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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-N-[(3R)-1,1-dioxothiolan-3-yl]-4-phenyl-4,5-dihydrothiazol-2-amine (4R)-N-[(3R)-1,1-dioxothiolan-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) 1.50 4.34 -43.63 2 4 1 60 297.425 3 ↓
Hi High (pH 8-9.5) 1.50 3.39 -13.69 1 4 0 59 296.417 3 ↓

Analogs

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Popular Name: (4S)-N-[(3R)-1,1-dioxothiolan-3-yl]-4-phenyl-4,5-dihydrothiazol-2-amine (4S)-N-[(3R)-1,1-dioxothiolan-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) 1.50 4.34 -43.68 2 4 1 60 297.425 3 ↓
Hi High (pH 8-9.5) 1.50 3.39 -13.73 1 4 0 59 296.417 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-N-[(3S)-1,1-dioxothiolan-3-yl]-4-phenyl-4,5-dihydrothiazol-2-amine (4R)-N-[(3S)-1,1-dioxothiolan-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) 1.50 4.35 -43.93 2 4 1 60 297.425 3 ↓
Hi High (pH 8-9.5) 1.50 3.39 -13.66 1 4 0 59 296.417 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-N-[(3S)-1,1-dioxothiolan-3-yl]-4-phenyl-4,5-dihydrothiazol-2-amine (4S)-N-[(3S)-1,1-dioxothiolan-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) 1.50 4.35 -43.9 2 4 1 60 297.425 3 ↓
Hi High (pH 8-9.5) 1.50 3.39 -13.56 1 4 0 59 296.417 3 ↓

Analogs

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Popular Name: (4R)-N-[(3S)-3-methyl-1,1-dioxo-thiolan-3-yl]-4-phenyl-4,5-dihydrothiazol-2-amine (4R)-N-[(3S)-3-methyl-1,1-dioxo-…

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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) 1.94 4.21 -42.42 2 4 1 60 311.452 3 ↓
Hi High (pH 8-9.5) 1.94 3.26 -12.92 1 4 0 59 310.444 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-N-[(3R)-3-methyl-1,1-dioxo-thiolan-3-yl]-4-phenyl-4,5-dihydrothiazol-2-amine (4R)-N-[(3R)-3-methyl-1,1-dioxo-…

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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) 1.94 4.32 -41.64 2 4 1 60 311.452 3 ↓
Hi High (pH 8-9.5) 1.94 3.38 -13.88 1 4 0 59 310.444 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-N-[(3S)-3-methyl-1,1-dioxo-thiolan-3-yl]-4-phenyl-4,5-dihydrothiazol-2-amine (4S)-N-[(3S)-3-methyl-1,1-dioxo-…

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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) 1.94 4.22 -42.55 2 4 1 60 311.452 3 ↓
Hi High (pH 8-9.5) 1.94 3.25 -12.98 1 4 0 59 310.444 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-N-[(3R)-3-methyl-1,1-dioxo-thiolan-3-yl]-4-phenyl-4,5-dihydrothiazol-2-amine (4S)-N-[(3R)-3-methyl-1,1-dioxo-…

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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) 1.94 4.33 -41.56 2 4 1 60 311.452 3 ↓
Hi High (pH 8-9.5) 1.94 3.37 -13.78 1 4 0 59 310.444 3 ↓

Parameters Provided:

ring.id = 330867
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 = 330867 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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