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Popular Name: (2R)-2-[3-(3-methoxypropoxy)phenyl]-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (2R)-2-[3-(3-methoxypropoxy)phen…

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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) 1.76 4.56 -13.04 2 6 0 72 313.357 6 ↓

Analogs

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Popular Name: (2S)-2-[3-(3-methoxypropoxy)phenyl]-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (2S)-2-[3-(3-methoxypropoxy)phen…

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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) 1.76 4.56 -13.03 2 6 0 72 313.357 6 ↓

Analogs

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Popular Name: 4-[3-[(2R)-4-oxo-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-2-yl]phenoxy]butanenitrile 4-[3-[(2R)-4-oxo-2,3-dihydro-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) 1.23 6.01 -18.2 2 6 0 87 308.341 5 ↓

Analogs

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Popular Name: 4-[3-[(2S)-4-oxo-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-2-yl]phenoxy]butanenitrile 4-[3-[(2S)-4-oxo-2,3-dihydro-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) 1.23 6.01 -18.19 2 6 0 87 308.341 5 ↓

Analogs

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Popular Name: (2R)-2-(o-tolyl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (2R)-2-(o-tolyl)-2,3-dihydro-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) 1.87 4.13 -10.5 2 4 0 54 239.278 1 ↓

Analogs

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Popular Name: (2S)-2-(o-tolyl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (2S)-2-(o-tolyl)-2,3-dihydro-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) 1.87 4.17 -10.44 2 4 0 54 239.278 1 ↓

Analogs

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Popular Name: (2R)-2-(m-tolyl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (2R)-2-(m-tolyl)-2,3-dihydro-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) 1.90 5.13 -9.79 2 4 0 54 239.278 1 ↓

Analogs

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Popular Name: (2S)-2-(m-tolyl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (2S)-2-(m-tolyl)-2,3-dihydro-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) 1.90 5.13 -9.76 2 4 0 54 239.278 1 ↓

Analogs

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Popular Name: (2R)-2-(2,3-dimethoxyphenyl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (2R)-2-(2,3-dimethoxyphenyl)-2,3…

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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) 1.29 4.29 -12.22 2 6 0 72 285.303 3 ↓

Analogs

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Popular Name: (2S)-2-(2,3-dimethoxyphenyl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (2S)-2-(2,3-dimethoxyphenyl)-2,3…

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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) 1.29 4.23 -13.68 2 6 0 72 285.303 3 ↓

Analogs

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Popular Name: (2R)-2-(3-ethoxy-4-methoxy-phenyl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (2R)-2-(3-ethoxy-4-methoxy-pheny…

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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) 1.49 4.59 -13.61 2 6 0 72 299.33 4 ↓

Analogs

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Popular Name: (2S)-2-(3-ethoxy-4-methoxy-phenyl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (2S)-2-(3-ethoxy-4-methoxy-pheny…

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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) 1.49 4.59 -13.59 2 6 0 72 299.33 4 ↓

Analogs

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Popular Name: (2R)-2-(4-methoxyphenyl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (2R)-2-(4-methoxyphenyl)-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) 1.53 3.77 -11.2 2 5 0 63 255.277 2 ↓

Analogs

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Popular Name: (2S)-2-(4-methoxyphenyl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (2S)-2-(4-methoxyphenyl)-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) 1.53 3.77 -11.22 2 5 0 63 255.277 2 ↓

Analogs

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Popular Name: (2R)-2-(3-ethoxy-2-hydroxy-phenyl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (2R)-2-(3-ethoxy-2-hydroxy-pheny…

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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) 1.39 3.16 -10.64 3 6 0 83 285.303 3 ↓

Analogs

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Popular Name: (2S)-2-(3-ethoxy-2-hydroxy-phenyl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (2S)-2-(3-ethoxy-2-hydroxy-pheny…

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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) 1.39 2.96 -14.31 3 6 0 83 285.303 3 ↓

Parameters Provided:

ring.id = 298764
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 = 298764 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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