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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-(2-pyridyl)-4,5-dihydrothieno[2,3-g][1,2]benzoxazole-3-carboxamide N-(2-pyridyl)-4,5-dihydrothieno[…

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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 7.44 -11.96 1 5 0 68 297.339 2 ↓

Analogs

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Popular Name: N-(2-pyrrolidin-1-ylethyl)-4,5-dihydrothieno[2,3-g][1,2]benzoxazole-3-carboxamide N-(2-pyrrolidin-1-ylethyl)-4,5-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) 2.18 7.24 -40.4 2 5 1 60 318.422 4 ↓
Hi High (pH 8-9.5) 2.18 4.71 -7.52 1 5 0 58 317.414 4 ↓

Analogs

15733177
15733177

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Popular Name: N-(3-ethoxypropyl)-4,5-dihydrothieno[2,3-g][1,2]benzoxazole-3-carboxamide N-(3-ethoxypropyl)-4,5-dihydroth…

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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) 2.38 5.63 -8.07 1 5 0 64 306.387 6 ↓

Analogs

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Popular Name: N-(4-methyl-2-pyridyl)-4,5-dihydrothieno[2,3-g][1,2]benzoxazole-3-carboxamide N-(4-methyl-2-pyridyl)-4,5-dihyd…

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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) 2.95 8.11 -11.65 1 5 0 68 311.366 2 ↓

Analogs

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Popular Name: N-(2-carbamoylphenyl)-4,5-dihydrothieno[2,3-g][1,2]benzoxazole-3-carboxamide N-(2-carbamoylphenyl)-4,5-dihydr…

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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) 2.22 4.95 -15.92 3 6 0 98 339.376 3 ↓

Analogs

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Popular Name: methyl methyl

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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) 3.11 7.61 -10.49 1 6 0 81 360.416 4 ↓

Analogs

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Popular Name: methyl methyl

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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) 2.39 8.06 -11.37 1 6 0 81 366.464 7 ↓

Analogs

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Popular Name: methyl methyl

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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) 2.39 8.06 -11.23 1 6 0 81 366.464 7 ↓

Analogs

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Popular Name: N-ethyl-4,5-dihydrothieno[2,3-g][1,2]benzoxazole-3-carboxamide N-ethyl-4,5-dihydrothieno[2,3-g]…

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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) 2.12 4.85 -7.56 1 4 0 55 248.307 2 ↓

Analogs

15733269
15733269

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Popular Name: N-[2-[(2R)-2-methyl-1-piperidyl]ethyl]-4,5-dihydrothieno[2,3-g][1,2]benzoxazole-3-carboxamide N-[2-[(2R)-2-methyl-1-piperidyl]…

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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) 3.02 8.28 -39.88 2 5 1 60 346.476 4 ↓
Hi High (pH 8-9.5) 3.02 6.02 -7.45 1 5 0 58 345.468 4 ↓

Analogs

15733269
15733269

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Popular Name: N-[2-[(2S)-2-methyl-1-piperidyl]ethyl]-4,5-dihydrothieno[2,3-g][1,2]benzoxazole-3-carboxamide N-[2-[(2S)-2-methyl-1-piperidyl]…

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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) 3.02 8.56 -38.05 2 5 1 60 346.476 4 ↓
Hi High (pH 8-9.5) 3.02 6.36 -7.28 1 5 0 58 345.468 4 ↓

Analogs

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Popular Name: N-[(1S)-1-(morpholinomethyl)propyl]-4,5-dihydrothieno[2,3-g][1,2]benzoxazole-3-carboxamide N-[(1S)-1-(morpholinomethyl)prop…

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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) 2.49 5.33 -8.67 1 6 0 68 361.467 5 ↓
Mid Mid (pH 6-8) 2.49 8 -39.91 2 6 1 69 362.475 5 ↓

Analogs

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Popular Name: N-[(1R)-1-(morpholinomethyl)propyl]-4,5-dihydrothieno[2,3-g][1,2]benzoxazole-3-carboxamide N-[(1R)-1-(morpholinomethyl)prop…

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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) 2.49 5.04 -8.07 1 6 0 68 361.467 5 ↓
Mid Mid (pH 6-8) 2.49 7.62 -41.5 2 6 1 69 362.475 5 ↓

Parameters Provided:

ring.id = 90668
filter.purchasability = annotated
page.format = targets
page.num = 1

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 = 90668 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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