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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

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Popular Name: N-cyclopropyl-N-(2-hydroxyethyl)-2-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]acetamide N-cyclopropyl-N-(2-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) 0.20 5.81 -11.46 1 6 0 71 284.385 7 ↓

Analogs

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Popular Name: 2-[(5-amino-4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropyl-N-ethyl-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) 1.01 8.05 -12.65 2 6 0 77 283.401 6 ↓

Analogs

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Popular Name: 2-[(5-amino-4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropyl-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) 0.39 5.59 -12.74 3 6 0 86 255.347 5 ↓

Analogs

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Popular Name: 2-[(5-amino-4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropyl-N-methyl-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) 0.64 7.31 -12.98 2 6 0 77 269.374 5 ↓

Analogs

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Popular Name: (2S)-2-[(5-amino-4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropyl-propanamide (2S)-2-[(5-amino-4-isopropyl-1,2…

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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) 0.76 6.25 -12.24 3 6 0 86 269.374 5 ↓

Analogs

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Popular Name: (2R)-2-[(5-amino-4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropyl-propanamide (2R)-2-[(5-amino-4-isopropyl-1,2…

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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) 0.76 6.27 -12.15 3 6 0 86 269.374 5 ↓

Analogs

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Popular Name: (2S)-N-cyclopropyl-2-[[5-(dimethylamino)-4-isopropyl-1,2,4-triazol-3-yl]sulfanyl]propanamide (2S)-N-cyclopropyl-2-[[5-(dimeth…

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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) 1.37 8.27 -11.37 1 6 0 63 297.428 6 ↓

Analogs

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Popular Name: (2R)-N-cyclopropyl-2-[[5-(dimethylamino)-4-isopropyl-1,2,4-triazol-3-yl]sulfanyl]propanamide (2R)-N-cyclopropyl-2-[[5-(dimeth…

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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) 1.37 8.27 -11.33 1 6 0 63 297.428 6 ↓

Analogs

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Popular Name: (2S)-N-(cyanomethyl)-N-cyclopropyl-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide (2S)-N-(cyanomethyl)-N-cycloprop…

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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 7.83 -15.98 0 6 0 75 265.342 5 ↓

Analogs

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Popular Name: (2R)-N-(cyanomethyl)-N-cyclopropyl-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide (2R)-N-(cyanomethyl)-N-cycloprop…

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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 7.85 -15.65 0 6 0 75 265.342 5 ↓

Parameters Provided:

ring.id = 54652
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 = 54652 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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