UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

13145140
13145140
33726219
33726219
36631028
36631028
39716980
39716980
39717053
39717053

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Popular Name: (NZ)-N-(3-ethyl-4-methoxy-1,3-benzothiazol-2-ylidene)-2-phenyl-acetamide (NZ)-N-(3-ethyl-4-methoxy-1,3-be…

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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) 4.86 0.65 -11.28 0 4 0 44 326.421 4 ↓

Analogs

13145141
13145141
10096326
10096326
10697581
10697581
10701356
10701356

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Popular Name: (NZ)-N-(4-ethoxy-3-ethyl-1,3-benzothiazol-2-ylidene)-2-phenyl-acetamide (NZ)-N-(4-ethoxy-3-ethyl-1,3-ben…

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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) 5.23 0.67 -10.89 0 4 0 44 340.448 5 ↓

Analogs

39721250
39721250
39721327
39721327
39721613
39721613
39723347
39723347
39723348
39723348

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Popular Name: (NZ)-N-(4-chloro-3-methyl-1,3-benzothiazol-2-ylidene)-2-phenyl-acetamide (NZ)-N-(4-chloro-3-methyl-1,3-be…

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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) 5.10 -0.61 -9.88 0 3 0 34 316.813 2 ↓

Analogs

8974880
8974880

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Popular Name: (NZ)-N-(3-methyl-1,3-benzothiazol-2-ylidene)-2-(3,4,5-trimethoxyphenyl)acetamide (NZ)-N-(3-methyl-1,3-benzothiazo…

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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) 4.10 7.85 -15.51 0 6 0 62 372.446 5 ↓

Parameters Provided:

ring.id = 81632
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 = 81632 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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