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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: (3S)-N-cycloheptyl-2-(3-ethoxypropyl)-6,9-dimethoxy-3-methyl-1-oxo-4H-pyrazino[4,5-a]indole-3-carbox (3S)-N-cycloheptyl-2-(3-ethoxypr…

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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) 4.37 8.92 -11.3 1 8 0 82 485.625 9 ↓

Analogs

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Popular Name: (3R)-N-cycloheptyl-2-(3-ethoxypropyl)-6,9-dimethoxy-3-methyl-1-oxo-4H-pyrazino[4,5-a]indole-3-carbox (3R)-N-cycloheptyl-2-(3-ethoxypr…

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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) 4.37 9.65 -12.14 1 8 0 82 485.625 9 ↓

Analogs

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Popular Name: (3S)-N-cycloheptyl-6,9-dimethoxy-2-(3-methoxypropyl)-3-methyl-1-oxo-4H-pyrazino[4,5-a]indole-3-carbo (3S)-N-cycloheptyl-6,9-dimethoxy…

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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) 3.99 7.95 -11.42 1 8 0 82 471.598 8 ↓

Analogs

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Popular Name: (3R)-N-cycloheptyl-6,9-dimethoxy-2-(3-methoxypropyl)-3-methyl-1-oxo-4H-pyrazino[4,5-a]indole-3-carbo (3R)-N-cycloheptyl-6,9-dimethoxy…

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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) 3.99 8.71 -13.92 1 8 0 82 471.598 8 ↓

Analogs

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Popular Name: (3S)-N-cycloheptyl-2-isopentyl-3-methyl-1-oxo-4H-pyrazino[4,5-a]indole-3-carboxamide (3S)-N-cycloheptyl-2-isopentyl-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) 5.37 11.47 -8.02 1 5 0 54 409.574 5 ↓

Analogs

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Popular Name: (3R)-N-cycloheptyl-2-isopentyl-3-methyl-1-oxo-4H-pyrazino[4,5-a]indole-3-carboxamide (3R)-N-cycloheptyl-2-isopentyl-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) 5.37 12 -11.11 1 5 0 54 409.574 5 ↓

Analogs

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Popular Name: (3S)-N-cycloheptyl-2-(2-methoxyethyl)-3-methyl-1-oxo-4H-pyrazino[4,5-a]indole-3-carboxamide (3S)-N-cycloheptyl-2-(2-methoxye…

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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) 3.70 8.72 -10.1 1 6 0 64 397.519 5 ↓

Analogs

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Popular Name: (3R)-N-cycloheptyl-2-(2-methoxyethyl)-3-methyl-1-oxo-4H-pyrazino[4,5-a]indole-3-carboxamide (3R)-N-cycloheptyl-2-(2-methoxye…

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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) 3.70 10.49 -11.69 1 6 0 64 397.519 5 ↓

Analogs

15677006
15677006
15677007
15677007

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Popular Name: (3S)-2-butyl-N-cycloheptyl-3-methyl-1-oxo-4H-pyrazino[4,5-a]indole-3-carboxamide (3S)-2-butyl-N-cycloheptyl-3-met…

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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) 5.15 10.95 -8.18 1 5 0 54 395.547 5 ↓

Analogs

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Popular Name: (3R)-2-butyl-N-cycloheptyl-3-methyl-1-oxo-4H-pyrazino[4,5-a]indole-3-carboxamide (3R)-2-butyl-N-cycloheptyl-3-met…

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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) 5.15 11.59 -11.16 1 5 0 54 395.547 5 ↓

Analogs

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Popular Name: (3S)-N-cycloheptyl-3-methyl-1-oxo-2-(3-propylsulfanylpropyl)-4H-pyrazino[4,5-a]indole-3-carboxamide (3S)-N-cycloheptyl-3-methyl-1-ox…

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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) 5.39 13.08 -8.97 1 5 0 54 455.668 8 ↓

Analogs

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Popular Name: (3R)-N-cycloheptyl-3-methyl-1-oxo-2-(3-propylsulfanylpropyl)-4H-pyrazino[4,5-a]indole-3-carboxamide (3R)-N-cycloheptyl-3-methyl-1-ox…

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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) 5.39 13.75 -10.29 1 5 0 54 455.668 8 ↓

Parameters Provided:

ring.id = 83787
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 = 83787 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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