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

Analogs

6701922
6701922

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Popular Name: (2S)-2-[[5-[(1S)-1-hydroxyethyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-thiazol-2-yl-propanamide (2S)-2-[[5-[(1S)-1-hydroxyethyl]…

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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) 0.27 3.09 -20.22 2 7 0 93 313.408 5 ↓

Analogs

6701922
6701922

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Popular Name: (2S)-2-[[5-[(1R)-1-hydroxyethyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-thiazol-2-yl-propanamide (2S)-2-[[5-[(1R)-1-hydroxyethyl]…

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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) 0.27 3.11 -20.16 2 7 0 93 313.408 5 ↓

Analogs

6701922
6701922

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[[5-[(1S)-1-hydroxyethyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-thiazol-2-yl-propanamide (2R)-2-[[5-[(1S)-1-hydroxyethyl]…

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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) 0.27 3.09 -20.16 2 7 0 93 313.408 5 ↓

Analogs

6701922
6701922

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[[5-[(1R)-1-hydroxyethyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-thiazol-2-yl-propanamide (2R)-2-[[5-[(1R)-1-hydroxyethyl]…

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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) 0.27 3.11 -20.23 2 7 0 93 313.408 5 ↓

Analogs

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Popular Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-thiazol-2-yl-acetamide 2-[(4-methyl-1,2,4-triazol-3-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) 0.24 5.44 -17.79 1 6 0 73 255.328 4 ↓

Analogs

2783791
2783791

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Popular Name: 4-methyl-2-[[(2S)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]butanoyl]amino]thiazole-5-carboxylic-acid-eth 4-methyl-2-[[(2S)-2-[(4-methyl-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) 1.77 0.6 -16.1 1 8 0 99 369.472 8 ↓

Analogs

2783790
2783790

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Popular Name: 4-methyl-2-[[(2R)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]butanoyl]amino]thiazole-5-carboxylic-acid-eth 4-methyl-2-[[(2R)-2-[(4-methyl-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) 1.77 0.58 -16.3 1 8 0 99 369.472 8 ↓

Analogs

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Popular Name: 4-methyl-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetyl]amino]thiazole-5-carboxylic-acid-ethyl-este 4-methyl-2-[[2-[(4-methyl-1,2,4-…

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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) 0.90 7.36 -15.17 1 8 0 99 341.418 7 ↓
Hi High (pH 8-9.5) 1.09 5.93 -41.87 0 8 -1 105 340.41 7 ↓

Analogs

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Popular Name: 2-[[4-(2-methoxyethyl)-5-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylthiazol-2-yl)acetamide 2-[[4-(2-methoxyethyl)-5-propyl-…

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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 6.87 -12.56 1 7 0 82 355.489 9 ↓

Analogs

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Popular Name: 2-[(5-amino-4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-thiazol-2-yl-acetamide 2-[(5-amino-4-isopropyl-1,2,4-tr…

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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) 0.78 6.16 -17.84 3 7 0 99 298.397 5 ↓

Analogs

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Popular Name: 2-[(5-amino-4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylthiazol-2-yl)acetamide 2-[(5-amino-4-isopropyl-1,2,4-tr…

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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) 1.00 6.43 -14.15 3 7 0 99 312.424 5 ↓

Analogs

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Popular Name: 2-[[5-(dimethylamino)-4-isopropyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylthiazol-2-yl)acetamide 2-[[5-(dimethylamino)-4-isopropy…

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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 8.47 -13.47 1 7 0 76 340.478 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-methylthiazol-2-yl)acetamide 2-[(4-isopropyl-1,2,4-triazol-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) 1.20 7.58 -16.66 1 6 0 73 297.409 5 ↓
Hi High (pH 8-9.5) 1.38 6.35 -49.05 0 6 -1 79 296.401 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-N-thiazol-2-yl-acetamide 2-[(4-isopropyl-1,2,4-triazol-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) 1.22 8.4 -17.49 0 6 0 64 297.409 5 ↓

Parameters Provided:

ring.id = 1480
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 = 1480 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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