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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: (1S)-1-(2H-tetrazol-5-yl)-N-(thiazol-5-ylmethyl)ethanamine (1S)-1-(2H-tetrazol-5-yl)-N-(thi…

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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) 0.04 -0.73 -38.13 1 6 -1 78 209.258 4 ↓
Mid Mid (pH 6-8) 0.04 0.54 -40.01 2 6 0 82 210.266 4 ↓

Analogs

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Popular Name: (1R)-1-(2H-tetrazol-5-yl)-N-(thiazol-5-ylmethyl)ethanamine (1R)-1-(2H-tetrazol-5-yl)-N-(thi…

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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) 0.04 -0.62 -40.48 1 6 -1 78 209.258 4 ↓
Mid Mid (pH 6-8) 0.04 0.54 -40.06 2 6 0 82 210.266 4 ↓

Analogs

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Popular Name: N-(1H-tetrazol-5-ylmethyl)-1-thiazol-5-yl-methanamine N-(1H-tetrazol-5-ylmethyl)-1-thi…

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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) -0.52 -1.14 -38.4 1 6 -1 78 195.231 4 ↓
Mid Mid (pH 6-8) -0.52 0.22 -41.55 2 6 0 82 196.239 4 ↓

Analogs

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Popular Name: (1S)-N-[(2-tert-butylthiazol-5-yl)methyl]-1-(2H-tetrazol-5-yl)ethanamine (1S)-N-[(2-tert-butylthiazol-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) 1.48 1.86 -38.59 1 6 -1 78 265.366 5 ↓
Mid Mid (pH 6-8) 1.48 3.13 -39.13 2 6 0 82 266.374 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-N-[(2-tert-butylthiazol-5-yl)methyl]-1-(2H-tetrazol-5-yl)ethanamine (1R)-N-[(2-tert-butylthiazol-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) 1.48 1.96 -40.91 1 6 -1 78 265.366 5 ↓
Mid Mid (pH 6-8) 1.48 3.13 -39.17 2 6 0 82 266.374 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(2-tert-butylthiazol-5-yl)-N-(1H-tetrazol-5-ylmethyl)methanamine 1-(2-tert-butylthiazol-5-yl)-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) 0.92 1.45 -38.92 1 6 -1 78 251.339 5 ↓
Mid Mid (pH 6-8) 0.92 2.8 -40.7 2 6 0 82 252.347 5 ↓

Parameters Provided:

ring.id = 154367
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 = 154367 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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