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

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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) 4.47 9.3 -9.14 0 3 0 33 292.448 2 ↓

Analogs

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

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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) 3.58 8.38 -9.8 0 3 0 33 264.394 2 ↓

Analogs

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Popular Name: 2-[cyclohexyl(ethyl)amino]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[cyclohexyl(ethyl)amino]-5,6-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) 3.96 8.9 -10.77 0 3 0 33 278.421 3 ↓

Analogs

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

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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) 3.59 8.98 -9.77 0 3 0 33 278.421 2 ↓

Analogs

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

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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) 3.59 8.68 -10.15 0 3 0 33 278.421 2 ↓

Analogs

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

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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) 3.59 8.69 -10.51 0 3 0 33 278.421 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

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

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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) 3.59 8.98 -9.78 0 3 0 33 278.421 2 ↓

Analogs

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

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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 8.72 -10.07 0 3 0 33 278.421 2 ↓

Analogs

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

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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 9.33 -9.8 0 3 0 33 278.421 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

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

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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 9.34 -9.83 0 3 0 33 278.421 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

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

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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 7.68 -9.92 0 3 0 33 278.421 2 ↓

Analogs

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

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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) 3.35 8.69 -10.47 0 3 0 33 278.421 2 ↓

Analogs

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

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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) 4.04 9.35 -10.44 0 3 0 33 292.448 3 ↓

Parameters Provided:

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Structural Results Found: (before additional filtering)

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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 = 157514 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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