UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

15669230
15669230

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Popular Name: N-(3,4-dimethylphenyl)-2-[3-(4-methyl-3-morpholinosulfonyl-phenyl)-6-oxo-pyridazin-1-yl]acetamide N-(3,4-dimethylphenyl)-2-[3-(4-m…

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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) 2.98 6.79 -28.41 1 9 0 111 496.589 6 ↓

Analogs

21785569
21785569
21785572
21785572

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Popular Name: N-(3-methoxyphenyl)-2-[3-(4-methyl-3-morpholinosulfonyl-phenyl)-6-oxo-pyridazin-1-yl]acetamide N-(3-methoxyphenyl)-2-[3-(4-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) 2.18 4.82 -27.85 1 10 0 120 498.561 7 ↓

Analogs

21785552
21785552
21785556
21785556

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Popular Name: N-(4-ethylphenyl)-2-[3-(4-methyl-3-morpholinosulfonyl-phenyl)-6-oxo-pyridazin-1-yl]acetamide N-(4-ethylphenyl)-2-[3-(4-methyl…

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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 6.89 -28.05 1 9 0 111 496.589 7 ↓

Analogs

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Popular Name: N-(2-ethylphenyl)-2-[3-(4-methyl-3-morpholinosulfonyl-phenyl)-6-oxo-pyridazin-1-yl]acetamide N-(2-ethylphenyl)-2-[3-(4-methyl…

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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 7.17 -27.27 1 9 0 111 496.589 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-methoxyphenyl)-2-[3-(4-methyl-3-morpholinosulfonyl-phenyl)-6-oxo-pyridazin-1-yl]acetamide N-(2-methoxyphenyl)-2-[3-(4-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) 2.16 4.88 -25.03 1 10 0 120 498.561 7 ↓

Analogs

21785603
21785603

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Popular Name: N-(4-methoxyphenyl)-2-[3-(4-methyl-3-morpholinosulfonyl-phenyl)-6-oxo-pyridazin-1-yl]acetamide N-(4-methoxyphenyl)-2-[3-(4-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) 2.21 4.82 -29.41 1 10 0 120 498.561 7 ↓

Analogs

21785552
21785552
21785556
21785556

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Popular Name: N-(2,6-dimethylphenyl)-2-[3-(4-methyl-3-morpholinosulfonyl-phenyl)-6-oxo-pyridazin-1-yl]acetamide N-(2,6-dimethylphenyl)-2-[3-(4-m…

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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 6.93 -24.68 1 9 0 111 496.589 6 ↓

Analogs

15669230
15669230

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Popular Name: N-(2,3-dimethylphenyl)-2-[3-(4-methyl-3-morpholinosulfonyl-phenyl)-6-oxo-pyridazin-1-yl]acetamide N-(2,3-dimethylphenyl)-2-[3-(4-m…

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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) 2.95 6.97 -28.34 1 9 0 111 496.589 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-ethylphenyl)-2-[3-(4-methyl-3-morpholinosulfonyl-phenyl)-6-oxo-pyridazin-1-yl]acetamide N-(3-ethylphenyl)-2-[3-(4-methyl…

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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) 3.04 6.89 -27.73 1 9 0 111 496.589 7 ↓

Analogs

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Popular Name: N-(3-cyanophenyl)-2-[3-(4-methyl-3-morpholinosulfonyl-phenyl)-6-oxo-pyridazin-1-yl]acetamide N-(3-cyanophenyl)-2-[3-(4-methyl…

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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) 1.88 5.9 -32.42 1 10 0 134 493.545 6 ↓

Parameters Provided:

ring.id = 78531
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 = 78531 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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