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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-[[2-(5-chloro-2-fluoro-phenyl)thiazol-5-yl]methyl]cyclopropanamine N-[[2-(5-chloro-2-fluoro-phenyl)…

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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) 3.72 7.83 -41.23 2 2 1 29 283.779 4 ↓
Hi High (pH 8-9.5) 3.72 6.54 -5.89 1 2 0 25 282.771 4 ↓

Analogs

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Popular Name: N-[[2-(2-chloro-6-fluoro-phenyl)thiazol-5-yl]methyl]cyclopropanamine N-[[2-(2-chloro-6-fluoro-phenyl)…

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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) 3.70 7.6 -40.3 2 2 1 29 283.779 4 ↓
Hi High (pH 8-9.5) 3.70 6.3 -8.24 1 2 0 25 282.771 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[2-(2-chloro-6-fluoro-phenyl)-4-methyl-thiazol-5-yl]methyl]cyclopropanamine N-[[2-(2-chloro-6-fluoro-phenyl)…

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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) 3.92 8.42 -39.84 2 2 1 29 297.806 4 ↓
Hi High (pH 8-9.5) 3.92 7.12 -7.85 1 2 0 25 296.798 4 ↓

Analogs

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Popular Name: N-[[2-(4-propoxyphenyl)thiazol-5-yl]methyl]cyclopropanamine N-[[2-(4-propoxyphenyl)thiazol-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) 3.89 8.13 -39.88 2 3 1 39 289.424 7 ↓
Hi High (pH 8-9.5) 3.89 6.83 -4.99 1 3 0 34 288.416 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[2-(3-propoxyphenyl)thiazol-5-yl]methyl]cyclopropanamine N-[[2-(3-propoxyphenyl)thiazol-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) 3.86 8.12 -41.57 2 3 1 39 289.424 7 ↓
Hi High (pH 8-9.5) 3.86 6.83 -6.63 1 3 0 34 288.416 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[2-(3-chloro-2-fluoro-phenyl)thiazol-5-yl]methyl]cyclopropanamine N-[[2-(3-chloro-2-fluoro-phenyl)…

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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) 3.70 7.57 -40.17 2 2 1 29 283.779 4 ↓
Hi High (pH 8-9.5) 3.70 6.28 -6.69 1 2 0 25 282.771 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[2-(3-chloro-2-fluoro-phenyl)-4-methyl-thiazol-5-yl]methyl]cyclopropanamine N-[[2-(3-chloro-2-fluoro-phenyl)…

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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) 3.92 8.31 -44.55 2 2 1 29 297.806 4 ↓
Hi High (pH 8-9.5) 3.92 7.01 -8.63 1 2 0 25 296.798 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

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

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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) 3.72 7.59 -39.34 2 2 1 29 283.779 4 ↓
Hi High (pH 8-9.5) 3.72 6.3 -4.57 1 2 0 25 282.771 4 ↓

Analogs

43389049
43389049

Draw Identity 99% 90% 80% 70%

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

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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) 3.94 8.33 -42.71 2 2 1 29 297.806 4 ↓
Hi High (pH 8-9.5) 3.94 7.03 -6.17 1 2 0 25 296.798 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[2-(3-chloro-4-fluoro-phenyl)thiazol-5-yl]methyl]cyclopropanamine N-[[2-(3-chloro-4-fluoro-phenyl)…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 3.72 7.66 -41.45 2 2 1 29 283.779 4 ↓
Hi High (pH 8-9.5) 3.72 6.36 -4.18 1 2 0 25 282.771 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[2-(3-chloro-4-fluoro-phenyl)-4-methyl-thiazol-5-yl]methyl]cyclopropanamine N-[[2-(3-chloro-4-fluoro-phenyl)…

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) 3.94 8.16 -42.9 2 2 1 29 297.806 4 ↓
Hi High (pH 8-9.5) 3.94 6.86 -5.04 1 2 0 25 296.798 4 ↓

Parameters Provided:

ring.id = 28858
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 = 28858 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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