UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (4-fluorophenyl)sulfonyl-phenethyl-BLAHone (4-fluorophenyl)sulfonyl-pheneth…

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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) 3.70 11.31 -17.35 0 6 0 72 469.563 5 ↓

Analogs

35498359
35498359
4760546
4760546

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Popular Name: phenethyl(p-tolylsulfonyl)BLAHone phenethyl(p-tolylsulfonyl)BLAHone

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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) 3.98 11.78 -17.33 0 6 0 72 465.6 5 ↓

Analogs

35498356
35498356

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Popular Name: benzenesulfonyl(phenethyl)BLAHone benzenesulfonyl(phenethyl)BLAHone

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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) 3.54 11.24 -17.99 0 6 0 72 451.573 5 ↓

Analogs

34854787
34854787

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Popular Name: phenethyl-[3-(trifluoromethyl)phenyl]sulfonyl-BLAHone phenethyl-[3-(trifluoromethyl)ph…

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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) 4.41 12.26 -19.09 0 6 0 72 519.57 6 ↓

Analogs

35498367
35498367

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Popular Name: (4-methoxyphenyl)sulfonyl-phenethyl-BLAHone (4-methoxyphenyl)sulfonyl-phenet…

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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) 3.59 10.41 -17.96 0 7 0 82 481.599 6 ↓

Parameters Provided:

ring.id = 17682
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 = 17682 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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