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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-(2-methoxyphenyl)-3-methyl-4-oxo-2-sulfanyl-quinazoline-7-carboxamide N-(2-methoxyphenyl)-3-methyl-4-o…

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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 6.47 -44.54 1 6 -1 79 340.384 3 ↓
Mid Mid (pH 6-8) 1.91 6.89 -16.06 2 6 0 76 341.392 3 ↓

Analogs

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Popular Name: 3-ethyl-N-(3-ethynylphenyl)-4-oxo-2-sulfanyl-quinazoline-7-carboxamide 3-ethyl-N-(3-ethynylphenyl)-4-ox…

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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) 2.48 9.08 -50.35 1 5 -1 70 348.407 3 ↓
Mid Mid (pH 6-8) 2.02 9.5 -21.06 2 5 0 67 349.415 3 ↓

Analogs

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Popular Name: 3-ethyl-N-(2-isobutoxyphenyl)-4-oxo-2-sulfanyl-quinazoline-7-carboxamide 3-ethyl-N-(2-isobutoxyphenyl)-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) 3.87 8.76 -41.09 1 6 -1 79 396.492 6 ↓
Mid Mid (pH 6-8) 3.41 10.03 -11.92 2 6 0 76 397.5 6 ↓

Analogs

55639655
55639655

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Popular Name: 3-methyl-N-[4-[(1S)-1-methylpropoxy]phenyl]-4-oxo-2-sulfanyl-quinazoline-7-carboxamide 3-methyl-N-[4-[(1S)-1-methylprop…

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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) 3.66 7.61 -42.15 1 6 -1 79 382.465 5 ↓
Mid Mid (pH 6-8) 3.20 8.86 -14.54 2 6 0 76 383.473 5 ↓

Analogs

55641096
55641096

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Popular Name: N-[4-[(1R)-1-methylpropoxy]phenyl]-4-oxo-2-sulfanyl-3H-quinazoline-7-carboxamide N-[4-[(1R)-1-methylpropoxy]pheny…

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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) 3.59 5.92 -42.63 2 6 -1 90 368.438 5 ↓
Mid Mid (pH 6-8) 3.14 7.25 -15.91 3 6 0 87 369.446 5 ↓

Analogs

55641091
55641091

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Popular Name: N-[4-[(1S)-1-methylpropoxy]phenyl]-4-oxo-2-sulfanyl-3H-quinazoline-7-carboxamide N-[4-[(1S)-1-methylpropoxy]pheny…

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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) 3.59 5.96 -41.73 2 6 -1 90 368.438 5 ↓
Mid Mid (pH 6-8) 3.14 7.28 -15.36 3 6 0 87 369.446 5 ↓

Analogs

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Popular Name: 3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]-4-oxo-2-sulfanyl-quinazoline-7-carboxamide 3-methyl-N-[4-methyl-3-(trifluor…

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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) 3.64 7.42 -40 1 5 -1 70 392.382 3 ↓
Mid Mid (pH 6-8) 3.18 8.67 -13.56 2 5 0 67 393.39 3 ↓

Parameters Provided:

ring.id = 60236
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 = 60236 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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