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

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Popular Name: (6R)-N-[(2-phenyloxazol-4-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine (6R)-N-[(2-phenyloxazol-4-yl)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) 1.49 5.81 -55.15 2 6 1 73 296.354 4 ↓
Hi High (pH 8-9.5) 1.49 4.66 -12.23 1 6 0 69 295.346 4 ↓

Analogs

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Popular Name: (6S)-N-[(2-phenyloxazol-4-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine (6S)-N-[(2-phenyloxazol-4-yl)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) 1.49 5.81 -56.42 2 6 1 73 296.354 4 ↓
Hi High (pH 8-9.5) 1.49 4.64 -13.95 1 6 0 69 295.346 4 ↓

Analogs

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Popular Name: (6R)-N-[[2-(3-chlorophenyl)oxazol-4-yl]methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-am (6R)-N-[[2-(3-chlorophenyl)oxazo…

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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) 2.15 6.32 -55.92 2 6 1 73 330.799 4 ↓
Hi High (pH 8-9.5) 2.15 5.17 -12.34 1 6 0 69 329.791 4 ↓

Analogs

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Popular Name: (6S)-N-[[2-(3-chlorophenyl)oxazol-4-yl]methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-am (6S)-N-[[2-(3-chlorophenyl)oxazo…

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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) 2.15 6.32 -57.5 2 6 1 73 330.799 4 ↓
Hi High (pH 8-9.5) 2.15 5.15 -14.24 1 6 0 69 329.791 4 ↓

Analogs

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Popular Name: (6R)-N-[[2-(2,4-dimethylphenyl)oxazol-4-yl]methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin- (6R)-N-[[2-(2,4-dimethylphenyl)o…

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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) 2.32 6.92 -54.88 2 6 1 73 324.408 4 ↓
Hi High (pH 8-9.5) 2.32 5.77 -12.26 1 6 0 69 323.4 4 ↓

Analogs

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Popular Name: (6S)-N-[[2-(2,4-dimethylphenyl)oxazol-4-yl]methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin- (6S)-N-[[2-(2,4-dimethylphenyl)o…

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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) 2.32 6.92 -56.43 2 6 1 73 324.408 4 ↓
Hi High (pH 8-9.5) 2.32 5.75 -14.08 1 6 0 69 323.4 4 ↓

Analogs

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Popular Name: (6R)-N-[[2-(4-fluorophenyl)oxazol-4-yl]methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-am (6R)-N-[[2-(4-fluorophenyl)oxazo…

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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) 1.66 5.88 -57.22 2 6 1 73 314.344 4 ↓
Hi High (pH 8-9.5) 1.66 4.73 -11.49 1 6 0 69 313.336 4 ↓

Analogs

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Popular Name: (6S)-N-[[2-(4-fluorophenyl)oxazol-4-yl]methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-am (6S)-N-[[2-(4-fluorophenyl)oxazo…

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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) 1.66 5.88 -58.5 2 6 1 73 314.344 4 ↓
Hi High (pH 8-9.5) 1.66 4.71 -13.19 1 6 0 69 313.336 4 ↓

Analogs

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Popular Name: (6R)-N-[[2-(p-tolyl)oxazol-4-yl]methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine (6R)-N-[[2-(p-tolyl)oxazol-4-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) 1.94 6.48 -54.97 2 6 1 73 310.381 4 ↓
Hi High (pH 8-9.5) 1.94 5.34 -12.1 1 6 0 69 309.373 4 ↓

Analogs

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Popular Name: (6S)-N-[[2-(p-tolyl)oxazol-4-yl]methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine (6S)-N-[[2-(p-tolyl)oxazol-4-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) 1.94 6.48 -56.31 2 6 1 73 310.381 4 ↓
Hi High (pH 8-9.5) 1.94 5.32 -13.69 1 6 0 69 309.373 4 ↓

Analogs

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Popular Name: (6R)-N-[[2-(2-chlorophenyl)oxazol-4-yl]methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-am (6R)-N-[[2-(2-chlorophenyl)oxazo…

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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) 2.12 6.31 -55.95 2 6 1 73 330.799 4 ↓
Hi High (pH 8-9.5) 2.12 5.17 -12.7 1 6 0 69 329.791 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (6S)-N-[[2-(2-chlorophenyl)oxazol-4-yl]methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-am (6S)-N-[[2-(2-chlorophenyl)oxazo…

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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) 2.12 6.31 -56.88 2 6 1 73 330.799 4 ↓
Hi High (pH 8-9.5) 2.12 5.15 -13.99 1 6 0 69 329.791 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (6R)-2-methyl-N-[(2-phenyloxazol-4-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-ami (6R)-2-methyl-N-[(2-phenyloxazol…

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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) 1.58 5.69 -55.52 2 6 1 73 310.381 4 ↓
Hi High (pH 8-9.5) 1.58 4.52 -11.92 1 6 0 69 309.373 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (6S)-2-methyl-N-[(2-phenyloxazol-4-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-ami (6S)-2-methyl-N-[(2-phenyloxazol…

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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) 1.58 5.69 -56.86 2 6 1 73 310.381 4 ↓
Hi High (pH 8-9.5) 1.58 4.55 -12.57 1 6 0 69 309.373 4 ↓

Parameters Provided:

ring.id = 383715
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 = 383715 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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