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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: 1-(2-fluorophenyl)-N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-6-methyl-4-oxo-pyridazine-3-carboxamide 1-(2-fluorophenyl)-N-[2-(2-metho…

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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) 3.44 2.05 -23.63 1 6 0 73 395.434 6 ↓

Analogs

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Popular Name: 1-(2-chlorophenyl)-N-[(2S)-2-dimethylamino-2-(4-ethylphenyl)ethyl]-6-methyl-4-oxo-pyridazine-3-carbo 1-(2-chlorophenyl)-N-[(2S)-2-dim…

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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) 4.24 13.68 -52.92 2 6 1 68 439.967 7 ↓
Hi High (pH 8-9.5) 4.24 11.27 -19.88 1 6 0 67 438.959 7 ↓

Analogs

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Popular Name: 1-(2-chlorophenyl)-N-[(2R)-2-dimethylamino-2-(4-ethylphenyl)ethyl]-6-methyl-4-oxo-pyridazine-3-carbo 1-(2-chlorophenyl)-N-[(2R)-2-dim…

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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) 4.24 13.14 -53.16 2 6 1 68 439.967 7 ↓
Hi High (pH 8-9.5) 4.24 10.79 -20.07 1 6 0 67 438.959 7 ↓

Analogs

31893187
31893187
31893191
31893191

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Popular Name: 1-(4-chlorophenyl)-N-[(2S)-2-dimethylamino-2-(4-ethylphenyl)ethyl]-6-methyl-4-oxo-pyridazine-3-carbo 1-(4-chlorophenyl)-N-[(2S)-2-dim…

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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) 4.08 13.55 -57.55 2 6 1 68 439.967 7 ↓
Hi High (pH 8-9.5) 4.08 11.13 -17.91 1 6 0 67 438.959 7 ↓

Analogs

31893187
31893187
31893191
31893191

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(4-chlorophenyl)-N-[(2R)-2-dimethylamino-2-(4-ethylphenyl)ethyl]-6-methyl-4-oxo-pyridazine-3-carbo 1-(4-chlorophenyl)-N-[(2R)-2-dim…

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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) 4.08 13.45 -54.53 2 6 1 68 439.967 7 ↓
Hi High (pH 8-9.5) 4.08 11.27 -19.49 1 6 0 67 438.959 7 ↓

Analogs

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Popular Name: N-[(2S)-2-dimethylamino-2-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)-6-methyl-4-oxo-pyridazine-3-carbo N-[(2S)-2-dimethylamino-2-(4-eth…

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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) 3.72 12.68 -51.76 2 6 1 68 423.512 7 ↓
Hi High (pH 8-9.5) 3.72 10.22 -22.02 1 6 0 67 422.504 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-dimethylamino-2-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)-6-methyl-4-oxo-pyridazine-3-carbo N-[(2R)-2-dimethylamino-2-(4-eth…

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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) 3.72 12.58 -53.46 2 6 1 68 423.512 7 ↓
Hi High (pH 8-9.5) 3.72 10.24 -21.29 1 6 0 67 422.504 7 ↓

Analogs

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Popular Name: 1-(4-chlorophenyl)-N-[(2R)-2-diethylamino-2-(3-methoxyphenyl)ethyl]-6-methyl-4-oxo-pyridazine-3-carb 1-(4-chlorophenyl)-N-[(2R)-2-die…

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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) 3.95 12.54 -50.58 2 7 1 78 469.993 9 ↓

Analogs

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Popular Name: 1-(4-chlorophenyl)-N-[(2S)-2-diethylamino-2-(3-methoxyphenyl)ethyl]-6-methyl-4-oxo-pyridazine-3-carb 1-(4-chlorophenyl)-N-[(2S)-2-die…

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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) 3.95 12.31 -48.72 2 7 1 78 469.993 9 ↓

Analogs

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Popular Name: N-[(2R)-2-diethylamino-2-(3-methoxyphenyl)ethyl]-1-(2-fluorophenyl)-6-methyl-4-oxo-pyridazine-3-carb N-[(2R)-2-diethylamino-2-(3-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) 3.59 12.1 -49.18 2 7 1 78 453.538 9 ↓

Analogs

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Popular Name: N-[(2S)-2-diethylamino-2-(3-methoxyphenyl)ethyl]-1-(2-fluorophenyl)-6-methyl-4-oxo-pyridazine-3-carb N-[(2S)-2-diethylamino-2-(3-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) 3.59 11.82 -47.69 2 7 1 78 453.538 9 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(4-chlorophenyl)-N-[(2R)-2-diethylamino-2-phenyl-ethyl]-6-methyl-4-oxo-pyridazine-3-carboxamide 1-(4-chlorophenyl)-N-[(2R)-2-die…

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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) 3.91 13.22 -50.2 2 6 1 68 439.967 8 ↓

Analogs

31893187
31893187
31893191
31893191

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(4-chlorophenyl)-N-[(2S)-2-diethylamino-2-phenyl-ethyl]-6-methyl-4-oxo-pyridazine-3-carboxamide 1-(4-chlorophenyl)-N-[(2S)-2-die…

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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) 3.91 13.03 -48.27 2 6 1 68 439.967 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(2-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-6-methyl-4-oxo-pyridazine-3-carboxamide 1-(2-fluorophenyl)-N-[2-(4-metho…

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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) 3.06 9.51 -23.75 1 6 0 73 381.407 6 ↓

Analogs

15611669
15611669
7953818
7953818

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Popular Name: 1-(2-fluorophenyl)-6-methyl-4-oxo-N-phenethyl-pyridazine-3-carboxamide 1-(2-fluorophenyl)-6-methyl-4-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) 3.00 10.21 -22.18 1 5 0 64 351.381 5 ↓

Analogs

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Popular Name: 1-(2-fluorophenyl)-6-methyl-4-oxo-N-[2-(4-sulfamoylphenyl)ethyl]pyridazine-3-carboxamide 1-(2-fluorophenyl)-6-methyl-4-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) 1.70 5.17 -30.42 3 8 0 124 430.461 6 ↓

Analogs

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Popular Name: 6-methoxy-4-oxo-N-phenethyl-1-(p-tolyl)pyridazine-3-carboxamide 6-methoxy-4-oxo-N-phenethyl-1-(p…

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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) 3.08 9.51 -17.31 1 6 0 73 363.417 6 ↓

Parameters Provided:

ring.id = 5355
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 = 5355 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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