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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-tert-butyl-2-methyl-pyrazol-3-yl)-2-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)acetamide N-(5-tert-butyl-2-methyl-pyrazol…

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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 8.05 -59.34 2 7 1 77 329.428 4 ↓
Mid Mid (pH 6-8) 1.76 5.85 -18.26 1 7 0 76 328.42 4 ↓

Analogs

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Popular Name: 2-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-N-(2-isopropylpyrazol-3-yl)acetamide 2-(6,8-dihydro-5H-pyrido[3,4-d]p…

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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) 0.56 7.17 -59.5 2 7 1 77 301.374 4 ↓
Mid Mid (pH 6-8) 0.56 4.98 -17.86 1 7 0 76 300.366 4 ↓

Analogs

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Popular Name: 2-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide 2-(6,8-dihydro-5H-pyrido[3,4-d]p…

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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) 0.04 6.16 -60.15 2 7 1 77 287.347 3 ↓
Mid Mid (pH 6-8) 0.04 3.96 -18.76 1 7 0 76 286.339 3 ↓

Analogs

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Popular Name: (2R)-2-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-N-(2-isopropylpyrazol-3-yl)propanamide (2R)-2-(6,8-dihydro-5H-pyrido[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) 0.52 7.7 -53.68 2 7 1 77 315.401 4 ↓
Mid Mid (pH 6-8) 0.52 5.3 -13.34 1 7 0 76 314.393 4 ↓

Analogs

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Popular Name: (2S)-2-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-N-(2-isopropylpyrazol-3-yl)propanamide (2S)-2-(6,8-dihydro-5H-pyrido[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) 0.52 7.65 -49.4 2 7 1 77 315.401 4 ↓
Mid Mid (pH 6-8) 0.52 5.37 -17.33 1 7 0 76 314.393 4 ↓

Analogs

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Popular Name: (NE)-2-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-N-(2-propyl-1H-pyrazol-3-ylidene)acetamide (NE)-2-(6,8-dihydro-5H-pyrido[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) 0.70 7.2 -59.55 2 7 1 77 301.374 5 ↓
Mid Mid (pH 6-8) 0.70 5 -17.68 1 7 0 76 300.366 5 ↓

Analogs

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Popular Name: (NE)-2-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-N-(2-isobutyl-1H-pyrazol-3-ylidene)acetamide (NE)-2-(6,8-dihydro-5H-pyrido[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) 0.94 7.7 -60.13 2 7 1 77 315.401 5 ↓
Mid Mid (pH 6-8) 0.94 5.5 -17.73 1 7 0 76 314.393 5 ↓

Parameters Provided:

ring.id = 352230
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 = 352230 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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