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Analogs

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Popular Name: 1-(4-methoxyphenyl)-7,7-dimethyl-3-(2-phenyl-1,2,4-triazol-3-yl)-6,8-dihydroquinoline-2,5-dione 1-(4-methoxyphenyl)-7,7-dimethyl…

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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) 4.00 13.26 -22.33 0 7 0 79 440.503 4 ↓

Analogs

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Popular Name: 1-(4-methoxyphenyl)-3-[2-(4-methoxyphenyl)-1,2,4-triazol-3-yl]-7,7-dimethyl-6,8-dihydroquinoline-2,5 1-(4-methoxyphenyl)-3-[2-(4-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) 4.06 12.58 -21.65 0 8 0 88 470.529 5 ↓

Analogs

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Popular Name: 1-(4-methoxyphenyl)-7,7-dimethyl-3-[2-(p-tolyl)-1,2,4-triazol-3-yl]-6,8-dihydroquinoline-2,5-dione 1-(4-methoxyphenyl)-7,7-dimethyl…

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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) 4.45 13.92 -21.53 0 7 0 79 454.53 4 ↓

Analogs

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Popular Name: 3-[2-(3-chloro-4-methyl-phenyl)-1,2,4-triazol-3-yl]-1-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydroquin 3-[2-(3-chloro-4-methyl-phenyl)-…

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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 14.41 -19.59 0 7 0 79 488.975 4 ↓

Analogs

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Popular Name: 3-[2-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]-1-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydroquinoline- 3-[2-(2,4-dimethylphenyl)-1,2,4-…

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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) 5.04 14.97 -19.86 0 7 0 79 468.557 4 ↓

Analogs

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Popular Name: 3-[2-(3-chloro-4-methyl-phenyl)-1,2,4-triazol-3-yl]-7,7-dimethyl-1-(p-tolyl)-6,8-dihydroquinoline-2, 3-[2-(3-chloro-4-methyl-phenyl)-…

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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) 5.66 15.7 -19.19 0 6 0 70 472.976 3 ↓

Analogs

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Popular Name: 3-[2-(3-chloro-4-methyl-phenyl)-1,2,4-triazol-3-yl]-7,7-dimethyl-1-phenyl-6,8-dihydroquinoline-2,5-d 3-[2-(3-chloro-4-methyl-phenyl)-…

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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 15.09 -19.57 0 6 0 70 458.949 3 ↓

Analogs

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Popular Name: 3-[2-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]-7,7-dimethyl-1-phenyl-6,8-dihydroquinoline-2,5-dione 3-[2-(2,4-dimethylphenyl)-1,2,4-…

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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) 4.98 15.66 -19.78 0 6 0 70 438.531 3 ↓

Analogs

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Popular Name: 7,7-dimethyl-1-phenyl-3-[2-(p-tolyl)-1,2,4-triazol-3-yl]-6,8-dihydroquinoline-2,5-dione 7,7-dimethyl-1-phenyl-3-[2-(p-to…

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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) 4.39 14.61 -21.46 0 6 0 70 424.504 3 ↓

Analogs

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Popular Name: 3-[2-(2,3-dimethylphenyl)-1,2,4-triazol-3-yl]-7,7-dimethyl-1-phenyl-6,8-dihydroquinoline-2,5-dione 3-[2-(2,3-dimethylphenyl)-1,2,4-…

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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) 4.96 15.78 -19.97 0 6 0 70 438.531 3 ↓

Analogs

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Popular Name: 3-[2-(2,4-difluorophenyl)-1,2,4-triazol-3-yl]-7,7-dimethyl-1-phenyl-6,8-dihydroquinoline-2,5-dione 3-[2-(2,4-difluorophenyl)-1,2,4-…

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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) 4.41 14.35 -19.88 0 6 0 70 446.457 3 ↓

Analogs

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Popular Name: 7,7-dimethyl-1-(p-tolyl)-3-[2-(p-tolyl)-1,2,4-triazol-3-yl]-6,8-dihydroquinoline-2,5-dione 7,7-dimethyl-1-(p-tolyl)-3-[2-(p…

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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) 4.84 15.27 -21.23 0 6 0 70 438.531 3 ↓

Parameters Provided:

ring.id = 12592
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 = 12592 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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