UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

4500748
4500748

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Popular Name: [2-(2-thienyl)oxazol-4-yl]methyl [2-(2-thienyl)oxazol-4-yl]methyl

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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) 3.91 0.61 -14.73 0 7 0 98 344.348 6 ↓

Analogs

4580371
4580371

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Popular Name: [2-(2-thienyl)oxazol-4-yl]methyl [2-(2-thienyl)oxazol-4-yl]methyl

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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) 4.90 1.55 -9.21 0 5 0 61 369.32 7 ↓

Analogs

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Popular Name: [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl [5-methyl-2-(2-thienyl)oxazol-4-…

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Activity (Go SEA)

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) 4.22 -3.6 -15.5 0 7 0 89 434.539 9 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl [5-methyl-2-(2-thienyl)oxazol-4-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 0.33 -11.46 0 4 0 52 313.378 5 ↓

Analogs

11564984
11564984

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Popular Name: [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl [5-methyl-2-(2-thienyl)oxazol-4-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 3.87 0.85 -15.59 0 7 0 80 389.429 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl [5-methyl-2-(2-thienyl)oxazol-4-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 3.51 3.57 -13.92 2 6 0 85 358.419 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl [5-methyl-2-(2-thienyl)oxazol-4-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 4.14 6.11 -10.7 1 5 0 64 328.393 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl [5-methyl-2-(2-thienyl)oxazol-4-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 4.43 5.63 -11.26 2 5 0 78 348.811 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl [5-methyl-2-(2-thienyl)oxazol-4-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 5.94 -11.19 2 5 0 78 328.393 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl [5-methyl-2-(2-thienyl)oxazol-4-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 3.91 5.18 -10.21 2 5 0 78 332.356 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl [5-methyl-2-(2-thienyl)oxazol-4-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 4.39 5.06 -19.66 1 8 0 108 464.565 9 ↓

Parameters Provided:

ring.id = 2483
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 = 2483 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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