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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

47145782
47145782
59763565
59763565
59763569
59763569
59763576
59763576
59763580
59763580

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Popular Name: ethyl ethyl

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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) 3.89 9.05 -12.28 1 8 0 106 496.566 6 ↓
Ref Reference (pH 7) 3.89 9.41 -15.23 1 8 0 106 496.566 6 ↓

Analogs

47145371
47145371
47145535
47145535
47146774
47146774

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Popular Name: 6-(4-bromophenyl)-8-phenyl-3,4a,7a,8-tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3-d][1,3]thiazole-2,5,7(6H)-trione 6-(4-bromophenyl)-8-phenyl-3,4a,…

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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 8.94 -13.05 1 5 0 70 473.373 2 ↓
Ref Reference (pH 7) 4.10 8.76 -7.97 1 5 0 70 473.373 2 ↓

Analogs

11990656
11990656

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Popular Name: BRD-A62160418-001-01-8 BRD-A62160418-001-01-8

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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 10.4 -10.02 1 5 0 70 499.411 3 ↓
Ref Reference (pH 7) 4.86 10.48 -13.6 1 5 0 70 499.411 3 ↓
Mid Mid (pH 6-8) 5.31 8.45 -48.03 0 5 -1 73 498.403 3 ↓

Analogs

11990654
11990654

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Popular Name: BRD-A62160418-001-01-8 BRD-A62160418-001-01-8

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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 10.52 -10.53 1 5 0 70 499.411 3 ↓
Ref Reference (pH 7) 4.86 10.52 -11.85 1 5 0 70 499.411 3 ↓
Mid Mid (pH 6-8) 5.31 8.47 -46.06 0 5 -1 73 498.403 3 ↓

Analogs

11990659
11990659

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Popular Name: 6-(4-chlorophenyl)-8-(2-phenylvinyl)-3,4a,7a,8-tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3-d][1,3]thiazole-2,5,7(6H)-trione 6-(4-chlorophenyl)-8-(2-phenylvi…

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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) 4.72 10.29 -10.08 1 5 0 70 454.96 3 ↓
Ref Reference (pH 7) 4.72 10.37 -13.53 1 5 0 70 454.96 3 ↓
Mid Mid (pH 6-8) 5.18 8.35 -48.02 0 5 -1 73 453.952 3 ↓

Analogs

11990657
11990657

Draw Identity 99% 90% 80% 70%

Popular Name: 6-(4-chlorophenyl)-8-(2-phenylvinyl)-3,4a,7a,8-tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3-d][1,3]thiazole-2,5,7(6H)-trione 6-(4-chlorophenyl)-8-(2-phenylvi…

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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) 4.72 10.42 -10.54 1 5 0 70 454.96 3 ↓
Ref Reference (pH 7) 4.72 10.42 -11.86 1 5 0 70 454.96 3 ↓
Mid Mid (pH 6-8) 5.18 8.37 -46.1 0 5 -1 73 453.952 3 ↓

Analogs

13776904
13776904
39884073
39884073
39884074
39884074
39884078
39884078
39884079
39884079

Draw Identity 99% 90% 80% 70%

Popular Name: 8-(4-methoxyphenyl)-6-(4-methylphenyl)-3,4a,7a,8-tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3-d][1,3]thiazole-2,5,7(6H)-trione 8-(4-methoxyphenyl)-6-(4-methylp…

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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) 3.80 8.5 -12.82 1 6 0 79 438.53 3 ↓
Ref Reference (pH 7) 3.80 8.14 -10.15 1 6 0 79 438.53 3 ↓

Parameters Provided:

ring.id = 66068
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 = 66068 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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