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Analogs

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Popular Name: 4-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]thiazol-2-amine 4-[(4,5-dimethyl-1,2,4-triazol-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) 0.39 3.83 -17.16 2 5 0 70 209.278 2 ↓
Lo Low (pH 4.5-6) 0.39 4.31 -38.86 3 5 1 71 210.286 2 ↓

Analogs

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Popular Name: 4-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]thiazol-2-amine 4-[(4-ethyl-5-methyl-1,2,4-triaz…

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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) 0.77 4.75 -12.74 2 5 0 70 223.305 3 ↓
Lo Low (pH 4.5-6) 0.77 5.01 -37.53 3 5 1 71 224.313 3 ↓

Analogs

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Popular Name: 4-[(5-methyl-4-propyl-1,2,4-triazol-3-yl)methyl]thiazol-2-amine 4-[(5-methyl-4-propyl-1,2,4-tria…

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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) 1.27 5.51 -12.19 2 5 0 70 237.332 4 ↓
Lo Low (pH 4.5-6) 1.27 5.77 -37.25 3 5 1 71 238.34 4 ↓

Analogs

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Popular Name: 4-[(4-isopropyl-5-methyl-1,2,4-triazol-3-yl)methyl]thiazol-2-amine 4-[(4-isopropyl-5-methyl-1,2,4-t…

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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 4.9 -16.14 2 5 0 70 237.332 3 ↓
Lo Low (pH 4.5-6) 1.13 5.38 -37.73 3 5 1 71 238.34 3 ↓

Parameters Provided:

ring.id = 604244
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 = 604244 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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