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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

28016144
28016144
28016155
28016155

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R,4S,5S)-2-[6-(3-fluoroanilino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (2S,3R,4S,5S)-2-[6-(3-fluoroanil…

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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) 1.79 1.48 -15.57 4 9 0 126 361.333 4 ↓

Analogs

28016144
28016144
28016155
28016155

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,3R,4S,5S)-2-[6-(3-fluoroanilino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (2R,3R,4S,5S)-2-[6-(3-fluoroanil…

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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) 1.79 0.93 -16.76 4 9 0 126 361.333 4 ↓

Analogs

28017648
28017648
28017658
28017658

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R,4S,5S)-2-[6-(4-fluoroanilino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (2S,3R,4S,5S)-2-[6-(4-fluoroanil…

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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) 1.82 1.48 -14.41 4 9 0 126 361.333 4 ↓

Analogs

28017648
28017648
28017658
28017658

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,3R,4S,5S)-2-[6-(4-fluoroanilino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (2R,3R,4S,5S)-2-[6-(4-fluoroanil…

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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) 1.82 0.93 -15.47 4 9 0 126 361.333 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R,4S,5S)-2-[6-(3-hydroxyanilino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (2S,3R,4S,5S)-2-[6-(3-hydroxyani…

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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) 1.15 -1.4 -16.58 5 10 0 146 359.342 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,3R,4S,5S)-2-[6-(3-hydroxyanilino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (2R,3R,4S,5S)-2-[6-(3-hydroxyani…

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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) 1.15 -1.95 -17.85 5 10 0 146 359.342 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R,4S,5S)-2-[6-(4-ethylanilino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (2S,3R,4S,5S)-2-[6-(4-ethylanili…

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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) 2.57 2.85 -14.73 4 9 0 126 371.397 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,3R,4S,5S)-2-[6-(4-ethylanilino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (2R,3R,4S,5S)-2-[6-(4-ethylanili…

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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) 2.57 2.3 -15.68 4 9 0 126 371.397 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3S,4R,5S)-2-(hydroxymethyl)-5-[6-(4-iodoanilino)purin-9-yl]tetrahydrofuran-3,4-diol (2S,3S,4R,5S)-2-(hydroxymethyl)-…

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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) 2.74 2.51 -13.78 4 9 0 126 469.239 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3S,4R,5R)-2-(hydroxymethyl)-5-[6-(4-iodoanilino)purin-9-yl]tetrahydrofuran-3,4-diol (2S,3S,4R,5R)-2-(hydroxymethyl)-…

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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) 2.74 1.96 -14.82 4 9 0 126 469.239 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3S,4R,5R)-2-(hydroxymethyl)-5-[6-(2-isopropylanilino)purin-9-yl]tetrahydrofuran-3,4-diol (2S,3S,4R,5R)-2-(hydroxymethyl)-…

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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) 2.65 3.14 -15.67 4 9 0 126 385.424 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R,4R,5R)-2-(hydroxymethyl)-5-[6-(2-isopropylanilino)purin-9-yl]tetrahydrofuran-3,4-diol (2S,3R,4R,5R)-2-(hydroxymethyl)-…

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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) 2.65 1.86 -13.73 4 9 0 126 385.424 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3S,4R,5S)-2-(hydroxymethyl)-5-[6-(2-isopropylanilino)purin-9-yl]tetrahydrofuran-3,4-diol (2S,3S,4R,5S)-2-(hydroxymethyl)-…

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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) 2.65 3.69 -14.81 4 9 0 126 385.424 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R,4R,5S)-2-(hydroxymethyl)-5-[6-(2-isopropylanilino)purin-9-yl]tetrahydrofuran-3,4-diol (2S,3R,4R,5S)-2-(hydroxymethyl)-…

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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) 2.65 2.07 -14.31 4 9 0 126 385.424 5 ↓

Parameters Provided:

ring.id = 55563
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 = 55563 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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