UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-chloro-5-(isopropylsulfamoyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-benzamide 2-chloro-5-(isopropylsulfamoyl)-…

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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) 3.81 6.14 -22.14 2 7 0 101 436.946 6 ↓
Mid Mid (pH 6-8) 3.88 5.22 -51.93 1 7 -1 107 435.938 6 ↓

Analogs

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Popular Name: 3-methoxy-4-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide 3-methoxy-4-methyl-N-(5-phenyl-1…

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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) 3.90 7.93 -16.86 1 5 0 64 325.393 4 ↓
Hi High (pH 8-9.5) 3.97 6.27 -52.69 0 5 -1 70 324.385 4 ↓

Analogs

25449563
25449563
25449671
25449671
25449733
25449733
39758327
39758327
39759735
39759735

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Popular Name: 3-methanesulfonamido-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide 3-methanesulfonamido-N-(5-phenyl…

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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) 2.67 4.55 -33.28 2 7 0 101 374.447 5 ↓
Hi High (pH 8-9.5) 2.74 3.72 -112.99 0 7 -2 109 372.431 5 ↓
Mid Mid (pH 6-8) 2.67 4.63 -61.25 1 7 -1 103 373.439 5 ↓

Analogs

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Popular Name: N-[5-(o-tolyl)-1,3,4-thiadiazol-2-yl]benzamide N-[5-(o-tolyl)-1,3,4-thiadiazol-…

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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) 3.86 8.75 -15.47 1 4 0 55 295.367 3 ↓

Analogs

4070401
4070401

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Popular Name: 4-tert-butyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide 4-tert-butyl-N-(5-phenyl-1,3,4-t…

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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) 5.17 10.21 -15.3 1 4 0 55 337.448 4 ↓

Analogs

4880663
4880663
7318922
7318922
8790862
8790862
43133
43133
42307
42307

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Popular Name: N,4-dimethyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide N,4-dimethyl-N-(5-phenyl-1,3,4-t…

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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) 4.16 1.5 -17.54 0 4 0 46 309.394 3 ↓

Analogs

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Popular Name: N-[5-(2-chloro-4-fluoro-phenyl)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide N-[5-(2-chloro-4-fluoro-phenyl)-…

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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) 4.17 1.22 -24.72 1 7 0 100 378.772 4 ↓

Analogs

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Popular Name: 2-(difluoromethoxy)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide 2-(difluoromethoxy)-N-(5-phenyl-…

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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) 4.58 8.69 -19.3 1 5 0 64 347.346 5 ↓

Parameters Provided:

ring.id = 45321
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 = 45321 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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