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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: (3S)-3-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methylcarbamoyl]pyrrolidine-3-carboxylic (3S)-3-methyl-1-[(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) -0.44 5.55 -54.85 1 8 -1 103 266.281 3 ↓

Analogs

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Popular Name: (3R)-3-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methylcarbamoyl]pyrrolidine-3-carboxylic (3R)-3-methyl-1-[(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) -0.44 5.67 -61.67 1 8 -1 103 266.281 3 ↓

Analogs

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Popular Name: (3S)-3-ethyl-1-[(4-methyl-1,2,4-triazol-3-yl)methylcarbamoyl]pyrrolidine-3-carboxylic (3S)-3-ethyl-1-[(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) -0.10 6.12 -50.55 1 8 -1 103 280.308 4 ↓

Analogs

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Popular Name: (3R)-3-ethyl-1-[(4-methyl-1,2,4-triazol-3-yl)methylcarbamoyl]pyrrolidine-3-carboxylic (3R)-3-ethyl-1-[(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) -0.10 6.15 -61.17 1 8 -1 103 280.308 4 ↓

Analogs

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Popular Name: (3S)-1-[(4-methyl-1,2,4-triazol-3-yl)methylcarbamoyl]-3-propyl-pyrrolidine-3-carboxylic (3S)-1-[(4-methyl-1,2,4-triazol-…

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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) 0.46 6.88 -50.9 1 8 -1 103 294.335 5 ↓

Analogs

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Popular Name: (3R)-1-[(4-methyl-1,2,4-triazol-3-yl)methylcarbamoyl]-3-propyl-pyrrolidine-3-carboxylic (3R)-1-[(4-methyl-1,2,4-triazol-…

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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) 0.46 6.92 -61.53 1 8 -1 103 294.335 5 ↓

Analogs

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Popular Name: (3R)-3-methyl-1-[[(1S)-1-(4-methyl-1,2,4-triazol-3-yl)ethyl]carbamoyl]pyrrolidine-3-carboxylic (3R)-3-methyl-1-[[(1S)-1-(4-meth…

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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) 0.12 6.23 -54.79 1 8 -1 103 280.308 3 ↓

Analogs

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Popular Name: (3R)-3-methyl-1-[[(1R)-1-(4-methyl-1,2,4-triazol-3-yl)ethyl]carbamoyl]pyrrolidine-3-carboxylic (3R)-3-methyl-1-[[(1R)-1-(4-meth…

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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) 0.12 6.21 -54.47 1 8 -1 103 280.308 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-methyl-1-[[(1S)-1-(4-methyl-1,2,4-triazol-3-yl)ethyl]carbamoyl]pyrrolidine-3-carboxylic (3S)-3-methyl-1-[[(1S)-1-(4-meth…

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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) 0.12 6.29 -57.11 1 8 -1 103 280.308 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-methyl-1-[[(1R)-1-(4-methyl-1,2,4-triazol-3-yl)ethyl]carbamoyl]pyrrolidine-3-carboxylic (3S)-3-methyl-1-[[(1R)-1-(4-meth…

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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) 0.12 6.3 -57.9 1 8 -1 103 280.308 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-ethyl-1-[[(1S)-1-(4-methyl-1,2,4-triazol-3-yl)ethyl]carbamoyl]pyrrolidine-3-carboxylic (3S)-3-ethyl-1-[[(1S)-1-(4-methy…

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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) 0.46 6.78 -50.9 1 8 -1 103 294.335 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-ethyl-1-[[(1S)-1-(4-methyl-1,2,4-triazol-3-yl)ethyl]carbamoyl]pyrrolidine-3-carboxylic (3R)-3-ethyl-1-[[(1S)-1-(4-methy…

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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) 0.46 6.81 -57.8 1 8 -1 103 294.335 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-ethyl-1-[[(1R)-1-(4-methyl-1,2,4-triazol-3-yl)ethyl]carbamoyl]pyrrolidine-3-carboxylic (3S)-3-ethyl-1-[[(1R)-1-(4-methy…

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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) 0.46 6.78 -51.15 1 8 -1 103 294.335 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-ethyl-1-[[(1R)-1-(4-methyl-1,2,4-triazol-3-yl)ethyl]carbamoyl]pyrrolidine-3-carboxylic (3R)-3-ethyl-1-[[(1R)-1-(4-methy…

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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) 0.46 6.81 -57.02 1 8 -1 103 294.335 4 ↓

Analogs

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Popular Name: (2R)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-2-isopropyl-pyrrolidine-1-carboxamide (2R)-N-[(4-ethyl-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) 1.46 7.9 -13.93 1 6 0 63 265.361 4 ↓

Analogs

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Popular Name: (2S)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-2-isopropyl-pyrrolidine-1-carboxamide (2S)-N-[(4-ethyl-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) 1.46 7.85 -14.23 1 6 0 63 265.361 4 ↓

Parameters Provided:

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filter.purchasability = annotated
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Structural Results Found: (before additional filtering)

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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 = 311263 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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