UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

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Popular Name: N-(2-furylmethyl)-3-methylsulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine N-(2-furylmethyl)-3-methylsulfan…

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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) 1.38 5.22 -8.02 2 6 0 80 261.31 4 ↓

Analogs

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Popular Name: N-(2-furylmethyl)-N-methyl-3-methylsulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine N-(2-furylmethyl)-N-methyl-3-met…

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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) 1.62 6.82 -7.86 1 6 0 71 275.337 4 ↓

Analogs

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Popular Name: N-[(5-methyl-2-furyl)methyl]-3-methylsulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine N-[(5-methyl-2-furyl)methyl]-3-m…

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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) 1.60 6.04 -8.07 2 6 0 80 275.337 4 ↓

Analogs

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Popular Name: N-[(5-bromo-2-furyl)methyl]-N,1-dimethyl-pyrazolo[3,4-d]pyrimidin-4-amine N-[(5-bromo-2-furyl)methyl]-N,1-…

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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 7.61 -12.71 0 6 0 60 322.166 3 ↓

Analogs

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Popular Name: N-ethyl-N-(2-furylmethyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine N-ethyl-N-(2-furylmethyl)-1-meth…

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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) 1.34 7.61 -9.53 0 6 0 60 257.297 4 ↓

Parameters Provided:

ring.id = 266870
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 = 266870 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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