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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: (2S)-1-[(2-methylthiazol-4-yl)methyl]-5-oxo-pyrrolidine-2-carboxylic (2S)-1-[(2-methylthiazol-4-yl)me…

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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) -1.87 5.07 -48.5 0 5 -1 73 239.276 3 ↓

Analogs

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Popular Name: (2R)-1-[(2-methylthiazol-4-yl)methyl]-5-oxo-pyrrolidine-2-carboxylic (2R)-1-[(2-methylthiazol-4-yl)me…

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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) -1.87 4.62 -49.55 0 5 -1 73 239.276 3 ↓

Analogs

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Popular Name: (2S)-5-oxo-1-(thiazol-4-ylmethyl)pyrrolidine-2-carboxylic (2S)-5-oxo-1-(thiazol-4-ylmethyl…

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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) -1.59 4.33 -48.14 0 5 -1 73 225.249 3 ↓

Analogs

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Popular Name: (2R)-5-oxo-1-(thiazol-4-ylmethyl)pyrrolidine-2-carboxylic (2R)-5-oxo-1-(thiazol-4-ylmethyl…

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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) -1.59 3.88 -49.02 0 5 -1 73 225.249 3 ↓

Analogs

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Popular Name: (2S)-1-[(2-isopropylthiazol-4-yl)methyl]-5-oxo-pyrrolidine-2-carboxylic (2S)-1-[(2-isopropylthiazol-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) -0.82 6.44 -48.55 0 5 -1 73 267.33 4 ↓

Analogs

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Popular Name: (2R)-1-[(2-isopropylthiazol-4-yl)methyl]-5-oxo-pyrrolidine-2-carboxylic (2R)-1-[(2-isopropylthiazol-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) -0.82 5.98 -49.82 0 5 -1 73 267.33 4 ↓

Analogs

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Popular Name: (2S)-1-[(2-ethylthiazol-4-yl)methyl]-5-oxo-pyrrolidine-2-carboxylic (2S)-1-[(2-ethylthiazol-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) -1.30 5.83 -48.55 0 5 -1 73 253.303 4 ↓

Analogs

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Popular Name: (2R)-1-[(2-ethylthiazol-4-yl)methyl]-5-oxo-pyrrolidine-2-carboxylic (2R)-1-[(2-ethylthiazol-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) -1.30 5.37 -49.67 0 5 -1 73 253.303 4 ↓

Analogs

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Popular Name: (2S)-5-oxo-1-[(2-propylthiazol-4-yl)methyl]pyrrolidine-2-carboxylic (2S)-5-oxo-1-[(2-propylthiazol-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) -0.80 6.6 -48.36 0 5 -1 73 267.33 5 ↓

Analogs

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Popular Name: (2R)-5-oxo-1-[(2-propylthiazol-4-yl)methyl]pyrrolidine-2-carboxylic (2R)-5-oxo-1-[(2-propylthiazol-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) -0.80 6.14 -49.51 0 5 -1 73 267.33 5 ↓

Analogs

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Popular Name: 4-[[(4R)-4-methyl-2-oxo-pyrrolidin-1-yl]methyl]thiazole-2-carboxylic 4-[[(4R)-4-methyl-2-oxo-pyrrolid…

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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) 0.41 4.45 -62.53 0 5 -1 73 239.276 3 ↓

Analogs

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Popular Name: 4-[[(4S)-4-methyl-2-oxo-pyrrolidin-1-yl]methyl]thiazole-2-carboxylic 4-[[(4S)-4-methyl-2-oxo-pyrrolid…

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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) 0.41 4.45 -62.63 0 5 -1 73 239.276 3 ↓

Analogs

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Popular Name: (4R)-4-hydroxy-1-(thiazol-4-ylmethyl)pyrrolidin-2-one (4R)-4-hydroxy-1-(thiazol-4-ylme…

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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) -0.28 -0.12 -13.78 1 4 0 53 198.247 2 ↓

Analogs

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Popular Name: (4S)-4-hydroxy-1-(thiazol-4-ylmethyl)pyrrolidin-2-one (4S)-4-hydroxy-1-(thiazol-4-ylme…

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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) -0.28 -0.11 -14.4 1 4 0 53 198.247 2 ↓

Analogs

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Popular Name: (4R)-4-hydroxy-1-[(2-methylthiazol-4-yl)methyl]pyrrolidin-2-one (4R)-4-hydroxy-1-[(2-methylthiaz…

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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) -0.57 0.62 -13.95 1 4 0 53 212.274 2 ↓

Analogs

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Popular Name: (4S)-4-hydroxy-1-[(2-methylthiazol-4-yl)methyl]pyrrolidin-2-one (4S)-4-hydroxy-1-[(2-methylthiaz…

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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) -0.57 0.63 -14.59 1 4 0 53 212.274 2 ↓

Analogs

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Popular Name: (3R)-1-[(2-methylthiazol-4-yl)methyl]-5-oxo-pyrrolidine-3-carboxylic (3R)-1-[(2-methylthiazol-4-yl)me…

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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) -0.31 4.55 -46.55 0 5 -1 73 239.276 3 ↓
Lo Low (pH 4.5-6) -0.31 2.54 -14.89 1 5 0 71 240.284 3 ↓

Analogs

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Popular Name: (3S)-1-[(2-methylthiazol-4-yl)methyl]-5-oxo-pyrrolidine-3-carboxylic (3S)-1-[(2-methylthiazol-4-yl)me…

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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) -0.31 4.49 -52.59 0 5 -1 73 239.276 3 ↓
Lo Low (pH 4.5-6) -0.31 2.54 -18.34 1 5 0 71 240.284 3 ↓

Analogs

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Popular Name: (4R)-4-amino-1-[(2-methylthiazol-4-yl)methyl]pyrrolidin-2-one (4R)-4-amino-1-[(2-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) -1.06 1.27 -63.62 3 4 1 61 212.298 2 ↓
Hi High (pH 8-9.5) -1.06 0.98 -13.13 2 4 0 59 211.29 2 ↓

Analogs

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Popular Name: (4S)-4-amino-1-[(2-methylthiazol-4-yl)methyl]pyrrolidin-2-one (4S)-4-amino-1-[(2-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) -1.06 1.28 -58.06 3 4 1 61 212.298 2 ↓
Hi High (pH 8-9.5) -1.06 0.99 -13.89 2 4 0 59 211.29 2 ↓

Parameters Provided:

ring.id = 216832
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 = 216832 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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