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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: (2R)-2-[(6-oxopyran-3-carbonyl)amino]-2-phenyl-propanoic (2R)-2-[(6-oxopyran-3-carbonyl)a…

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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) 1.10 7.7 -54.14 1 6 -1 99 286.263 4 ↓

Analogs

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Popular Name: (2S)-2-[(6-oxopyran-3-carbonyl)amino]-2-phenyl-propanoic (2S)-2-[(6-oxopyran-3-carbonyl)a…

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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) 1.10 7.7 -54.12 1 6 -1 99 286.263 4 ↓

Analogs

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Popular Name: N-[[4-(2-aminoethyl)phenyl]methyl]-6-oxo-pyran-3-carboxamide N-[[4-(2-aminoethyl)phenyl]methy…

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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) 0.21 4.58 -56.62 4 5 1 87 273.312 5 ↓

Analogs

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Popular Name: 4-[[(6-oxopyran-3-carbonyl)amino]methyl]benzoic 4-[[(6-oxopyran-3-carbonyl)amino…

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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 5.36 -57.8 1 6 -1 99 272.236 4 ↓

Analogs

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Popular Name: (2S)-2-[(6-oxopyran-3-carbonyl)amino]-2-phenyl-acetic (2S)-2-[(6-oxopyran-3-carbonyl)a…

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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) 0.66 5.85 -57.04 1 6 -1 99 272.236 4 ↓

Analogs

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Popular Name: (2R)-2-[(6-oxopyran-3-carbonyl)amino]-2-phenyl-acetic (2R)-2-[(6-oxopyran-3-carbonyl)a…

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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) 0.66 5.85 -57.02 1 6 -1 99 272.236 4 ↓

Analogs

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Popular Name: N-[(1S)-2-hydroxy-1-phenyl-ethyl]-6-oxo-pyran-3-carboxamide N-[(1S)-2-hydroxy-1-phenyl-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) 0.78 3.47 -11.44 2 5 0 80 259.261 4 ↓

Analogs

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Popular Name: N-[(1R)-2-hydroxy-1-phenyl-ethyl]-6-oxo-pyran-3-carboxamide N-[(1R)-2-hydroxy-1-phenyl-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) 0.78 3.47 -11.47 2 5 0 80 259.261 4 ↓

Analogs

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Popular Name: 3-[[(6-oxopyran-3-carbonyl)amino]methyl]benzoic 3-[[(6-oxopyran-3-carbonyl)amino…

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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) 1.11 6.32 -54.28 1 6 -1 99 272.236 4 ↓

Analogs

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Popular Name: 4-[[methyl-(6-oxopyran-3-carbonyl)amino]methyl]benzoic 4-[[methyl-(6-oxopyran-3-carbony…

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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) 0.91 8.29 -59.15 0 6 -1 91 286.263 4 ↓

Analogs

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Popular Name: N-[(1S)-1-(3-bromophenyl)ethyl]-6-oxo-pyran-3-carboxamide N-[(1S)-1-(3-bromophenyl)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) 2.57 7.24 -12.81 1 4 0 59 322.158 3 ↓

Analogs

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Popular Name: N-[(1R)-1-(3-bromophenyl)ethyl]-6-oxo-pyran-3-carboxamide N-[(1R)-1-(3-bromophenyl)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) 2.57 7.24 -12.79 1 4 0 59 322.158 3 ↓

Analogs

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Popular Name: N-[(2-bromophenyl)methyl]-N-methyl-6-oxo-pyran-3-carboxamide N-[(2-bromophenyl)methyl]-N-meth…

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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 7.88 -12.96 0 4 0 51 322.158 3 ↓

Analogs

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Popular Name: N-[(4-bromophenyl)methyl]-N-methyl-6-oxo-pyran-3-carboxamide N-[(4-bromophenyl)methyl]-N-meth…

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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) 1.81 8.35 -13 0 4 0 51 322.158 3 ↓

Analogs

42258730
42258730

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Popular Name: N-[(1S)-1-(4-bromophenyl)ethyl]-6-oxo-pyran-3-carboxamide N-[(1S)-1-(4-bromophenyl)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) 2.60 7.25 -12.09 1 4 0 59 322.158 3 ↓

Analogs

42258728
42258728

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Popular Name: N-[(1R)-1-(4-bromophenyl)ethyl]-6-oxo-pyran-3-carboxamide N-[(1R)-1-(4-bromophenyl)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) 2.60 7.25 -12.08 1 4 0 59 322.158 3 ↓

Analogs

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Popular Name: N-[(3-bromophenyl)methyl]-6-oxo-pyran-3-carboxamide N-[(3-bromophenyl)methyl]-6-oxo-…

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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) 2.01 6.38 -11.56 1 4 0 59 308.131 3 ↓

Analogs

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Popular Name: N-[(2-bromophenyl)methyl]-6-oxo-pyran-3-carboxamide N-[(2-bromophenyl)methyl]-6-oxo-…

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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) 1.99 6.26 -11.13 1 4 0 59 308.131 3 ↓

Parameters Provided:

ring.id = 30099
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 = 30099 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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