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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-[(cyclopropylamino)methyl]-N,N,1-trimethyl-imidazol-2-amine 5-[(cyclopropylamino)methyl]-N,N…

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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 7.28 -91.59 3 4 2 39 196.298 4 ↓
Hi High (pH 8-9.5) 0.58 5.98 -24.92 2 4 1 34 195.29 4 ↓
Hi High (pH 8-9.5) 0.58 5.53 -6.86 1 4 0 33 194.282 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-[[[(1S)-2,2-dimethylcyclopropyl]amino]methyl]-N,N,1-trimethyl-imidazol-2-amine 5-[[[(1S)-2,2-dimethylcyclopropy…

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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) 1.14 8.57 -95.18 3 4 2 39 224.352 4 ↓
Mid Mid (pH 6-8) 1.14 8.07 -41.53 2 4 1 38 223.344 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-[[[(1R)-2,2-dimethylcyclopropyl]amino]methyl]-N,N,1-trimethyl-imidazol-2-amine 5-[[[(1R)-2,2-dimethylcyclopropy…

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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) 1.14 8.57 -95.33 3 4 2 39 224.352 4 ↓
Mid Mid (pH 6-8) 1.14 8.07 -41.7 2 4 1 38 223.344 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N,N,1-trimethyl-5-[[[(1S,2R)-2-methylcyclopropyl]amino]methyl]imidazol-2-amine N,N,1-trimethyl-5-[[[(1S,2R)-2-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) 1.19 8.09 -94 3 4 2 39 210.325 4 ↓
Hi High (pH 8-9.5) 1.19 6.7 -24.46 2 4 1 34 209.317 4 ↓
Mid Mid (pH 6-8) 1.19 7.57 -41.41 2 4 1 38 209.317 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N,N,1-trimethyl-5-[[[(1S,2S)-2-methylcyclopropyl]amino]methyl]imidazol-2-amine N,N,1-trimethyl-5-[[[(1S,2S)-2-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) 1.19 7.85 -94.71 3 4 2 39 210.325 4 ↓
Hi High (pH 8-9.5) 1.19 6.52 -24.33 2 4 1 34 209.317 4 ↓
Mid Mid (pH 6-8) 1.19 7.32 -41.96 2 4 1 38 209.317 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N,N,1-trimethyl-5-[[[(1R,2R)-2-methylcyclopropyl]amino]methyl]imidazol-2-amine N,N,1-trimethyl-5-[[[(1R,2R)-2-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) 1.19 7.85 -94.81 3 4 2 39 210.325 4 ↓
Hi High (pH 8-9.5) 1.19 6.52 -24.48 2 4 1 34 209.317 4 ↓
Mid Mid (pH 6-8) 1.19 7.32 -42.07 2 4 1 38 209.317 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N,N,1-trimethyl-5-[[[(1R,2S)-2-methylcyclopropyl]amino]methyl]imidazol-2-amine N,N,1-trimethyl-5-[[[(1R,2S)-2-m…

Find On: PubMed — Wikipedia — Google

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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) 1.19 8.09 -94.12 3 4 2 39 210.325 4 ↓
Hi High (pH 8-9.5) 1.19 6.79 -24.57 2 4 1 34 209.317 4 ↓
Mid Mid (pH 6-8) 1.19 7.57 -41.38 2 4 1 38 209.317 4 ↓

Parameters Provided:

ring.id = 420318
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 = 420318 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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