UCSF
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Analogs

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Popular Name: 6-bromo-2-pyrimidin-4-yl-imidazo[1,2-a]pyridin-3-amine 6-bromo-2-pyrimidin-4-yl-imidazo…

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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) 1.29 6.54 -8.15 2 5 0 69 290.124 1 ↓
Lo Low (pH 4.5-6) 1.29 6.99 -30.09 3 5 1 70 291.132 1 ↓

Analogs

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Popular Name: 6-methyl-2-pyrimidin-4-yl-imidazo[1,2-a]pyridin-3-amine 6-methyl-2-pyrimidin-4-yl-imidaz…

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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) 0.93 6.58 -10.34 2 5 0 69 225.255 1 ↓
Mid Mid (pH 6-8) 0.93 7.04 -28.37 3 5 1 70 226.263 1 ↓

Analogs

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Popular Name: 6-chloro-2-pyrimidin-4-yl-imidazo[1,2-a]pyridin-3-amine 6-chloro-2-pyrimidin-4-yl-imidaz…

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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) 1.16 6.43 -8.24 2 5 0 69 245.673 1 ↓
Lo Low (pH 4.5-6) 1.16 6.89 -30.22 3 5 1 70 246.681 1 ↓

Analogs

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Popular Name: 5-methyl-2-pyrimidin-4-yl-imidazo[1,2-a]pyridin-3-amine 5-methyl-2-pyrimidin-4-yl-imidaz…

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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) 0.37 7.07 -28.47 3 5 1 70 226.263 1 ↓
Mid Mid (pH 6-8) 0.37 6.62 -11.17 2 5 0 69 225.255 1 ↓

Analogs

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Popular Name: 6,8-dichloro-2-pyrimidin-4-yl-imidazo[1,2-a]pyridin-3-amine 6,8-dichloro-2-pyrimidin-4-yl-im…

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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) 1.77 6.89 -8.14 2 5 0 69 280.118 1 ↓

Analogs

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Popular Name: 7-methyl-2-pyrimidin-4-yl-imidazo[1,2-a]pyridin-3-amine 7-methyl-2-pyrimidin-4-yl-imidaz…

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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) 0.93 7.04 -28.22 3 5 1 70 226.263 1 ↓
Mid Mid (pH 6-8) 0.93 6.58 -10.79 2 5 0 69 225.255 1 ↓

Analogs

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Popular Name: 8-methyl-2-pyrimidin-4-yl-imidazo[1,2-a]pyridin-3-amine 8-methyl-2-pyrimidin-4-yl-imidaz…

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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) 0.93 6.98 -28.03 3 5 1 70 226.263 1 ↓
Mid Mid (pH 6-8) 0.93 6.53 -10.85 2 5 0 69 225.255 1 ↓

Analogs

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Popular Name: 6-fluoro-2-pyrimidin-4-yl-imidazo[1,2-a]pyridin-3-amine 6-fluoro-2-pyrimidin-4-yl-imidaz…

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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) 0.65 6 -8.44 2 5 0 69 229.218 1 ↓
Lo Low (pH 4.5-6) 0.65 6.45 -31.06 3 5 1 70 230.226 1 ↓

Analogs

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Popular Name: N6,N6-dimethyl-2-pyrimidin-4-yl-imidazo[1,2-a]pyridine-3,6-diamine N6,N6-dimethyl-2-pyrimidin-4-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) 0.59 6.75 -28.04 3 6 1 74 255.305 2 ↓
Mid Mid (pH 6-8) 0.59 6.28 -10.45 2 6 0 72 254.297 2 ↓

Analogs

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Popular Name: 8-methoxy-2-pyrimidin-4-yl-imidazo[1,2-a]pyridin-3-amine 8-methoxy-2-pyrimidin-4-yl-imida…

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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) 0.54 5.21 -13.13 2 6 0 78 241.254 2 ↓
Mid Mid (pH 6-8) 0.54 5.66 -27.55 3 6 1 80 242.262 2 ↓

Parameters Provided:

ring.id = 521583
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 = 521583 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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