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Popular Name: benzenemethanamine, N-(3-methylphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(3-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) 5.31 10.84 -7.77 1 3 0 30 333.431 8 ↓

Analogs

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Popular Name: benzenemethanamine, 2-(2-phenoxyethoxy)-N-phenyl- benzenemethanamine, 2-(2-phenoxy…

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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) 4.88 10.18 -7.61 1 3 0 30 319.404 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-(2-chlorophenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(2-chlorop…

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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) 5.51 10.76 -7.48 1 3 0 30 353.849 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-(4-chlorophenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(4-chlorop…

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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) 5.56 10.69 -7.12 1 3 0 30 353.849 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-(3,4-dimethylphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(3,4-dimet…

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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) 5.71 11.4 -7.99 1 3 0 30 347.458 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-(2,4-dimethylphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(2,4-dimet…

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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) 5.71 11.63 -7.87 1 3 0 30 347.458 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-(4-fluorophenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(4-fluorop…

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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) 5.05 10.24 -7.82 1 3 0 30 337.394 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-(4-methoxyphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(4-methoxy…

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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) 4.94 9.46 -8.91 1 4 0 40 349.43 9 ↓

Analogs

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Popular Name: benzenemethanamine, 2-(2-phenoxyethoxy)-N-(2,4,6-trimethylphenyl)- benzenemethanamine, 2-(2-phenoxy…

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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) 5.15 12.07 -7.88 1 3 0 30 361.485 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-(3,5-dimethylphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(3,5-dimet…

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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) 5.71 11.5 -7.94 1 3 0 30 347.458 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-(2,5-dimethylphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(2,5-dimet…

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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) 5.71 11.63 -7.96 1 3 0 30 347.458 8 ↓

Analogs

32204246
32204246

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Popular Name: benzenemethanamine, N-(3-chloro-2-methylphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(3-chloro-…

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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) 5.91 11.4 -7.24 1 3 0 30 367.876 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-(4-methylphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(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) 5.33 10.86 -7.68 1 3 0 30 333.431 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-(3-methoxyphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(3-methoxy…

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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) 4.92 9.48 -8.97 1 4 0 40 349.43 9 ↓

Analogs

32204258
32204258

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Popular Name: benzenemethanamine, N-(3-chloro-4-methylphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(3-chloro-…

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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) 5.94 11.28 -7.91 1 3 0 30 367.876 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-(2,3-dimethylphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(2,3-dimet…

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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) 5.68 11.52 -8.07 1 3 0 30 347.458 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-(2-methoxyphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(2-methoxy…

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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) 4.89 9.59 -8.91 1 4 0 40 349.43 9 ↓

Analogs

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Popular Name: benzenemethanamine, N-(2-ethoxyphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(2-ethoxyp…

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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) 5.27 10.52 -8.76 1 4 0 40 363.457 10 ↓

Analogs

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Popular Name: benzenemethanamine, N-(2-fluorophenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(2-fluorop…

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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) 5.00 10.27 -8.21 1 3 0 30 337.394 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-(2,6-dimethylphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(2,6-dimet…

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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) 4.75 11.43 -7.84 1 3 0 30 347.458 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-(2-ethyl-6-methylphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(2-ethyl-6…

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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) 5.21 12.64 -5.99 1 3 0 30 361.485 9 ↓

Analogs

32204250
32204250

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Popular Name: benzenemethanamine, N-(5-chloro-2-methylphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(5-chloro-…

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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) 5.94 11.48 -7.84 1 3 0 30 367.876 8 ↓

Analogs

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Popular Name: benzenemethanamine, N-[2-(1-methylethyl)phenyl]-2-(2-phenoxyethoxy)- benzenemethanamine, N-[2-(1-meth…

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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) 5.88 12.23 -7.48 1 3 0 30 361.485 9 ↓

Analogs

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Popular Name: benzenemethanamine, N-(3-ethoxyphenyl)-2-(2-phenoxyethoxy)- benzenemethanamine, N-(3-ethoxyp…

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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) 5.29 10.4 -8.8 1 4 0 40 363.457 10 ↓

Parameters Provided:

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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 = 481417 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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