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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: N-[[2-[4-[(1R)-1-methylpropyl]piperazin-1-yl]phenyl]methyl]cyclopropanamine N-[[2-[4-[(1R)-1-methylpropyl]pi…

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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) 3.02 10.71 -91.81 3 3 2 24 289.467 6 ↓
Hi High (pH 8-9.5) 3.02 8.82 -32.98 2 3 1 23 288.459 6 ↓

Analogs

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Popular Name: N-[[2-[4-[(1S)-1-methylpropyl]piperazin-1-yl]phenyl]methyl]cyclopropanamine N-[[2-[4-[(1S)-1-methylpropyl]pi…

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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) 3.02 10.7 -91.71 3 3 2 24 289.467 6 ↓
Hi High (pH 8-9.5) 3.02 8.83 -33.02 2 3 1 23 288.459 6 ↓

Analogs

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Popular Name: N-[[2-(4-isobutylpiperazin-1-yl)phenyl]methyl]cyclopropanamine N-[[2-(4-isobutylpiperazin-1-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) 2.93 11.05 -93.4 3 3 2 24 289.467 6 ↓
Hi High (pH 8-9.5) 2.93 9.09 -33.42 2 3 1 23 288.459 6 ↓

Analogs

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Popular Name: N-[[2-(4-tert-butylpiperazin-1-yl)phenyl]methyl]cyclopropanamine N-[[2-(4-tert-butylpiperazin-1-y…

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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) 2.99 10.33 -90.91 3 3 2 24 289.467 5 ↓
Hi High (pH 8-9.5) 2.99 8.25 -32.97 2 3 1 23 288.459 5 ↓

Analogs

45701757
45701757
36190492
36190492

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Popular Name: N-[[5-fluoro-2-(4-methylpiperazin-1-yl)phenyl]methyl]cyclopropanamine N-[[5-fluoro-2-(4-methylpiperazi…

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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) 1.95 9.02 -98.4 3 3 2 24 265.376 4 ↓
Mid Mid (pH 6-8) 1.95 6.65 -36.25 2 3 1 23 264.368 4 ↓

Analogs

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Popular Name: 1-[4-[2-[(cyclopropylamino)methyl]-4-fluoro-phenyl]piperazin-1-yl]ethanone 1-[4-[2-[(cyclopropylamino)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) 1.31 7.98 -44.14 2 4 1 40 292.378 4 ↓

Analogs

45701746
45701746
45701754
45701754
45701757
45701757

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[5-fluoro-2-(4-propylpiperazin-1-yl)phenyl]methyl]cyclopropanamine N-[[5-fluoro-2-(4-propylpiperazi…

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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) 2.83 10.44 -99.53 3 3 2 24 293.43 6 ↓
Mid Mid (pH 6-8) 2.83 8.2 -36.16 2 3 1 23 292.422 6 ↓

Analogs

45701757
45701757
36190492
36190492

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[2-(4-ethylpiperazin-1-yl)-5-fluoro-phenyl]methyl]cyclopropanamine N-[[2-(4-ethylpiperazin-1-yl)-5-…

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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) 2.32 9.68 -97.89 3 3 2 24 279.403 5 ↓
Mid Mid (pH 6-8) 2.32 7.45 -36.19 2 3 1 23 278.395 5 ↓

Parameters Provided:

ring.id = 392466
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 = 392466 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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