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Popular Name: 5H-thiochromeno[4,3-c]pyridazin-3-amine 5H-thiochromeno[4,3-c]pyridazin-…

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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) 2.05 4.95 -32.64 3 3 1 53 216.289 0 ↓
Mid Mid (pH 6-8) 2.05 4.89 -28.13 3 3 1 53 216.289 0 ↓
Mid Mid (pH 6-8) 2.05 4.8 -10.15 2 3 0 52 215.281 0 ↓

Analogs

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Popular Name: N-methyl-5H-thiochromeno[4,3-c]pyridazin-3-amine N-methyl-5H-thiochromeno[4,3-c]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) 2.42 5.86 -30.18 2 3 1 39 230.316 1 ↓
Mid Mid (pH 6-8) 2.42 5.79 -26.55 2 3 1 39 230.316 1 ↓
Mid Mid (pH 6-8) 2.42 5.69 -10.03 1 3 0 38 229.308 1 ↓

Analogs

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Popular Name: N-propyl-5H-thiochromeno[4,3-c]pyridazin-3-amine N-propyl-5H-thiochromeno[4,3-c]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) 3.30 7.44 -29.69 2 3 1 39 258.37 3 ↓
Mid Mid (pH 6-8) 3.30 7.28 -9.14 1 3 0 38 257.362 3 ↓
Mid Mid (pH 6-8) 3.30 7.38 -26.25 2 3 1 39 258.37 3 ↓

Analogs

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Popular Name: 5H-thiochromeno[4,3-c]pyridazin-3-ylhydrazine 5H-thiochromeno[4,3-c]pyridazin-…

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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) 1.81 4.63 -11.31 3 4 0 64 230.296 1 ↓
Mid Mid (pH 6-8) 1.81 4.72 -28.68 4 4 1 65 231.304 1 ↓

Parameters Provided:

ring.id = 370738
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 = 370738 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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