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

Analogs

40767351
40767351
40767354
40767354
40767357
40767357
28709827
28709827

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S,2R,4S)-2-(6-chloropurin-9-yl)-4-(hydroxymethyl)cyclobutyl]methanol [(1S,2R,4S)-2-(6-chloropurin-9-y…

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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) 0.29 0.89 -11.31 2 6 0 84 268.704 3 ↓

Analogs

40767354
40767354
40767357
40767357
40767348
40767348
28709827
28709827

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S,2S,4S)-2-(6-chloropurin-9-yl)-4-(hydroxymethyl)cyclobutyl]methanol [(1S,2S,4S)-2-(6-chloropurin-9-y…

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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) 0.29 1.35 -11.2 2 6 0 84 268.704 3 ↓

Analogs

40767357
40767357
40767348
40767348
40767351
40767351

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S,2R,4R)-2-(6-chloropurin-9-yl)-4-(hydroxymethyl)cyclobutyl]methanol [(1S,2R,4R)-2-(6-chloropurin-9-y…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.29 1.37 -9.85 2 6 0 84 268.704 3 ↓

Analogs

16952124
16952124
16952125
16952125
40767348
40767348

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S,2S,4R)-2-(6-chloropurin-9-yl)-4-(hydroxymethyl)cyclobutyl]methanol [(1S,2S,4R)-2-(6-chloropurin-9-y…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.29 1.55 -11.24 2 6 0 84 268.704 3 ↓

Analogs

6272
6272

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S,2R,4R)-4-(6-aminopurin-9-yl)-2-fluoro-2-(hydroxymethyl)cyclobutyl]methanol [(1S,2R,4R)-4-(6-aminopurin-9-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) -0.12 -0.74 -14.76 4 7 0 110 267.264 3 ↓

Analogs

6272
6272

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S,2R,4S)-4-(6-aminopurin-9-yl)-2-fluoro-2-(hydroxymethyl)cyclobutyl]methanol [(1S,2R,4S)-4-(6-aminopurin-9-yl…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) -0.12 0.44 -17.65 4 7 0 110 267.264 3 ↓

Analogs

6272
6272

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S,2S,4R)-4-(6-aminopurin-9-yl)-2-fluoro-2-(hydroxymethyl)cyclobutyl]methanol [(1S,2S,4R)-4-(6-aminopurin-9-yl…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) -0.12 -0.11 -16.49 4 7 0 110 267.264 3 ↓

Parameters Provided:

ring.id = 516777
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 = 516777 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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