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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: [(1S)-1-(4-chlorophenyl)ethyl] [(1S)-1-(4-chlorophenyl)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) 2.68 6.63 -15.03 0 4 0 60 316.806 5 ↓

Analogs

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Popular Name: [(1R)-1-(4-chlorophenyl)ethyl] [(1R)-1-(4-chlorophenyl)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) 2.68 6.63 -14.94 0 4 0 60 316.806 5 ↓

Analogs

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Popular Name: [(1S)-1-(4-chlorophenyl)ethyl] [(1S)-1-(4-chlorophenyl)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) 2.68 6.62 -14.39 0 4 0 60 316.806 5 ↓

Analogs

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Popular Name: [(1R)-1-(4-chlorophenyl)ethyl] [(1R)-1-(4-chlorophenyl)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) 2.68 6.62 -14.36 0 4 0 60 316.806 5 ↓

Analogs

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Popular Name: [(1S)-1-(4-nitrophenyl)ethyl] [(1S)-1-(4-nitrophenyl)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) 1.96 6.83 -19.07 0 7 0 106 327.358 6 ↓

Analogs

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Popular Name: [(1R)-1-(4-nitrophenyl)ethyl] [(1R)-1-(4-nitrophenyl)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) 1.96 6.82 -18.88 0 7 0 106 327.358 6 ↓

Analogs

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Popular Name: [(1S)-1-(4-nitrophenyl)ethyl] [(1S)-1-(4-nitrophenyl)ethyl]

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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) 1.96 6.82 -18.43 0 7 0 106 327.358 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(1R)-1-(4-nitrophenyl)ethyl] [(1R)-1-(4-nitrophenyl)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) 1.96 6.81 -18.34 0 7 0 106 327.358 6 ↓

Analogs

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Popular Name: [(1R)-1-(p-tolyl)ethyl] [(1R)-1-(p-tolyl)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) 2.45 6.79 -14.9 0 4 0 60 296.388 5 ↓

Analogs

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Popular Name: [(1S)-1-(p-tolyl)ethyl] [(1S)-1-(p-tolyl)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) 2.45 6.79 -15.01 0 4 0 60 296.388 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(1R)-1-(p-tolyl)ethyl] [(1R)-1-(p-tolyl)ethyl]

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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) 2.45 6.77 -14.3 0 4 0 60 296.388 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S)-1-(p-tolyl)ethyl] [(1S)-1-(p-tolyl)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) 2.45 6.78 -14.37 0 4 0 60 296.388 5 ↓

Analogs

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Popular Name: [(1S)-1-[2-(trifluoromethyl)phenyl]ethyl] [(1S)-1-[2-(trifluoromethyl)phen…

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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) 2.85 6.78 -17.46 0 4 0 60 350.358 6 ↓

Analogs

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Popular Name: [(1R)-1-[2-(trifluoromethyl)phenyl]ethyl] [(1R)-1-[2-(trifluoromethyl)phen…

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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) 2.85 6.78 -17.33 0 4 0 60 350.358 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S)-1-[2-(trifluoromethyl)phenyl]ethyl] [(1S)-1-[2-(trifluoromethyl)phen…

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) 2.85 6.77 -16.6 0 4 0 60 350.358 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(1R)-1-[2-(trifluoromethyl)phenyl]ethyl] [(1R)-1-[2-(trifluoromethyl)phen…

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) 2.85 6.77 -16.61 0 4 0 60 350.358 6 ↓

Parameters Provided:

ring.id = 207311
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 = 207311 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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