UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

16692470
16692470
16692473
16692473
16692507
16692507
16692524
16692524
6703328
6703328

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Popular Name: 3-chloro-4-ethoxy-N-ethyl-N-(morpholinocarbonylmethyl)benzenesulfonamide 3-chloro-4-ethoxy-N-ethyl-N-(mor…

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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) 1.86 -4.48 -13.32 0 7 0 76 390.889 7 ↓

Analogs

24959173
24959173
24959180
24959180

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Popular Name: N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-oxo-ethyl]-N-methyl-benzenesulfonamide N-[2-[(2S,6S)-2,6-dimethylmorpho…

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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) 1.17 4.36 -12.04 0 6 0 67 326.418 4 ↓

Analogs

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Popular Name: N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-oxo-ethyl]-3-(trifluoromethyl)benzenesulfonamide N-[2-[(2S,6R)-2,6-dimethylmorpho…

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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) 1.80 3.19 -16.57 1 6 0 76 380.388 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-oxo-ethyl]-3-(trifluoromethyl)benzenesulfonamide N-[2-[(2S,6S)-2,6-dimethylmorpho…

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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) 1.80 3.36 -16.22 1 6 0 76 380.388 5 ↓

Analogs

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Popular Name: N-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-oxo-ethyl]-3-(trifluoromethyl)benzenesulfonamide N-[2-[(2R,6R)-2,6-dimethylmorpho…

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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) 1.80 3.35 -16.57 1 6 0 76 380.388 5 ↓

Analogs

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Popular Name: 4-acetyl-N-[(1R)-2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-1-methyl-2-oxo-ethyl]benzenesulfonamide 4-acetyl-N-[(1R)-2-[(2S,6S)-2,6-…

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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) 1.16 3.23 -16.18 1 7 0 93 368.455 5 ↓

Parameters Provided:

ring.id = 4340
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 = 4340 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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