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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-methyl-N-(2-thienylmethyl)azetidin-3-amine N-methyl-N-(2-thienylmethyl)azet…

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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) 1.27 2.45 -38.84 2 2 1 20 183.3 3 ↓
Mid Mid (pH 6-8) 1.27 0.77 -2.25 1 2 0 15 182.292 3 ↓

Analogs

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Popular Name: N-methyl-N-[(1S)-1-(2-thienyl)ethyl]azetidin-3-amine N-methyl-N-[(1S)-1-(2-thienyl)et…

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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) 1.83 2.77 -37.24 2 2 1 20 197.327 3 ↓
Mid Mid (pH 6-8) 1.83 1.09 -2.8 1 2 0 15 196.319 3 ↓
Lo Low (pH 4.5-6) 1.83 4.78 -113.14 3 2 2 21 198.335 3 ↓

Analogs

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Popular Name: N-methyl-N-[(1R)-1-(2-thienyl)ethyl]azetidin-3-amine N-methyl-N-[(1R)-1-(2-thienyl)et…

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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) 1.83 2.69 -40.01 2 2 1 20 197.327 3 ↓
Mid Mid (pH 6-8) 1.83 1.01 -2.25 1 2 0 15 196.319 3 ↓
Lo Low (pH 4.5-6) 1.83 4.7 -104.58 3 2 2 21 198.335 3 ↓

Analogs

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Popular Name: N-[(5-chloro-2-thienyl)methyl]-N-methyl-azetidin-3-amine N-[(5-chloro-2-thienyl)methyl]-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) 2.08 3.08 -41.83 2 2 1 20 217.745 3 ↓
Mid Mid (pH 6-8) 2.08 1.42 -2.03 1 2 0 15 216.737 3 ↓

Analogs

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Popular Name: N-[(4-bromo-2-thienyl)methyl]-N-methyl-azetidin-3-amine N-[(4-bromo-2-thienyl)methyl]-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) 2.01 3.08 -40.1 2 2 1 20 262.196 3 ↓
Mid Mid (pH 6-8) 2.01 1.39 -2.65 1 2 0 15 261.188 3 ↓

Analogs

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Popular Name: N-isopropyl-N-(2-thienylmethyl)azetidin-3-amine N-isopropyl-N-(2-thienylmethyl)a…

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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 3.51 -41.19 2 2 1 20 211.354 4 ↓
Mid Mid (pH 6-8) 1.95 1.84 -2.01 1 2 0 15 210.346 4 ↓
Lo Low (pH 4.5-6) 1.95 5.47 -113.47 3 2 2 21 212.362 4 ↓

Analogs

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Popular Name: N-ethyl-N-(2-thienylmethyl)azetidin-3-amine N-ethyl-N-(2-thienylmethyl)azeti…

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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) 1.65 2.96 -39.14 2 2 1 20 197.327 4 ↓
Mid Mid (pH 6-8) 1.65 1.29 -2.06 1 2 0 15 196.319 4 ↓
Lo Low (pH 4.5-6) 1.65 5.11 -105.78 3 2 2 21 198.335 4 ↓

Parameters Provided:

ring.id = 370971
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 = 370971 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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