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Analogs

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Popular Name: 6-bromo-2-[(2S)-tetrahydrothiophen-2-yl]-3H-imidazo[4,5-b]pyridine 6-bromo-2-[(2S)-tetrahydrothioph…

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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) 2.48 6.13 -7.58 1 3 0 42 284.182 1 ↓
Hi High (pH 8-9.5) 2.48 5.59 -39.34 0 3 -1 40 283.174 1 ↓

Analogs

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Popular Name: 6-bromo-2-[(2R)-tetrahydrothiophen-2-yl]-3H-imidazo[4,5-b]pyridine 6-bromo-2-[(2R)-tetrahydrothioph…

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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) 2.48 6.07 -11.22 1 3 0 42 284.182 1 ↓
Hi High (pH 8-9.5) 2.48 5.64 -39.57 0 3 -1 40 283.174 1 ↓

Analogs

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Popular Name: 2-[(2S)-tetrahydrothiophen-2-yl]-3H-imidazo[4,5-b]pyridine 2-[(2S)-tetrahydrothiophen-2-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) 1.52 5.54 -10.77 1 3 0 42 205.286 1 ↓

Analogs

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Popular Name: 2-[(2R)-tetrahydrothiophen-2-yl]-3H-imidazo[4,5-b]pyridine 2-[(2R)-tetrahydrothiophen-2-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) 1.52 5.48 -14.3 1 3 0 42 205.286 1 ↓

Analogs

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Popular Name: 7-methyl-2-[(2S)-tetrahydrothiophen-2-yl]-3H-imidazo[4,5-b]pyridine 7-methyl-2-[(2S)-tetrahydrothiop…

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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) 1.90 6.18 -10.73 1 3 0 42 219.313 1 ↓

Analogs

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Popular Name: 7-methyl-2-[(2R)-tetrahydrothiophen-2-yl]-3H-imidazo[4,5-b]pyridine 7-methyl-2-[(2R)-tetrahydrothiop…

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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) 1.90 6.13 -14.06 1 3 0 42 219.313 1 ↓

Parameters Provided:

ring.id = 512271
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 = 512271 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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