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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: 1-methyl-N-[(1S)-1-(1-methylimidazol-2-yl)ethyl]pyrazol-4-amine 1-methyl-N-[(1S)-1-(1-methylimid…

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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) 0.29 4.49 -33.07 2 5 1 49 206.273 3 ↓
Hi High (pH 8-9.5) 0.29 3.93 -9.55 1 5 0 48 205.265 3 ↓

Analogs

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Popular Name: 1-methyl-N-[(1R)-1-(1-methylimidazol-2-yl)ethyl]pyrazol-4-amine 1-methyl-N-[(1R)-1-(1-methylimid…

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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) 0.29 4.52 -33.07 2 5 1 49 206.273 3 ↓
Hi High (pH 8-9.5) 0.29 3.93 -9.56 1 5 0 48 205.265 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-1-(1-methylimidazol-2-yl)ethyl]-1H-pyrazol-4-amine N-[(1S)-1-(1-methylimidazol-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) 0.22 3.18 -32.64 3 5 1 60 192.246 3 ↓
Hi High (pH 8-9.5) 0.22 2.62 -8.68 2 5 0 59 191.238 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-1-(1-methylimidazol-2-yl)ethyl]-1H-pyrazol-4-amine N-[(1R)-1-(1-methylimidazol-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) 0.22 3.21 -32.69 3 5 1 60 192.246 3 ↓
Hi High (pH 8-9.5) 0.22 2.61 -8.72 2 5 0 59 191.238 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-ethyl-N-[(1S)-1-(1-methylimidazol-2-yl)ethyl]pyrazol-4-amine 1-ethyl-N-[(1S)-1-(1-methylimida…

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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) 0.67 5.36 -32.75 2 5 1 49 220.3 4 ↓
Hi High (pH 8-9.5) 0.67 4.8 -9.27 1 5 0 48 219.292 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-ethyl-N-[(1R)-1-(1-methylimidazol-2-yl)ethyl]pyrazol-4-amine 1-ethyl-N-[(1R)-1-(1-methylimida…

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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) 0.67 5.39 -32.8 2 5 1 49 220.3 4 ↓
Hi High (pH 8-9.5) 0.67 4.8 -9.3 1 5 0 48 219.292 4 ↓

Analogs

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Popular Name: 3,5-dimethyl-N-[(1S)-1-(1-methylimidazol-2-yl)ethyl]-1H-pyrazol-4-amine 3,5-dimethyl-N-[(1S)-1-(1-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) 0.67 4.41 -30.7 3 5 1 60 220.3 3 ↓
Hi High (pH 8-9.5) 0.67 4.01 -9.57 2 5 0 59 219.292 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-dimethyl-N-[(1R)-1-(1-methylimidazol-2-yl)ethyl]-1H-pyrazol-4-amine 3,5-dimethyl-N-[(1R)-1-(1-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) 0.67 4.03 -33.29 3 5 1 60 220.3 3 ↓
Hi High (pH 8-9.5) 0.67 3.44 -9.09 2 5 0 59 219.292 3 ↓

Parameters Provided:

ring.id = 518794
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 = 518794 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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