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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-methyl-4-oxo-2-sulfanyl-3H-quinazoline-7-carboxamide N-[(1S)-1-(4-methoxyphenyl)ethyl…

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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) 2.39 5.98 -43.66 1 6 -1 81 368.438 4 ↓
Mid Mid (pH 6-8) 1.93 7.32 -16.55 2 6 0 78 369.446 4 ↓

Analogs

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Popular Name: N-methyl-4-oxo-N-[(1S)-1-(p-tolyl)ethyl]-2-sulfanyl-3H-quinazoline-7-carboxamide N-methyl-4-oxo-N-[(1S)-1-(p-toly…

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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) 2.78 7.37 -42.45 1 5 -1 72 352.439 3 ↓
Mid Mid (pH 6-8) 2.32 8.69 -14.86 2 5 0 69 353.447 3 ↓

Analogs

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Popular Name: 3-methyl-N-[(3-nitrophenyl)methyl]-4-oxo-2-sulfanyl-quinazoline-7-carboxamide 3-methyl-N-[(3-nitrophenyl)methy…

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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) 2.00 6.74 -45.39 1 8 -1 116 369.382 4 ↓
Mid Mid (pH 6-8) 1.54 7.99 -18.41 2 8 0 113 370.39 4 ↓

Analogs

21936277
21936277
26524137
26524137

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Popular Name: N-benzyl-N-isopropyl-3-methyl-4-oxo-2-sulfanyl-quinazoline-7-carboxamide N-benzyl-N-isopropyl-3-methyl-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) 2.51 8.88 -45.61 0 5 -1 61 366.466 4 ↓
Mid Mid (pH 6-8) 2.05 10.14 -13.44 1 5 0 58 367.474 4 ↓

Analogs

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Popular Name: N-benzyl-3-ethyl-N-isopropyl-4-oxo-2-sulfanyl-quinazoline-7-carboxamide N-benzyl-3-ethyl-N-isopropyl-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) 2.89 9.38 -45.66 0 5 -1 61 380.493 5 ↓
Mid Mid (pH 6-8) 2.43 10.66 -13.68 1 5 0 58 381.501 5 ↓

Parameters Provided:

ring.id = 39351
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 = 39351 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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