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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (3S)-1-[2-(2,4-dioxo-1H-pyrimidin-6-yl)acetyl]-3-methyl-pyrrolidine-3-carboxylic (3S)-1-[2-(2,4-dioxo-1H-pyrimidi…

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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 1.69 -59.7 2 8 -1 126 280.26 3 ↓
Hi High (pH 8-9.5) -0.46 -0.18 -102.23 1 8 -2 129 279.252 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[2-(2,4-dioxo-1H-pyrimidin-6-yl)acetyl]-3-methyl-pyrrolidine-3-carboxylic (3R)-1-[2-(2,4-dioxo-1H-pyrimidi…

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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 1.75 -62.37 2 8 -1 126 280.26 3 ↓
Hi High (pH 8-9.5) -0.46 -0.11 -104.59 1 8 -2 129 279.252 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[2-(2,4-dioxo-1H-pyrimidin-6-yl)acetyl]-3-ethyl-pyrrolidine-3-carboxylic (3S)-1-[2-(2,4-dioxo-1H-pyrimidi…

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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) -0.58 2.33 -53.7 2 8 -1 126 294.287 4 ↓
Hi High (pH 8-9.5) -0.12 0.47 -96.01 1 8 -2 129 293.279 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[2-(2,4-dioxo-1H-pyrimidin-6-yl)acetyl]-3-ethyl-pyrrolidine-3-carboxylic (3R)-1-[2-(2,4-dioxo-1H-pyrimidi…

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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) -0.58 2.24 -61.51 2 8 -1 126 294.287 4 ↓
Hi High (pH 8-9.5) -0.12 0.38 -104.06 1 8 -2 129 293.279 4 ↓

Analogs

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Popular Name: 2-[(2R)-1-[2-(2,4-dioxo-1H-pyrimidin-6-yl)acetyl]pyrrolidin-2-yl]acetic 2-[(2R)-1-[2-(2,4-dioxo-1H-pyrim…

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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) -1.00 2.03 -62.56 2 8 -1 126 280.26 4 ↓
Hi High (pH 8-9.5) -0.55 0.18 -107.19 1 8 -2 129 279.252 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S)-1-[2-(2,4-dioxo-1H-pyrimidin-6-yl)acetyl]pyrrolidin-2-yl]acetic 2-[(2S)-1-[2-(2,4-dioxo-1H-pyrim…

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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) -1.00 2.01 -62.49 2 8 -1 126 280.26 4 ↓
Hi High (pH 8-9.5) -0.55 0.15 -106 1 8 -2 129 279.252 4 ↓

Analogs

42433997
42433997

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Popular Name: 6-[2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxo-ethyl]-1H-pyrimidine-2,4-dione 6-[2-[(2R)-2-(hydroxymethyl)pyrr…

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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) -1.15 -1.74 -17.07 3 7 0 106 253.258 3 ↓
Hi High (pH 8-9.5) -0.69 -3.6 -47.98 2 7 -1 109 252.25 3 ↓

Analogs

42433996
42433996

Draw Identity 99% 90% 80% 70%

Popular Name: 6-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxo-ethyl]-1H-pyrimidine-2,4-dione 6-[2-[(2S)-2-(hydroxymethyl)pyrr…

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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) -1.15 -1.75 -17.23 3 7 0 106 253.258 3 ↓
Hi High (pH 8-9.5) -0.69 -3.6 -47.42 2 7 -1 109 252.25 3 ↓

Parameters Provided:

ring.id = 307279
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 = 307279 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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