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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: (2-chloro-4-pyridyl)-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)methanone (2-chloro-4-pyridyl)-(1,3,4,5-te…

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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) 2.54 7.88 -10.11 0 3 0 33 286.762 1 ↓

Analogs

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Popular Name: (2,6-dichloro-4-pyridyl)-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)methanone (2,6-dichloro-4-pyridyl)-(1,3,4,…

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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) 3.56 8.3 -7.66 0 3 0 33 321.207 1 ↓

Analogs

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Popular Name: (2-fluoro-4-pyridyl)-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)methanone (2-fluoro-4-pyridyl)-(1,3,4,5-te…

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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) 2.03 7.39 -10.78 0 3 0 33 270.307 1 ↓

Analogs

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Popular Name: (2-amino-4-pyridyl)-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)methanone (2-amino-4-pyridyl)-(1,3,4,5-tet…

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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) 1.35 6.19 -10.22 2 4 0 59 267.332 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2-amino-6-chloro-4-pyridyl)-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)methanone (2-amino-6-chloro-4-pyridyl)-(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) 2.37 6.63 -10.26 2 4 0 59 301.777 1 ↓

Analogs

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Popular Name: [2-(methylamino)-4-pyridyl]-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)methanone [2-(methylamino)-4-pyridyl]-(1,3…

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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) 1.72 7.1 -10.4 1 4 0 45 281.359 2 ↓

Analogs

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Popular Name: (2-hydrazino-4-pyridyl)-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)methanone (2-hydrazino-4-pyridyl)-(1,3,4,5…

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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) 1.11 6.09 -10.82 3 5 0 71 282.347 2 ↓

Parameters Provided:

ring.id = 315007
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 = 315007 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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