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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: N-[4-[[5-[(2R)-3-benzyl-5,8-dimethoxy-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxy-phenyl]methoxy]phe N-[4-[[5-[(2R)-3-benzyl-5,8-dime…

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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) 4.42 12.47 -22.8 2 9 0 98 567.642 10 ↓

Analogs

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Popular Name: N-[4-[[5-[(2S)-3-benzyl-5,8-dimethoxy-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxy-phenyl]methoxy]phe N-[4-[[5-[(2S)-3-benzyl-5,8-dime…

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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) 4.42 12.59 -22.41 2 9 0 98 567.642 10 ↓

Analogs

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Popular Name: N-[4-[[5-[(2R)-3-benzyl-5-(methanesulfonamido)-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxy-phenyl]me N-[4-[[5-[(2R)-3-benzyl-5-(metha…

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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) 3.58 9.71 -64.18 2 10 -1 128 599.689 10 ↓
Lo Low (pH 4.5-6) 3.58 9.74 -25.05 3 10 0 126 600.697 10 ↓

Analogs

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Popular Name: N-[4-[[5-[(2S)-3-benzyl-5-(methanesulfonamido)-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxy-phenyl]me N-[4-[[5-[(2S)-3-benzyl-5-(metha…

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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) 3.58 9.8 -64.8 2 10 -1 128 599.689 10 ↓
Lo Low (pH 4.5-6) 3.58 9.81 -25.07 3 10 0 126 600.697 10 ↓

Analogs

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Popular Name: (2R)-3-benzyl-2-[3-[(3-fluorophenoxy)methyl]-4-methoxy-phenyl]-1,2-dihydroquinazolin-4-one (2R)-3-benzyl-2-[3-[(3-fluorophe…

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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) 5.32 14.04 -12.72 1 5 0 51 468.528 7 ↓

Analogs

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Popular Name: (2S)-3-benzyl-2-[3-[(3-fluorophenoxy)methyl]-4-methoxy-phenyl]-1,2-dihydroquinazolin-4-one (2S)-3-benzyl-2-[3-[(3-fluorophe…

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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) 5.32 13.97 -12.95 1 5 0 51 468.528 7 ↓

Analogs

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Popular Name: N-[4-[[5-[(2R)-3-benzyl-5-fluoro-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxy-phenyl]methoxy]phenyl]a N-[4-[[5-[(2R)-3-benzyl-5-fluoro…

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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) 4.51 12.76 -24.18 2 7 0 80 525.58 8 ↓

Analogs

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Popular Name: N-[4-[[5-[(2S)-3-benzyl-5-fluoro-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxy-phenyl]methoxy]phenyl]a N-[4-[[5-[(2S)-3-benzyl-5-fluoro…

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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) 4.51 12.86 -23.94 2 7 0 80 525.58 8 ↓

Analogs

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Popular Name: N-[4-[[3-[(2R)-3-benzyl-4-oxo-1,2-dihydroquinazolin-2-yl]phenyl]methoxy]phenyl]acetamide N-[4-[[3-[(2R)-3-benzyl-4-oxo-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) 4.39 13.24 -20.27 2 6 0 71 477.564 7 ↓

Analogs

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Popular Name: N-[4-[[3-[(2S)-3-benzyl-4-oxo-1,2-dihydroquinazolin-2-yl]phenyl]methoxy]phenyl]acetamide N-[4-[[3-[(2S)-3-benzyl-4-oxo-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) 4.39 13.35 -18.48 2 6 0 71 477.564 7 ↓

Analogs

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Popular Name: N-[3-[[5-[(2R)-3-benzyl-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxy-phenyl]methoxy]phenyl]acetamide N-[3-[[5-[(2R)-3-benzyl-4-oxo-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) 4.37 12.69 -18.99 2 7 0 80 507.59 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-[[5-[(2S)-3-benzyl-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxy-phenyl]methoxy]phenyl]acetamide N-[3-[[5-[(2S)-3-benzyl-4-oxo-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) 4.37 12.8 -18.99 2 7 0 80 507.59 8 ↓

Analogs

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Popular Name: N-[4-[[5-[(2R)-3-benzyl-6-hydroxy-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxy-phenyl]methoxy]phenyl] N-[4-[[5-[(2R)-3-benzyl-6-hydrox…

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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) 3.90 9.85 -22.46 3 8 0 100 523.589 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-[[5-[(2S)-3-benzyl-6-hydroxy-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxy-phenyl]methoxy]phenyl] N-[4-[[5-[(2S)-3-benzyl-6-hydrox…

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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) 3.90 9.95 -22.09 3 8 0 100 523.589 8 ↓

Analogs

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Popular Name: N-[4-[[5-[(2R)-5-amino-3-benzyl-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxy-phenyl]methoxy]phenyl]ac N-[4-[[5-[(2R)-5-amino-3-benzyl-…

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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) 3.83 10.89 -18.67 4 8 0 106 522.605 8 ↓

Analogs

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Popular Name: N-[4-[[5-[(2S)-5-amino-3-benzyl-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxy-phenyl]methoxy]phenyl]ac N-[4-[[5-[(2S)-5-amino-3-benzyl-…

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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) 3.83 10.97 -18.55 4 8 0 106 522.605 8 ↓

Analogs

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Popular Name: (2R)-3-benzyl-2-[4-methoxy-3-(phenoxymethyl)phenyl]-1,2-dihydroquinazolin-4-one (2R)-3-benzyl-2-[4-methoxy-3-(ph…

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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) 5.18 13.97 -12.63 1 5 0 51 450.538 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-3-benzyl-2-[4-methoxy-3-(phenoxymethyl)phenyl]-1,2-dihydroquinazolin-4-one (2S)-3-benzyl-2-[4-methoxy-3-(ph…

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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) 5.18 13.91 -12.91 1 5 0 51 450.538 7 ↓

Parameters Provided:

ring.id = 471358
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 = 471358 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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