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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: 7-(7,8-dimethoxy-2,2,3-trimethyl-1H-3-benzazepine-4-carbonyl)-4H-1,4-benzoxazin-3-one 7-(7,8-dimethoxy-2,2,3-trimethyl…

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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) 3.22 7.82 -13.08 1 7 0 77 422.481 4 ↓

Analogs

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Popular Name: (7,8-dimethoxy-2,2,3-trimethyl-1H-3-benzazepin-4-yl)-(1,2-dimethylindol-3-yl)methanone (7,8-dimethoxy-2,2,3-trimethyl-1…

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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) 4.63 13.11 -13.61 0 5 0 44 418.537 4 ↓

Analogs

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Popular Name: (4-chlorophenyl)-(7,8-dimethoxy-3-methyl-1,2-dihydro-3-benzazepin-4-yl)methanone (4-chlorophenyl)-(7,8-dimethoxy-…

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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) 4.06 10.79 -9.41 0 4 0 39 357.837 4 ↓

Analogs

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Popular Name: (4-bromophenyl)-(7,8-dimethoxy-3-methyl-1,2-dihydro-3-benzazepin-4-yl)methanone (4-bromophenyl)-(7,8-dimethoxy-3…

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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) 4.19 10.89 -9.34 0 4 0 39 402.288 4 ↓

Analogs

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Popular Name: (4-bromophenyl)-(7,8-dimethoxy-2,2,3-trimethyl-1H-3-benzazepin-4-yl)methanone (4-bromophenyl)-(7,8-dimethoxy-2…

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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 11.2 -9.36 0 4 0 39 430.342 4 ↓

Analogs

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Popular Name: (3,4-dimethoxyphenyl)-(7,8-dimethoxy-2,2,3-trimethyl-1H-3-benzazepin-4-yl)methanone (3,4-dimethoxyphenyl)-(7,8-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) 3.84 9.81 -12.27 0 6 0 57 411.498 6 ↓

Analogs

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Popular Name: (2,4-dichlorophenyl)-(7,8-dimethoxy-2,2,3-trimethyl-1H-3-benzazepin-4-yl)methanone (2,4-dichlorophenyl)-(7,8-dimeth…

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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) 5.48 11.85 -9.22 0 4 0 39 420.336 4 ↓

Analogs

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Popular Name: (7,8-dimethoxy-3-methyl-1,2-dihydro-3-benzazepin-4-yl)-(4-fluorophenyl)methanone (7,8-dimethoxy-3-methyl-1,2-dihy…

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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) 3.55 10.34 -9.66 0 4 0 39 341.382 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (7,8-dimethoxy-2,2,3-trimethyl-1H-3-benzazepin-4-yl)-(4-fluorophenyl)methanone (7,8-dimethoxy-2,2,3-trimethyl-1…

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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) 4.36 10.65 -9.79 0 4 0 39 369.436 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4-chlorophenyl)-(7,8-dimethoxy-2,2,3-trimethyl-1H-3-benzazepin-4-yl)methanone (4-chlorophenyl)-(7,8-dimethoxy-…

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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) 4.87 11.1 -9.46 0 4 0 39 385.891 4 ↓

Parameters Provided:

ring.id = 582293
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 = 582293 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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