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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-[5-chloro-2-[(5-oxothiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl]benzenesulfonamide N-[5-chloro-2-[(5-oxothiazolo[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) 4.05 7.28 -18.84 1 7 0 90 447.925 6 ↓
Mid Mid (pH 6-8) 4.05 7.32 -58.76 0 7 -1 92 446.917 6 ↓
Mid Mid (pH 6-8) 4.05 7.81 -52.14 2 7 1 91 448.933 6 ↓

Analogs

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Popular Name: N-[5-chloro-2-[(5-oxothiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl]-4-methyl-benzenesulfonamide N-[5-chloro-2-[(5-oxothiazolo[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) 4.50 7.96 -18.64 1 7 0 90 461.952 6 ↓
Mid Mid (pH 6-8) 4.50 8.01 -58.89 0 7 -1 92 460.944 6 ↓
Mid Mid (pH 6-8) 4.50 8.5 -51.93 2 7 1 91 462.96 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[5-methyl-2-[(5-oxothiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl]benzenesulfonamide N-[5-methyl-2-[(5-oxothiazolo[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) 3.82 7.43 -18.83 1 7 0 90 427.507 6 ↓
Hi High (pH 8-9.5) 3.82 7.49 -62.07 0 7 -1 92 426.499 6 ↓
Mid Mid (pH 6-8) 3.82 7.98 -49.33 2 7 1 91 428.515 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methyl-N-[5-methyl-2-[(5-oxothiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl]benzenesulfonamide 4-methyl-N-[5-methyl-2-[(5-oxoth…

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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) 4.27 8.11 -18.68 1 7 0 90 441.534 6 ↓
Hi High (pH 8-9.5) 4.27 8.16 -62.18 0 7 -1 92 440.526 6 ↓
Mid Mid (pH 6-8) 4.27 8.65 -49.15 2 7 1 91 442.542 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-methyl-2-[(5-oxothiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl]benzenesulfonamide N-[4-methyl-2-[(5-oxothiazolo[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) 3.82 7.44 -18.56 1 7 0 90 427.507 6 ↓
Hi High (pH 8-9.5) 3.82 7.48 -61.52 0 7 -1 92 426.499 6 ↓
Mid Mid (pH 6-8) 3.82 7.98 -48.97 2 7 1 91 428.515 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methyl-N-[4-methyl-2-[(5-oxothiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl]benzenesulfonamide 4-methyl-N-[4-methyl-2-[(5-oxoth…

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Activity (Go SEA)

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) 4.27 8.11 -18.43 1 7 0 90 441.534 6 ↓
Hi High (pH 8-9.5) 4.27 8.16 -61.59 0 7 -1 92 440.526 6 ↓
Mid Mid (pH 6-8) 4.27 8.65 -48.67 2 7 1 91 442.542 6 ↓

Parameters Provided:

ring.id = 372720
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 = 372720 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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