UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

4840050
4840050
27587374
27587374

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Popular Name: 2-(5-chloro-6-methyl-benzofuran-3-yl)-N-(2-morpholinoethyl)acetamide 2-(5-chloro-6-methyl-benzofuran-…

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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) 2.38 4.22 -13.31 1 5 0 55 336.819 5 ↓
Mid Mid (pH 6-8) 2.38 6.5 -48.28 2 5 1 56 337.827 5 ↓

Analogs

22708938
22708938
27232853
27232853

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Popular Name: 2-(5-chloro-4,6-dimethyl-benzofuran-3-yl)-N-(2-morpholinoethyl)acetamide 2-(5-chloro-4,6-dimethyl-benzofu…

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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) 2.76 4.51 -13.48 1 5 0 55 350.846 5 ↓
Mid Mid (pH 6-8) 2.76 6.78 -49.19 2 5 1 56 351.854 5 ↓

Analogs

27587459
27587459

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Popular Name: 2-(5-methylbenzofuran-3-yl)-N-(2-morpholinoethyl)acetamide 2-(5-methylbenzofuran-3-yl)-N-(2…

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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) 1.78 3.8 -14.13 1 5 0 55 302.374 5 ↓
Mid Mid (pH 6-8) 1.78 6.08 -49.29 2 5 1 56 303.382 5 ↓

Analogs

41870035
41870035

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Popular Name: 2-(6-methoxybenzofuran-3-yl)-N-[(2S)-3-methyl-2-morpholino-butyl]acetamide 2-(6-methoxybenzofuran-3-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) 2.49 4.21 -13.51 1 6 0 64 360.454 7 ↓
Mid Mid (pH 6-8) 2.49 7.77 -50.38 2 6 1 65 361.462 7 ↓

Analogs

41870033
41870033

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Popular Name: 2-(6-methoxybenzofuran-3-yl)-N-[(2R)-3-methyl-2-morpholino-butyl]acetamide 2-(6-methoxybenzofuran-3-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) 2.49 4.23 -13.42 1 6 0 64 360.454 7 ↓
Mid Mid (pH 6-8) 2.49 7.19 -48.68 2 6 1 65 361.462 7 ↓

Parameters Provided:

ring.id = 2921
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 = 2921 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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