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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: 2-[[(1S)-1-cyclopropylethyl]-methyl-amino]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[[(1S)-1-cyclopropylethyl]-met…

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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) 3.77 8.79 -9.27 0 3 0 33 278.421 3 ↓

Analogs

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Popular Name: 2-[[(1R)-1-cyclopropylethyl]-methyl-amino]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[[(1R)-1-cyclopropylethyl]-met…

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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) 3.77 8.84 -9.39 0 3 0 33 278.421 3 ↓

Analogs

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Popular Name: 2-[[(1S)-1-cyclopropylethyl]-methyl-amino]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[[(1S)-1-cyclopropylethyl]-met…

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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) 2.88 7.87 -10.06 0 3 0 33 250.367 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[(1R)-1-cyclopropylethyl]-methyl-amino]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[[(1R)-1-cyclopropylethyl]-met…

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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) 2.88 7.93 -10.17 0 3 0 33 250.367 3 ↓

Analogs

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Popular Name: 2-[cyclopropylmethyl(methyl)amino]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[cyclopropylmethyl(methyl)amin…

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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) 3.44 8.5 -9.68 0 3 0 33 264.394 3 ↓

Analogs

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Popular Name: 2-[cyclopropylmethyl(methyl)amino]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[cyclopropylmethyl(methyl)amin…

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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) 2.55 7.58 -10.52 0 3 0 33 236.34 3 ↓

Analogs

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Popular Name: 2-[cyclopropylmethyl(propyl)amino]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[cyclopropylmethyl(propyl)amin…

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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) 4.31 10.19 -9.42 0 3 0 33 292.448 5 ↓

Analogs

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Popular Name: 2-[cyclopropylmethyl(propyl)amino]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[cyclopropylmethyl(propyl)amin…

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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) 3.42 9.27 -10.13 0 3 0 33 264.394 5 ↓

Analogs

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Popular Name: 2-[[(1S)-1-cyclopropylethyl]-(2-methoxyethyl)amino]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[[(1S)-1-cyclopropylethyl]-(2-…

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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) 2.86 7.5 -12.69 0 4 0 42 294.42 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[(1R)-1-cyclopropylethyl]-(2-methoxyethyl)amino]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[[(1R)-1-cyclopropylethyl]-(2-…

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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) 2.86 7.63 -13.02 0 4 0 42 294.42 6 ↓

Analogs

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Popular Name: 2-[cyclopropylmethyl(isopropyl)amino]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[cyclopropylmethyl(isopropyl)a…

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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) 4.11 10.31 -9.27 0 3 0 33 292.448 4 ↓

Analogs

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Popular Name: 2-[cyclopropylmethyl(isopropyl)amino]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[cyclopropylmethyl(isopropyl)a…

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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) 3.22 9.4 -10.01 0 3 0 33 264.394 4 ↓

Analogs

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Popular Name: 2-[cyclopropylmethyl(ethyl)amino]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[cyclopropylmethyl(ethyl)amino…

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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) 2.92 8.53 -10.38 0 3 0 33 250.367 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[cyclopropylmethyl(ethyl)amino]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[cyclopropylmethyl(ethyl)amino…

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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) 3.81 9.43 -9.63 0 3 0 33 278.421 4 ↓

Parameters Provided:

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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 = 157560 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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