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Analogs

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Popular Name: 5-(thiazol-5-ylmethylamino)-2,3-dihydrophthalazine-1,4-dione 5-(thiazol-5-ylmethylamino)-2,3-…

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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) 1.46 -1 -47.52 2 6 -1 94 273.297 3 ↓
Lo Low (pH 4.5-6) 1.46 -1.73 -11.85 3 6 0 91 274.305 3 ↓

Analogs

37797034
37797034

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Popular Name: 5-[[(1R)-1-(4-methylthiazol-5-yl)ethyl]amino]-2,3-dihydrophthalazine-1,4-dione 5-[[(1R)-1-(4-methylthiazol-5-yl…

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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) 2.24 0.22 -47.53 2 6 -1 94 301.351 3 ↓
Lo Low (pH 4.5-6) 2.24 -0.51 -12.03 3 6 0 91 302.359 3 ↓

Analogs

37797034
37797034

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Popular Name: 5-[[(1S)-1-(4-methylthiazol-5-yl)ethyl]amino]-2,3-dihydrophthalazine-1,4-dione 5-[[(1S)-1-(4-methylthiazol-5-yl…

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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) 2.24 0.16 -47.61 2 6 -1 94 301.351 3 ↓
Lo Low (pH 4.5-6) 2.24 -0.56 -12.09 3 6 0 91 302.359 3 ↓

Parameters Provided:

ring.id = 153556
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 = 153556 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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