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

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,3S,4R,5S,6S)-5-acetamido-4-acetoxy-6-benzyloxy-2-(hydroxymethyl)tetrahydropyran-3-yl] [(2R,3S,4R,5S,6S)-5-acetamido-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) 0.32 4.71 -15.07 2 9 0 120 395.408 9 ↓

Analogs

22050204
22050204
22050209
22050209
22050213
22050213
22050217
22050217

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Popular Name: (2S,3R,4S,5S,6S)-4-amino-2-benzyloxy-6-(hydroxymethyl)tetrahydropyran-3,5-diol (2S,3R,4S,5S,6S)-4-amino-2-benzy…

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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) -1.36 -2.88 -54.52 6 6 1 107 270.305 4 ↓
Hi High (pH 8-9.5) -1.36 -3.21 -9.46 5 6 0 105 269.297 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R,4S,5S,6R)-4-amino-2-benzyloxy-6-(hydroxymethyl)tetrahydropyran-3,5-diol (2S,3R,4S,5S,6R)-4-amino-2-benzy…

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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) -1.36 -4.49 -44.02 6 6 1 107 270.305 4 ↓
Hi High (pH 8-9.5) -1.36 -4.89 -11.23 5 6 0 105 269.297 4 ↓

Analogs

2572064
2572064

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R,4R,5R,6S)-2-benzyloxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol (2S,3R,4R,5R,6S)-2-benzyloxy-6-(…

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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) -0.43 -4.01 -9.19 4 6 0 99 270.281 4 ↓

Analogs

4855165
4855165
4855167
4855167

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S,3R,4R,5R,6R)-2-[(2-chlorophenyl)methoxy]-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl] N-[(2S,3R,4R,5R,6R)-2-[(2-chloro…

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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) -0.24 -2.27 -17.11 4 7 0 108 345.779 5 ↓

Analogs

4855165
4855165
4855167
4855167

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S,3S,4R,5R,6R)-2-[(2-chlorophenyl)methoxy]-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl] N-[(2S,3S,4R,5R,6R)-2-[(2-chloro…

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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) -0.24 -0.7 -14.05 4 7 0 108 345.779 5 ↓

Analogs

4855165
4855165
4855167
4855167

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S,3R,4S,5R,6R)-2-[(2-chlorophenyl)methoxy]-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl] N-[(2S,3R,4S,5R,6R)-2-[(2-chloro…

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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) -0.24 -1.88 -16.26 4 7 0 108 345.779 5 ↓

Analogs

4855165
4855165
4855167
4855167

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S,3S,4S,5R,6R)-2-[(2-chlorophenyl)methoxy]-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl] N-[(2S,3S,4S,5R,6R)-2-[(2-chloro…

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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) -0.24 -1.11 -13.76 4 7 0 108 345.779 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R,4S,5R,6R)-2-benzyloxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol (2S,3R,4S,5R,6R)-2-benzyloxy-6-(…

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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) -0.43 -3.73 -8.36 4 6 0 99 270.281 4 ↓

Analogs

15938452
15938452
4131545
4131545

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3S,4R,5S,6R)-5-acetamido-3,4-diacetoxy-6-[(2,4-dichlorophenyl)methoxy]tetrahydropyran-2-yl]meth [(2S,3S,4R,5S,6R)-5-acetamido-3,…

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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) 2.31 10.08 -19.24 1 10 0 126 506.335 11 ↓

Analogs

4131545
4131545

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3S,4R,5R,6R)-5-acetamido-3,4-diacetoxy-6-[(2,4-dichlorophenyl)methoxy]tetrahydropyran-2-yl]meth [(2S,3S,4R,5R,6R)-5-acetamido-3,…

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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) 2.31 10.72 -20.97 1 10 0 126 506.335 11 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,3R,4S,5S,6S)-2-benzyloxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol (2R,3R,4S,5S,6S)-2-benzyloxy-6-(…

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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) -0.43 -3 -9.55 4 6 0 99 270.281 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S,3S,4R,5R,6S)-3,5-diazido-2-(azidomethyl)-6-benzyloxy-tetrahydropyran-4-yl]acetamide N-[(2S,3S,4R,5R,6S)-3,5-diazido-…

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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) 2.91 -3.25 -13.9 1 13 0 197 386.376 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S,3S,4S,5R,6S)-3,5-diazido-2-(azidomethyl)-6-benzyloxy-tetrahydropyran-4-yl]acetamide N-[(2S,3S,4S,5R,6S)-3,5-diazido-…

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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) 2.91 -3.25 -17.04 1 13 0 197 386.376 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S,3R,4R,5R,6S)-3,5-diazido-2-(azidomethyl)-6-benzyloxy-tetrahydropyran-4-yl]acetamide N-[(2S,3R,4R,5R,6S)-3,5-diazido-…

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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) 2.91 -4.1 -9.19 1 13 0 197 386.376 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S,3R,4S,5R,6S)-3,5-diazido-2-(azidomethyl)-6-benzyloxy-tetrahydropyran-4-yl]acetamide N-[(2S,3R,4S,5R,6S)-3,5-diazido-…

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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) 2.91 -3.83 -10.77 1 13 0 197 386.376 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,3R,4R,5S,6R)-3,5-diacetoxy-6-benzyloxy-4-[(2,2,2-trifluoroacetyl)amino]tetrahydropyran-2-yl]met [(2R,3R,4R,5S,6R)-3,5-diacetoxy-…

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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) 1.91 9.96 -18.92 1 10 0 126 491.415 12 ↓
Hi High (pH 8-9.5) 2.09 7.98 -49.71 0 10 -1 133 490.407 12 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3R,4R,5S,6R)-3,5-diacetoxy-6-benzyloxy-4-[(2,2,2-trifluoroacetyl)amino]tetrahydropyran-2-yl]met [(2S,3R,4R,5S,6R)-3,5-diacetoxy-…

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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) 1.91 9.58 -14.99 1 10 0 126 491.415 12 ↓
Hi High (pH 8-9.5) 2.09 6.91 -50.56 0 10 -1 133 490.407 12 ↓

Analogs

792602
792602
4303675
4303675

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3R,4R,5S,6S)-5-acetamido-4-acetoxy-6-benzyloxy-2-(hydroxymethyl)tetrahydropyran-3-yl] [(2S,3R,4R,5S,6S)-5-acetamido-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) 0.32 5.27 -18.67 2 9 0 120 395.408 9 ↓

Analogs

792602
792602
4303675
4303675

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,3R,4R,5S,6S)-5-acetamido-4-acetoxy-6-benzyloxy-2-(hydroxymethyl)tetrahydropyran-3-yl] [(2R,3R,4R,5S,6S)-5-acetamido-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) 0.32 5.61 -17.59 2 9 0 120 395.408 9 ↓

Analogs

28212
28212
134040
134040

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S,3S,4R,5S,6R)-2-benzyloxy-5-hydroxy-6-(hydroxymethyl)-4-methoxy-tetrahydropyran-3-yl]acetamide N-[(2S,3S,4R,5S,6R)-2-benzyloxy-…

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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) -0.25 -0.91 -13.1 3 7 0 97 325.361 6 ↓

Parameters Provided:

ring.id = 20422
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 = 20422 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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