UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-[[4-(dimethylamino)-3-fluoro-phenyl]methyl]-N'-thiazol-2-yl-oxamide N-[[4-(dimethylamino)-3-fluoro-p…

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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) 0.87 4.34 -11.6 2 6 0 74 322.365 5 ↓

Analogs

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Popular Name: N-[(3-methoxy-4-methylsulfanyl-phenyl)methyl]-N-methyl-N'-thiazol-2-yl-oxamide N-[(3-methoxy-4-methylsulfanyl-p…

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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) 1.34 5.94 -13.73 1 6 0 72 351.453 6 ↓

Analogs

4796767
4796767

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Popular Name: N-[(4-ethylphenyl)methyl]-N-(2-methoxyethyl)-N'-(4-methylthiazol-2-yl)oxamide N-[(4-ethylphenyl)methyl]-N-(2-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) 2.04 8.56 -9.53 1 6 0 72 361.467 8 ↓

Analogs

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Popular Name: N-allyl-N'-(4-methylthiazol-2-yl)-N-(o-tolylmethyl)oxamide N-allyl-N'-(4-methylthiazol-2-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) 2.19 8.37 -7.83 1 5 0 62 329.425 6 ↓

Analogs

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Popular Name: N-[(4-bromo-2-chloro-phenyl)methyl]-N'-thiazol-2-yl-oxamide N-[(4-bromo-2-chloro-phenyl)meth…

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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) 2.09 4.5 -10.32 2 5 0 71 374.647 4 ↓
Mid Mid (pH 6-8) 2.28 3.92 -44.78 1 5 -1 77 373.639 4 ↓

Analogs

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Popular Name: N-[(2-fluorophenyl)methyl]-N'-thiazol-2-yl-oxamide N-[(2-fluorophenyl)methyl]-N'-th…

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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) 0.79 3.45 -11.37 2 5 0 71 279.296 4 ↓
Mid Mid (pH 6-8) 0.98 2.87 -48.25 1 5 -1 77 278.288 4 ↓

Parameters Provided:

ring.id = 144382
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 = 144382 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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