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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: N-[(2-chlorophenyl)methyl]-4-[2-(1-methylpyrrol-2-yl)-6,7-dihydro-5H-pyrazolo[5,1-b]pyrimidin-4-yl]- N-[(2-chlorophenyl)methyl]-4-[2-…

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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) 1.61 10.2 -18.5 1 7 0 72 425.92 6 ↓

Analogs

21644708
21644708
21644720
21644720
21644760
21644760

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Popular Name: N-[(4-methoxyphenyl)methyl]-4-[2-(1-methylpyrrol-2-yl)-6,7-dihydro-5H-pyrazolo[5,1-b]pyrimidin-4-yl] N-[(4-methoxyphenyl)methyl]-4-[2…

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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) 1.03 9.11 -19.56 1 8 0 81 421.501 7 ↓

Analogs

21644696
21644696
21644727
21644727
21644731
21644731
21644862
21644862

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Popular Name: 4-[2-(1-methylpyrrol-2-yl)-6,7-dihydro-5H-pyrazolo[5,1-b]pyrimidin-4-yl]-4-oxo-N-(p-tolylmethyl)buta 4-[2-(1-methylpyrrol-2-yl)-6,7-d…

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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) 1.42 10.46 -18.08 1 7 0 72 405.502 6 ↓

Analogs

21644696
21644696
21644727
21644727
21644731
21644731
21644862
21644862

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Popular Name: 4-[2-(1-methylpyrrol-2-yl)-6,7-dihydro-5H-pyrazolo[5,1-b]pyrimidin-4-yl]-N-(m-tolylmethyl)-4-oxo-but 4-[2-(1-methylpyrrol-2-yl)-6,7-d…

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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) 1.40 10.45 -18.08 1 7 0 72 405.502 6 ↓

Analogs

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Popular Name: N-[(4-fluorophenyl)methyl]-4-[2-(1-methylpyrrol-2-yl)-6,7-dihydro-5H-pyrazolo[5,1-b]pyrimidin-4-yl]- N-[(4-fluorophenyl)methyl]-4-[2-…

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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) 1.14 9.86 -19.12 1 7 0 72 409.465 6 ↓

Analogs

21644760
21644760

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Popular Name: N-[(2-ethoxyphenyl)methyl]-4-[2-(1-methylpyrrol-2-yl)-6,7-dihydro-5H-pyrazolo[5,1-b]pyrimidin-4-yl]- N-[(2-ethoxyphenyl)methyl]-4-[2-…

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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) 1.36 10.09 -19.09 1 8 0 81 435.528 8 ↓

Analogs

21644708
21644708
21644720
21644720

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-4-[2-(1-methylpyrrol-2-yl)-6,7-dihydro-5H-pyrazolo[5,1-b]pyrim N-[(4-ethoxy-3-methoxy-phenyl)me…

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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 9.94 -21.8 1 9 0 91 465.554 9 ↓

Analogs

21644760
21644760

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Popular Name: N-[(2,5-dimethoxyphenyl)methyl]-4-[2-(1-methylpyrrol-2-yl)-6,7-dihydro-5H-pyrazolo[5,1-b]pyrimidin-4 N-[(2,5-dimethoxyphenyl)methyl]-…

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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) 1.02 8.47 -20.3 1 9 0 91 451.527 8 ↓

Analogs

21644696
21644696
21644862
21644862

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Popular Name: N-[(4-dimethylaminophenyl)methyl]-4-[2-(1-methylpyrrol-2-yl)-6,7-dihydro-5H-pyrazolo[5,1-b]pyrimidin N-[(4-dimethylaminophenyl)methyl…

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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) 1.08 10.28 -19 1 8 0 75 434.544 7 ↓

Analogs

21644708
21644708
21644720
21644720

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4-isopropoxyphenyl)methyl]-4-[2-(1-methylpyrrol-2-yl)-6,7-dihydro-5H-pyrazolo[5,1-b]pyrimidin-4- N-[(4-isopropoxyphenyl)methyl]-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) 1.77 10.63 -19.33 1 8 0 81 449.555 8 ↓

Analogs

21644708
21644708
21644720
21644720

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[2-(1-methylpyrrol-2-yl)-6,7-dihydro-5H-pyrazolo[5,1-b]pyrimidin-4-yl]-4-oxo-N-[(4-propoxyphenyl)m 4-[2-(1-methylpyrrol-2-yl)-6,7-d…

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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) 1.91 10.82 -19.08 1 8 0 81 449.555 9 ↓

Analogs

21644708
21644708

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Popular Name: N-[(4-butoxyphenyl)methyl]-4-[2-(1-methylpyrrol-2-yl)-6,7-dihydro-5H-pyrazolo[5,1-b]pyrimidin-4-yl]- N-[(4-butoxyphenyl)methyl]-4-[2-…

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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) 2.47 11.6 -19.01 1 8 0 81 463.582 10 ↓

Parameters Provided:

ring.id = 87539
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 = 87539 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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