UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

25409319
25409319
25409314
25409314

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Popular Name: N-[(2R)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[(2R)-2-(dimethylamino)-2-(3-m…

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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) 1.62 6.17 -49.56 2 6 1 63 352.48 8 ↓
Mid Mid (pH 6-8) 1.62 3.64 -17.75 1 6 0 62 351.472 8 ↓

Analogs

25409319
25409319
25409314
25409314

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Popular Name: N-[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[(2S)-2-(dimethylamino)-2-(3-m…

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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) 1.62 6.19 -52.28 2 6 1 63 352.48 8 ↓
Mid Mid (pH 6-8) 1.62 3.75 -16.12 1 6 0 62 351.472 8 ↓

Analogs

25377592
25377592
25377597
25377597

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Popular Name: N-[(2R)-2-(2-chlorophenyl)-2-diethylamino-ethyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[(2R)-2-(2-chlorophenyl)-2-die…

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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) 2.96 8.68 -49.44 2 5 1 54 384.953 9 ↓
Mid Mid (pH 6-8) 2.96 7.37 -15.03 1 5 0 53 383.945 9 ↓

Analogs

25377592
25377592
25377597
25377597

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Popular Name: N-[(2S)-2-(2-chlorophenyl)-2-diethylamino-ethyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[(2S)-2-(2-chlorophenyl)-2-die…

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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) 2.96 8.2 -49.41 2 5 1 54 384.953 9 ↓
Mid Mid (pH 6-8) 2.96 7.49 -15.61 1 5 0 53 383.945 9 ↓

Analogs

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Popular Name: N-[2-(4-hydroxyphenyl)ethyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[2-(4-hydroxyphenyl)ethyl]-3-(…

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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) 1.30 2.92 -19.02 2 5 0 70 294.376 6 ↓

Analogs

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Popular Name: N-[2-(2-chlorophenyl)ethyl]-3-(2-oxothiazolidin-3-yl)propanamide N-[2-(2-chlorophenyl)ethyl]-3-(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) 2.40 6.18 -17.62 1 4 0 49 312.822 6 ↓

Parameters Provided:

ring.id = 24365
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 = 24365 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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