UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

25799243
25799243
25799249
25799249

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Popular Name: (2-indan-5-yl-1-methyl-2-oxo-ethyl) (2-indan-5-yl-1-methyl-2-oxo-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) 3.92 11.46 -14.28 2 6 0 85 408.498 8 ↓

Analogs

25799243
25799243
25799249
25799249

Draw Identity 99% 90% 80% 70%

Popular Name: (2-indan-5-yl-1-methyl-2-oxo-ethyl) (2-indan-5-yl-1-methyl-2-oxo-ethyl)

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) 3.92 11.5 -14.04 2 6 0 85 408.498 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2-indan-5-yl-2-oxo-ethyl) (2-indan-5-yl-2-oxo-ethyl)

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) 3.65 3.39 -11.35 0 6 0 89 339.347 6 ↓

Analogs

5779353
5779353

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Popular Name: (2-indan-5-yl-1-methyl-2-oxo-ethyl) (2-indan-5-yl-1-methyl-2-oxo-ethyl)

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) 4.01 3.72 -10.93 0 6 0 89 353.374 6 ↓

Analogs

5779351
5779351

Draw Identity 99% 90% 80% 70%

Popular Name: (2-indan-5-yl-1-methyl-2-oxo-ethyl) (2-indan-5-yl-1-methyl-2-oxo-ethyl)

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) 4.01 3.73 -11.01 0 6 0 89 353.374 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2-indan-5-yl-2-oxo-ethyl) (2-indan-5-yl-2-oxo-ethyl)

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) 4.24 2.78 -8.06 0 3 0 43 377.209 5 ↓

Analogs

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Popular Name: [(1R)-2-indan-5-yl-1-methyl-2-oxo-ethyl] [(1R)-2-indan-5-yl-1-methyl-2-ox…

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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) 4.68 12.49 -12.45 0 4 0 53 360.356 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S)-2-indan-5-yl-1-methyl-2-oxo-ethyl] [(1S)-2-indan-5-yl-1-methyl-2-ox…

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) 4.68 12.45 -12.49 0 4 0 53 360.356 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(1R)-2-indan-5-yl-1-methyl-2-oxo-ethyl] [(1R)-2-indan-5-yl-1-methyl-2-ox…

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) 2.86 8.95 -14.26 2 5 0 86 337.375 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S)-2-indan-5-yl-1-methyl-2-oxo-ethyl] [(1S)-2-indan-5-yl-1-methyl-2-ox…

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) 2.86 8.91 -14.33 2 5 0 86 337.375 6 ↓

Parameters Provided:

ring.id = 1761
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 = 1761 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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