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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: 6-amino-1-butyl-5-(3-thienylmethylamino)pyrimidine-2,4-dione 6-amino-1-butyl-5-(3-thienylmeth…

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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) 1.21 3.72 -11.07 4 6 0 93 294.38 6 ↓

Analogs

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Popular Name: 6-amino-1-propyl-5-(3-thienylmethylamino)pyrimidine-2,4-dione 6-amino-1-propyl-5-(3-thienylmet…

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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) 0.65 2.94 -11.06 4 6 0 93 280.353 5 ↓

Analogs

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Popular Name: 6-amino-1-ethyl-5-(3-thienylmethylamino)pyrimidine-2,4-dione 6-amino-1-ethyl-5-(3-thienylmeth…

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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) 0.14 2.19 -11.32 4 6 0 93 266.326 4 ↓

Analogs

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Popular Name: 6-amino-1-methyl-5-(3-thienylmethylamino)pyrimidine-2,4-dione 6-amino-1-methyl-5-(3-thienylmet…

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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) -0.23 1.21 -11.52 4 6 0 93 252.299 3 ↓

Analogs

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Popular Name: 6-amino-1-butyl-3-methyl-5-(3-thienylmethylamino)pyrimidine-2,4-dione 6-amino-1-butyl-3-methyl-5-(3-th…

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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 5.87 -10.99 3 6 0 82 308.407 6 ↓

Analogs

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Popular Name: 6-amino-1-isobutyl-3-methyl-5-(3-thienylmethylamino)pyrimidine-2,4-dione 6-amino-1-isobutyl-3-methyl-5-(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) 0.96 5.51 -11.02 3 6 0 82 308.407 5 ↓

Analogs

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Popular Name: 6-amino-1-propyl-5-[[(1S)-1-(3-thienyl)ethyl]amino]pyrimidine-2,4-dione 6-amino-1-propyl-5-[[(1S)-1-(3-t…

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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) 1.21 3.78 -11.29 4 6 0 93 294.38 5 ↓

Analogs

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Popular Name: 6-amino-1-propyl-5-[[(1R)-1-(3-thienyl)ethyl]amino]pyrimidine-2,4-dione 6-amino-1-propyl-5-[[(1R)-1-(3-t…

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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) 1.21 3.77 -11.23 4 6 0 93 294.38 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-1-butyl-5-[[(1S)-1-(3-thienyl)ethyl]amino]pyrimidine-2,4-dione 6-amino-1-butyl-5-[[(1S)-1-(3-th…

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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 -11.37 4 6 0 93 308.407 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-1-butyl-5-[[(1R)-1-(3-thienyl)ethyl]amino]pyrimidine-2,4-dione 6-amino-1-butyl-5-[[(1R)-1-(3-th…

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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 4.55 -11.28 4 6 0 93 308.407 6 ↓

Analogs

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Popular Name: 6-amino-1-(2-methoxyethyl)-5-[[(1S)-1-(3-thienyl)ethyl]amino]pyrimidine-2,4-dione 6-amino-1-(2-methoxyethyl)-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) 0.31 2.61 -14.34 4 7 0 102 310.379 6 ↓

Analogs

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Popular Name: 6-amino-1-(2-methoxyethyl)-5-[[(1R)-1-(3-thienyl)ethyl]amino]pyrimidine-2,4-dione 6-amino-1-(2-methoxyethyl)-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) 0.31 2.62 -14.41 4 7 0 102 310.379 6 ↓

Analogs

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Popular Name: 6-amino-1-isobutyl-5-[[(1S)-1-(3-thienyl)ethyl]amino]pyrimidine-2,4-dione 6-amino-1-isobutyl-5-[[(1S)-1-(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) 1.45 4.08 -11.13 4 6 0 93 308.407 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-1-isobutyl-5-[[(1R)-1-(3-thienyl)ethyl]amino]pyrimidine-2,4-dione 6-amino-1-isobutyl-5-[[(1R)-1-(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) 1.45 4.09 -11.21 4 6 0 93 308.407 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-3-methyl-1-propyl-5-[[(1S)-1-(3-thienyl)ethyl]amino]pyrimidine-2,4-dione 6-amino-3-methyl-1-propyl-5-[[(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) 1.27 5.93 -11.15 3 6 0 82 308.407 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-3-methyl-1-propyl-5-[[(1R)-1-(3-thienyl)ethyl]amino]pyrimidine-2,4-dione 6-amino-3-methyl-1-propyl-5-[[(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) 1.27 5.92 -11.18 3 6 0 82 308.407 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-1-ethyl-5-[[(1S)-1-(3-thienyl)ethyl]amino]pyrimidine-2,4-dione 6-amino-1-ethyl-5-[[(1S)-1-(3-th…

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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 3.03 -11.59 4 6 0 93 280.353 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-1-ethyl-5-[[(1R)-1-(3-thienyl)ethyl]amino]pyrimidine-2,4-dione 6-amino-1-ethyl-5-[[(1R)-1-(3-th…

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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 3.02 -11.52 4 6 0 93 280.353 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-1-methyl-5-[[(1S)-1-(3-thienyl)ethyl]amino]pyrimidine-2,4-dione 6-amino-1-methyl-5-[[(1S)-1-(3-t…

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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) 0.33 2.1 -11.66 4 6 0 93 266.326 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-amino-1-methyl-5-[[(1R)-1-(3-thienyl)ethyl]amino]pyrimidine-2,4-dione 6-amino-1-methyl-5-[[(1R)-1-(3-t…

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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) 0.33 2.11 -11.78 4 6 0 93 266.326 3 ↓

Parameters Provided:

ring.id = 179381
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 = 179381 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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