UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 1-[(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]cyclopentanecarboxylic 1-[(1-methyl-6-oxo-4,5-dihydropy…

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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 4.03 -52.74 1 7 -1 102 266.277 3 ↓

Analogs

47236614
47236614
35132739
35132739
35206840
35206840
35206839
35206839
35238395
35238395

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Popular Name: N-(2-amino-2-oxo-ethyl)-N-cyclopentyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide N-(2-amino-2-oxo-ethyl)-N-cyclop…

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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) -0.79 0.64 -13.72 3 7 0 105 266.301 4 ↓

Analogs

36166950
36166950
36166948
36166948
36166806
36166806
36166804
36166804
36164363
36164363

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Popular Name: N-allyl-N-cyclopentyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide N-allyl-N-cyclopentyl-6-oxo-4,5-…

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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) 1.13 5.25 -6.47 1 5 0 62 249.314 4 ↓

Analogs

36166806
36166806
36166804
36166804
36164363
36164363
35238995
35238995
35238993
35238993

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Popular Name: N-cyclopentyl-N-(2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide N-cyclopentyl-N-(2-hydroxyethyl)…

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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) -0.15 1.67 -9.01 2 6 0 82 253.302 4 ↓

Analogs

35133150
35133150
12056588
12056588

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Popular Name: N-cyclopentyl-N-(2-dimethylaminoethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide N-cyclopentyl-N-(2-dimethylamino…

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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) 0.51 5.96 -45 2 6 1 66 281.38 5 ↓

Parameters Provided:

ring.id = 125656
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 = 125656 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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