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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-[(3-aminophenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-amine N-[(3-aminophenyl)methyl]-1,1-di…

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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) 0.49 2.33 -17.86 3 5 0 85 287.344 3 ↓

Analogs

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Popular Name: N-[(2-chlorophenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-amine N-[(2-chlorophenyl)methyl]-1,1-d…

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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) 2.07 4.87 -18.08 1 4 0 59 306.774 3 ↓

Analogs

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Popular Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-2-phenyl-ethanol (2S)-2-[(1,1-dioxo-1,2-benzothia…

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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) 0.99 2.12 -17.7 2 5 0 79 302.355 4 ↓
Hi High (pH 8-9.5) 0.99 1.25 -43.67 1 5 -1 81 301.347 4 ↓

Analogs

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Popular Name: (2R)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-2-phenyl-ethanol (2R)-2-[(1,1-dioxo-1,2-benzothia…

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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) 0.99 2.12 -17.75 2 5 0 79 302.355 4 ↓
Hi High (pH 8-9.5) 0.99 1.25 -43.77 1 5 -1 81 301.347 4 ↓

Analogs

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Popular Name: N-[(3,4-difluorophenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-amine N-[(3,4-difluorophenyl)methyl]-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) 1.69 4.58 -20.17 1 4 0 59 308.309 3 ↓

Analogs

42255599
42255599

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Popular Name: N-[(1S)-1-(3-fluorophenyl)ethyl]-1,1-dioxo-1,2-benzothiazol-3-amine N-[(1S)-1-(3-fluorophenyl)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) 2.14 5.36 -20.69 1 4 0 59 304.346 3 ↓
Hi High (pH 8-9.5) 2.14 4.53 -41.19 0 4 -1 61 303.338 3 ↓

Analogs

42255595
42255595

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Popular Name: N-[(1R)-1-(3-fluorophenyl)ethyl]-1,1-dioxo-1,2-benzothiazol-3-amine N-[(1R)-1-(3-fluorophenyl)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) 2.14 5.36 -20.66 1 4 0 59 304.346 3 ↓
Hi High (pH 8-9.5) 2.14 4.52 -41.12 0 4 -1 61 303.338 3 ↓

Parameters Provided:

ring.id = 36293
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 = 36293 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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