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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: N-[(2S)-2-(3,5-dimethyl-1,2,4-triazol-1-yl)propyl]cyclopropanamine N-[(2S)-2-(3,5-dimethyl-1,2,4-tr…

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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) 0.15 5.81 -44.98 2 4 1 47 195.29 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-(3,5-dimethyl-1,2,4-triazol-1-yl)propyl]cyclopropanamine N-[(2R)-2-(3,5-dimethyl-1,2,4-tr…

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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) 0.15 5.8 -44.72 2 4 1 47 195.29 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-(3,5-dimethyl-1,2,4-triazol-1-yl)-3-methyl-butyl]cyclopropanamine N-[(2R)-2-(3,5-dimethyl-1,2,4-tr…

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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) 0.90 7.37 -41.06 2 4 1 47 223.344 5 ↓
Lo Low (pH 4.5-6) 0.90 7.8 -95.37 3 4 2 49 224.352 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-(3,5-dimethyl-1,2,4-triazol-1-yl)-3-methyl-butyl]cyclopropanamine N-[(2S)-2-(3,5-dimethyl-1,2,4-tr…

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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) 0.90 7.44 -40.86 2 4 1 47 223.344 5 ↓
Lo Low (pH 4.5-6) 0.90 7.87 -95.07 3 4 2 49 224.352 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-(3,5-dimethyl-1,2,4-triazol-1-yl)butyl]cyclopropanamine N-[(2S)-2-(3,5-dimethyl-1,2,4-tr…

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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) 0.65 6.79 -41.17 2 4 1 47 209.317 5 ↓
Lo Low (pH 4.5-6) 0.65 7.23 -94.98 3 4 2 49 210.325 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-(3,5-dimethyl-1,2,4-triazol-1-yl)butyl]cyclopropanamine N-[(2R)-2-(3,5-dimethyl-1,2,4-tr…

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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) 0.65 6.69 -45.77 2 4 1 47 209.317 5 ↓
Lo Low (pH 4.5-6) 0.65 7.11 -92.84 3 4 2 49 210.325 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-(1,2,4-triazol-1-yl)propyl]cyclopropanamine N-[(2S)-2-(1,2,4-triazol-1-yl)pr…

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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) -0.03 5.8 -43.93 2 4 1 47 167.236 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-(1,2,4-triazol-1-yl)propyl]cyclopropanamine N-[(2R)-2-(1,2,4-triazol-1-yl)pr…

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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) -0.03 5.8 -44.18 2 4 1 47 167.236 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-3-methyl-2-(1,2,4-triazol-1-yl)butyl]cyclopropanamine N-[(2S)-3-methyl-2-(1,2,4-triazo…

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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) 0.72 7.16 -43.39 2 4 1 47 195.29 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-3-methyl-2-(1,2,4-triazol-1-yl)butyl]cyclopropanamine N-[(2R)-3-methyl-2-(1,2,4-triazo…

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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) 0.72 7.19 -43.32 2 4 1 47 195.29 5 ↓

Analogs

43990348
43990348
43990353
43990353
43990436
43990436
43990442
43990442
43990446
43990446

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-(1,2,4-triazol-1-yl)butyl]cyclopropanamine N-[(2S)-2-(1,2,4-triazol-1-yl)bu…

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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) 0.48 6.59 -38.12 2 4 1 47 181.263 5 ↓

Analogs

43990348
43990348
43990353
43990353
43990436
43990436
43990442
43990442
43990446
43990446

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-(1,2,4-triazol-1-yl)butyl]cyclopropanamine N-[(2R)-2-(1,2,4-triazol-1-yl)bu…

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) 0.48 6.4 -45.12 2 4 1 47 181.263 5 ↓

Parameters Provided:

ring.id = 260200
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 = 260200 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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