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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: 2-methyl-N-[[1-(1-naphthyl)tetrazol-5-yl]methyl]propan-1-amine 2-methyl-N-[[1-(1-naphthyl)tetra…

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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) 2.75 8.34 -47.59 2 5 1 60 282.371 5 ↓
Hi High (pH 8-9.5) 2.75 7.27 -9.74 1 5 0 56 281.363 5 ↓

Analogs

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Popular Name: 2-methoxy-N-[[1-(1-naphthyl)tetrazol-5-yl]methyl]ethanamine 2-methoxy-N-[[1-(1-naphthyl)tetr…

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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) 1.61 6.03 -48.37 2 6 1 69 284.343 6 ↓
Mid Mid (pH 6-8) 1.61 4.98 -11.72 1 6 0 65 283.335 6 ↓

Analogs

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Popular Name: {[1-(1-naphthyl)-1H-tetrazol-5-yl]methyl}amine hydrocloride {[1-(1-naphthyl)-1H-tetrazol-5-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) 1.25 4.17 -53.56 3 5 1 71 226.263 2 ↓
Hi High (pH 8-9.5) 1.25 3.91 -11.02 2 5 0 70 225.255 2 ↓

Analogs

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Popular Name: N-methyl-1-[1-(1-naphthyl)tetrazol-5-yl]methanamine N-methyl-1-[1-(1-naphthyl)tetraz…

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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) 1.63 6.03 -47.96 2 5 1 60 240.29 3 ↓
Hi High (pH 8-9.5) 1.63 4.91 -10.19 1 5 0 56 239.282 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[1-(1-naphthyl)tetrazol-5-yl]methyl]ethanamine N-[[1-(1-naphthyl)tetrazol-5-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) 2.00 6.89 -47.05 2 5 1 60 254.317 4 ↓
Hi High (pH 8-9.5) 2.00 5.82 -9.99 1 5 0 56 253.309 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[1-(1-naphthyl)tetrazol-5-yl]methyl]propan-1-amine N-[[1-(1-naphthyl)tetrazol-5-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) 2.51 7.64 -47.7 2 5 1 60 268.344 5 ↓
Hi High (pH 8-9.5) 2.51 6.59 -9.79 1 5 0 56 267.336 5 ↓

Analogs

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Popular Name: N-[[1-(1-naphthyl)tetrazol-5-yl]methyl]propan-2-amine N-[[1-(1-naphthyl)tetrazol-5-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) 2.30 7.41 -44.81 2 5 1 60 268.344 4 ↓
Hi High (pH 8-9.5) 2.30 6.52 -9.87 1 5 0 56 267.336 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methyl-N-[[1-(1-naphthyl)tetrazol-5-yl]methyl]propan-2-amine 2-methyl-N-[[1-(1-naphthyl)tetra…

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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) 2.81 7.83 -42.08 2 5 1 60 282.371 4 ↓
Hi High (pH 8-9.5) 2.81 6.91 -9.67 1 5 0 56 281.363 4 ↓

Parameters Provided:

ring.id = 109429
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 = 109429 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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