(1-methylpyrazol-4…

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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) 1.19 4.05 -16.47 3 7 0 84 322.419 7 ↓

Analogs

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Popular Name: 4-[4-(trifluoromethyl)thiazol-2-yl]-1H-pyrazol-5-amine 4-[4-(trifluoromethyl)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) 1.84 2.03 -8.53 3 4 0 68 234.206 2 ↓

Analogs

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Popular Name: 1-methyl-3-[[2-(1-methylpyrazol-4-yl)thiazole-4-carbonyl]amino]urea 1-methyl-3-[[2-(1-methylpyrazol-…

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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) 0.01 -0.26 -15.35 3 8 0 101 280.313 3 ↓

Analogs

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Popular Name: N-(cyanomethyl)-2-(1-methylpyrazol-4-yl)-N-propyl-thiazole-4-carboxamide N-(cyanomethyl)-2-(1-methylpyraz…

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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 6.56 -14.75 0 6 0 75 289.364 5 ↓

Analogs

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Popular Name: N-(2-amino-2-oxo-ethyl)-N-methyl-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide N-(2-amino-2-oxo-ethyl)-N-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) -0.43 1.37 -18.55 2 7 0 94 279.325 4 ↓

Analogs

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Popular Name: N-isopropylsulfonyl-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide N-isopropylsulfonyl-2-(1-methylp…

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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) 0.78 0.19 -67.48 0 7 -1 100 313.384 4 ↓

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

Structural Results Found: (before additional filtering)

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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 = 16007 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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