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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

41550794
41550794

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Popular Name: N-[(1S)-2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-7-methoxy-2-oxo-chromene-4-carboxamide N-[(1S)-2,2-dimethyl-1-(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) 2.93 8.52 -12.42 1 7 0 86 369.421 6 ↓

Analogs

41550791
41550791

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Popular Name: N-[(1R)-2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-7-methoxy-2-oxo-chromene-4-carboxamide N-[(1R)-2,2-dimethyl-1-(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) 2.93 8.01 -14.13 1 7 0 86 369.421 6 ↓

Analogs

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Popular Name: N-[2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)ethyl]-7-methoxy-2-oxo-chromene-4-carboxamide N-[2-(4-chloro-3,5-dimethyl-pyra…

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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) 2.29 6.96 -14.77 1 7 0 86 375.812 5 ↓

Analogs

41551759
41551759

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Popular Name: N-[(1R)-2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-7-isopropoxy-2-oxo-chromene-4-carboxamide N-[(1R)-2,2-dimethyl-1-(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) 3.67 9.54 -13.33 1 7 0 86 397.475 7 ↓

Analogs

41551756
41551756

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Popular Name: N-[(1S)-2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-7-isopropoxy-2-oxo-chromene-4-carboxamide N-[(1S)-2,2-dimethyl-1-(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) 3.67 10.09 -11.44 1 7 0 86 397.475 7 ↓

Analogs

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Popular Name: 7-isopropoxy-2-oxo-N-(2-pyrazol-1-ylethyl)chromene-4-carboxamide 7-isopropoxy-2-oxo-N-(2-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) 1.98 6.98 -14.33 1 7 0 86 341.367 6 ↓

Analogs

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Popular Name: N-[2-(4-chloropyrazol-1-yl)ethyl]-7-isopropoxy-2-oxo-chromene-4-carboxamide N-[2-(4-chloropyrazol-1-yl)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) 2.59 7.49 -14.12 1 7 0 86 375.812 6 ↓

Analogs

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Popular Name: N-[2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)ethyl]-7-isopropoxy-2-oxo-chromene-4-carboxamide N-[2-(4-chloro-3,5-dimethyl-pyra…

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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) 3.03 8.52 -14.25 1 7 0 86 403.866 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-7-isopropoxy-2-oxo-chromene-4-carboxamide N-[2-(3,5-dimethylpyrazol-1-yl)e…

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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) 2.42 8.03 -14.49 1 7 0 86 369.421 6 ↓

Analogs

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Popular Name: N-[(1R)-2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-7-ethoxy-2-oxo-chromene-4-carboxamide N-[(1R)-2,2-dimethyl-1-(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) 3.31 8.95 -13.58 1 7 0 86 383.448 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-7-ethoxy-2-oxo-chromene-4-carboxamide N-[(1S)-2,2-dimethyl-1-(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) 3.31 9.41 -12.31 1 7 0 86 383.448 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)ethyl]-7-ethoxy-2-oxo-chromene-4-carboxamide N-[2-(4-chloro-3,5-dimethyl-pyra…

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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) 2.67 7.89 -14.47 1 7 0 86 389.839 6 ↓

Parameters Provided:

ring.id = 547353
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 = 547353 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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