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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: methyl methyl

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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) 2.17 6.62 -13.15 0 7 0 79 284.275 4 ↓

Analogs

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Popular Name: 2,5-dimethyl-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-aniline 2,5-dimethyl-4-(1-methylpyrazolo…

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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) 2.20 4.81 -8.46 2 6 0 79 269.308 2 ↓

Analogs

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Popular Name: 1-[3-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxyphenyl]-3-propyl-urea 1-[3-(1-methylpyrazolo[3,4-d]pyr…

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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) 2.33 4.74 -16.15 2 8 0 94 326.36 5 ↓

Analogs

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Popular Name: 4-chloro-3-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-aniline 4-chloro-3-(1-methylpyrazolo[3,4…

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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) 1.65 3.86 -9.18 2 6 0 79 275.699 2 ↓

Analogs

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Popular Name: 3-amino-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzonitrile 3-amino-4-(1-methylpyrazolo[3,4-…

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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 3.83 -9.24 2 7 0 103 266.264 2 ↓

Analogs

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Popular Name: 5-amino-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzonitrile 5-amino-2-(1-methylpyrazolo[3,4-…

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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) 0.72 3.72 -12.51 2 7 0 103 266.264 2 ↓

Analogs

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Popular Name: 3-chloro-4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzaldehyde 3-chloro-4-(1-methylpyrazolo[3,4…

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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) 2.36 5.73 -13.47 0 6 0 70 288.694 3 ↓

Analogs

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Popular Name: 3-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxybenzamide 3-(1-methylpyrazolo[3,4-d]pyrimi…

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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) 0.76 2.34 -15.25 2 7 0 96 269.264 3 ↓

Parameters Provided:

ring.id = 148599
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 = 148599 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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