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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: N-[5-(2-furyl)-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-phenyl-propanamide N-[5-(2-furyl)-2-(4-methyl-6-oxo…

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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) 2.81 10.66 -33.98 2 8 0 106 389.415 6 ↓
Mid Mid (pH 6-8) 3.26 10.32 -52.76 1 8 -1 109 388.407 6 ↓
Mid Mid (pH 6-8) 2.81 11.48 -14.57 2 8 0 106 389.415 6 ↓

Analogs

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Popular Name: N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-(2-furyl)pyrazol-3-yl]-3-phenyl-propanamide N-[2-(4-ethyl-6-oxo-1H-pyrimidin…

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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) 3.38 11.39 -32.21 2 8 0 106 403.442 7 ↓
Mid Mid (pH 6-8) 3.38 12.22 -13.83 2 8 0 106 403.442 7 ↓
Mid Mid (pH 6-8) 3.84 11.06 -52.59 1 8 -1 109 402.434 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[5-(2-furyl)-2-(4-oxo-6-propyl-3H-pyrimidin-2-yl)pyrazol-3-yl]-3-phenyl-propanamide N-[5-(2-furyl)-2-(4-oxo-6-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) 3.88 12.16 -31.54 2 8 0 106 417.469 8 ↓
Mid Mid (pH 6-8) 4.34 11.83 -52.29 1 8 -1 109 416.461 8 ↓
Mid Mid (pH 6-8) 3.88 13 -13.52 2 8 0 106 417.469 8 ↓

Analogs

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Popular Name: N-[5-(2-furyl)-2-(4-isopropyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-phenyl-propanamide N-[5-(2-furyl)-2-(4-isopropyl-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) 3.86 12.04 -29.86 2 8 0 106 417.469 7 ↓
Mid Mid (pH 6-8) 4.32 11.69 -52.83 1 8 -1 109 416.461 7 ↓
Mid Mid (pH 6-8) 3.86 12.85 -13.36 2 8 0 106 417.469 7 ↓

Analogs

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Popular Name: N-[2-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-5-(2-furyl)pyrazol-3-yl]-3-phenyl-propanamide N-[2-(4,5-dimethyl-6-oxo-1H-pyri…

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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) 3.18 11.3 -34.54 2 8 0 106 403.442 6 ↓
Mid Mid (pH 6-8) 3.18 12.09 -14.81 2 8 0 106 403.442 6 ↓
Mid Mid (pH 6-8) 3.64 10.96 -53.87 1 8 -1 109 402.434 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(5-ethyl-4-methyl-6-oxo-1H-pyrimidin-2-yl)-5-(2-furyl)pyrazol-3-yl]-3-phenyl-propanamide N-[2-(5-ethyl-4-methyl-6-oxo-1H-…

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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) 3.65 12.06 -34.93 2 8 0 106 417.469 7 ↓
Mid Mid (pH 6-8) 3.65 12.78 -15.01 2 8 0 106 417.469 7 ↓
Mid Mid (pH 6-8) 4.11 11.72 -54.36 1 8 -1 109 416.461 7 ↓

Parameters Provided:

ring.id = 72669
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 = 72669 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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