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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: 3-[2-(3,5-difluorophenyl)ethyl]-1H-quinazoline-2,4-dione 3-[2-(3,5-difluorophenyl)ethyl]-…

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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) 2.76 7.91 -8.78 1 4 0 55 302.28 3 ↓
Hi High (pH 8-9.5) 3.21 6.07 -38.61 0 4 -1 58 301.272 3 ↓

Analogs

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Popular Name: 3-[(1S)-2-(2-fluorophenyl)-1-methyl-ethyl]-1H-quinazoline-2,4-dione 3-[(1S)-2-(2-fluorophenyl)-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) 2.98 8.45 -10.72 1 4 0 55 298.317 3 ↓

Analogs

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Popular Name: 3-[(1R)-2-(2-fluorophenyl)-1-methyl-ethyl]-1H-quinazoline-2,4-dione 3-[(1R)-2-(2-fluorophenyl)-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) 2.98 8.04 -11.33 1 4 0 55 298.317 3 ↓

Analogs

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Popular Name: 3-[2-(2,5-dimethoxyphenyl)ethyl]-1H-quinazoline-2,4-dione 3-[2-(2,5-dimethoxyphenyl)ethyl]…

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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) 2.54 6.41 -12.75 1 6 0 73 326.352 5 ↓
Hi High (pH 8-9.5) 3.00 4.56 -48.4 0 6 -1 76 325.344 5 ↓

Analogs

15959530
15959530

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Popular Name: (2R)-2-[[(2S)-2-[[(2R)-2-(2,4-dioxo-1H-quinazolin-3-yl)-3-phenyl-propanoyl]amino]-4-methyl-pentanoyl (2R)-2-[[(2S)-2-[[(2R)-2-(2,4-di…

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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) 1.24 11.33 -61.86 3 10 -1 153 521.594 11 ↓
Hi High (pH 8-9.5) 1.70 10.12 -114.75 2 10 -2 156 520.586 11 ↓

Analogs

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Popular Name: (2S)-2-[[(2S)-2-[[(2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-3-phenyl-propanoyl]amino]propanoyl]amino]-4- (2S)-2-[[(2S)-2-[[(2S)-2-(2,4-di…

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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) 0.46 10.44 -60.31 3 10 -1 153 493.54 10 ↓
Hi High (pH 8-9.5) 0.92 8.82 -108.59 2 10 -2 156 492.532 10 ↓

Analogs

38570092
38570092

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Popular Name: (2S,3R)-2-[[(2S)-2-[[(2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-3-phenyl-propanoyl]amino]-3-methyl-butano (2S,3R)-2-[[(2S)-2-[[(2S)-2-(2,4…

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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) -0.68 7.33 -60.78 4 11 -1 173 509.539 10 ↓
Hi High (pH 8-9.5) -0.23 5.62 -108.17 3 11 -2 177 508.531 10 ↓

Analogs

38570090
38570090

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Popular Name: (2S,3S)-2-[[(2S)-2-[[(2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-3-phenyl-propanoyl]amino]-3-methyl-butano (2S,3S)-2-[[(2S)-2-[[(2S)-2-(2,4…

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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) -0.68 7.74 -62.04 4 11 -1 173 509.539 10 ↓
Hi High (pH 8-9.5) -0.23 6.02 -108.95 3 11 -2 177 508.531 10 ↓

Parameters Provided:

ring.id = 301012
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 = 301012 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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