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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: 2,3-dimethyl-N-(4-methylcyclohexyl)quinoxaline-6-carboxamide 2,3-dimethyl-N-(4-methylcyclohex…

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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) 3.02 6.48 -13.38 1 4 0 55 297.402 2 ↓
Hi High (pH 8-9.5) 3.09 4.47 -7.79 1 4 0 58 297.402 2 ↓

Analogs

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Popular Name: N-(4-aminocyclohexyl)quinoxaline-6-carboxamide N-(4-aminocyclohexyl)quinoxaline…

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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 1.99 -55.96 4 5 1 83 271.344 2 ↓

Analogs

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Popular Name: N-[4-(methylamino)cyclohexyl]quinoxaline-6-carboxamide N-[4-(methylamino)cyclohexyl]qui…

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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 3.69 -50.9 3 5 1 71 285.371 3 ↓

Analogs

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Popular Name: N-[(1R,2S)-2-hydroxycyclohexyl]quinoxaline-6-carboxamide N-[(1R,2S)-2-hydroxycyclohexyl]q…

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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) 1.66 1.88 -14.37 2 5 0 75 271.32 2 ↓

Analogs

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Popular Name: N-[(1S,2S)-2-hydroxycyclohexyl]quinoxaline-6-carboxamide N-[(1S,2S)-2-hydroxycyclohexyl]q…

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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) 1.66 1.47 -15.12 2 5 0 75 271.32 2 ↓

Analogs

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Popular Name: N-[(1R,2R)-2-hydroxycyclohexyl]quinoxaline-6-carboxamide N-[(1R,2R)-2-hydroxycyclohexyl]q…

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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) 1.66 1.47 -15.11 2 5 0 75 271.32 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R)-2-hydroxycyclohexyl]quinoxaline-6-carboxamide N-[(1S,2R)-2-hydroxycyclohexyl]q…

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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) 1.66 1.64 -13.09 2 5 0 75 271.32 2 ↓

Analogs

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Popular Name: N-[1-(hydroxymethyl)cyclohexyl]quinoxaline-6-carboxamide N-[1-(hydroxymethyl)cyclohexyl]q…

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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) 2.25 2.47 -12.26 2 5 0 75 285.347 3 ↓

Analogs

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Popular Name: N-[(1R,2S)-2-aminocyclohexyl]quinoxaline-6-carboxamide N-[(1R,2S)-2-aminocyclohexyl]qui…

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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) 1.17 2.71 -58.22 4 5 1 83 271.344 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2S)-2-aminocyclohexyl]quinoxaline-6-carboxamide N-[(1S,2S)-2-aminocyclohexyl]qui…

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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) 1.17 2.28 -59.06 4 5 1 83 271.344 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R)-2-aminocyclohexyl]quinoxaline-6-carboxamide N-[(1R,2R)-2-aminocyclohexyl]qui…

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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) 1.17 2.28 -59.1 4 5 1 83 271.344 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R)-2-aminocyclohexyl]quinoxaline-6-carboxamide N-[(1S,2R)-2-aminocyclohexyl]qui…

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Activity (Go SEA)

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) 1.17 2.71 -58.16 4 5 1 83 271.344 2 ↓

Parameters Provided:

ring.id = 111936
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 = 111936 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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