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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: 5-(3-aminoprop-1-ynyl)-N-(4,5-dimethylthiazol-2-yl)pyridine-2-carboxamide 5-(3-aminoprop-1-ynyl)-N-(4,5-di…

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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) 0.16 4.18 -59.77 4 5 1 83 287.368 2 ↓
Mid Mid (pH 6-8) 0.16 3.78 -12.49 3 5 0 81 286.36 2 ↓

Analogs

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Popular Name: 5-(3-aminoprop-1-ynyl)-N-(4-ethyl-5-methyl-thiazol-2-yl)pyridine-2-carboxamide 5-(3-aminoprop-1-ynyl)-N-(4-ethy…

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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) 0.74 4.59 -56.61 4 5 1 83 301.395 3 ↓
Mid Mid (pH 6-8) 0.74 4.19 -9.17 3 5 0 81 300.387 3 ↓

Analogs

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Popular Name: 5-(3-aminoprop-1-ynyl)-N-(4-isopropylthiazol-2-yl)pyridine-2-carboxamide 5-(3-aminoprop-1-ynyl)-N-(4-isop…

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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 4.4 -55.91 4 5 1 83 301.395 3 ↓
Mid Mid (pH 6-8) 1.00 3.99 -8.33 3 5 0 81 300.387 3 ↓

Analogs

42218459
42218459
28354101
28354101

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Popular Name: 6-[(5-methylthiazol-2-yl)carbamoyl]pyridine-2-carboxylic 6-[(5-methylthiazol-2-yl)carbamo…

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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) 0.58 4.73 -50.23 1 6 -1 95 262.27 3 ↓

Analogs

42199016
42199016
28354101
28354101

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Popular Name: 6-[(4-methylthiazol-2-yl)carbamoyl]pyridine-2-carboxylic 6-[(4-methylthiazol-2-yl)carbamo…

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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) 0.58 4.18 -50.15 1 6 -1 95 262.27 3 ↓

Analogs

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Popular Name: methyl methyl

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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) 0.77 4.82 -12.37 1 6 0 81 277.305 4 ↓

Analogs

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Popular Name: methyl methyl

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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) 0.77 4.27 -8.89 1 6 0 81 277.305 4 ↓

Analogs

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Popular Name: N-(4-ethyl-5-methyl-thiazol-2-yl)-6-methyl-pyridine-2-carboxamide N-(4-ethyl-5-methyl-thiazol-2-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) 1.78 5.7 -9.63 1 4 0 55 261.35 3 ↓

Analogs

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Popular Name: N,6-dimethyl-N-(4-methylthiazol-2-yl)pyridine-2-carboxamide N,6-dimethyl-N-(4-methylthiazol-…

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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) 1.23 6.54 -9.6 0 4 0 46 247.323 2 ↓

Analogs

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Popular Name: methyl methyl

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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) 1.06 5.28 -13.51 1 6 0 81 291.332 4 ↓

Analogs

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Popular Name: 3-chloro-6-ethoxy-N-thiazol-2-yl-pyridine-2-carboxamide 3-chloro-6-ethoxy-N-thiazol-2-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) 2.50 3.35 -11.42 1 5 0 64 283.74 4 ↓
Hi High (pH 8-9.5) 2.57 1.76 -45.1 0 5 -1 70 282.732 4 ↓

Analogs

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Popular Name: 3-chloro-6-ethoxy-N-(5-methylthiazol-2-yl)pyridine-2-carboxamide 3-chloro-6-ethoxy-N-(5-methylthi…

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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) 2.72 4.18 -11.45 1 5 0 64 297.767 4 ↓

Analogs

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Popular Name: 3-chloro-6-ethoxy-N-methyl-N-thiazol-2-yl-pyridine-2-carboxamide 3-chloro-6-ethoxy-N-methyl-N-thi…

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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) 2.75 5.87 -12.74 0 5 0 55 297.767 4 ↓

Analogs

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Popular Name: 3-hydroxy-N-(4-isopropylthiazol-2-yl)pyridine-2-carboxamide 3-hydroxy-N-(4-isopropylthiazol-…

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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) 2.11 3.35 -10.75 2 5 0 75 263.322 3 ↓
Mid Mid (pH 6-8) 2.11 4.35 -47.15 1 5 -1 78 262.314 3 ↓
Lo Low (pH 4.5-6) 2.11 3.82 -42.69 3 5 1 76 264.33 3 ↓

Analogs

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Popular Name: 6-[(4-isopropylthiazol-2-yl)carbamoyl]-2-methyl-pyridine-3-carboxylic 6-[(4-isopropylthiazol-2-yl)carb…

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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) 1.95 6.05 -42.84 1 6 -1 95 304.351 4 ↓

Analogs

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Popular Name: 6-[(4-isopropylthiazol-2-yl)carbamoyl]pyridine-2-carboxylic 6-[(4-isopropylthiazol-2-yl)carb…

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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) 1.63 5.45 -50.35 1 6 -1 95 290.324 4 ↓

Analogs

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Popular Name: methyl methyl

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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 4.34 -9.29 1 6 0 81 277.305 4 ↓
Hi High (pH 8-9.5) 1.07 2.83 -45.13 0 6 -1 88 276.297 4 ↓

Analogs

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Popular Name: N-(4,5-dimethylthiazol-2-yl)-5-methoxy-4-oxo-1H-pyridine-2-carboxamide N-(4,5-dimethylthiazol-2-yl)-5-m…

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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) 1.25 2.61 -54.92 1 6 -1 87 278.313 3 ↓
Mid Mid (pH 6-8) 0.40 2.71 -48.09 1 6 -1 90 278.313 3 ↓
Mid Mid (pH 6-8) 0.34 4.17 -19.48 2 6 0 84 279.321 3 ↓

Parameters Provided:

ring.id = 8964
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 = 8964 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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