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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: (4R)-2-[(3,4-dimethoxyphenyl)methylamino]-4-ethyl-4-methyl-oxazol-5-one (4R)-2-[(3,4-dimethoxyphenyl)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) 2.09 4.29 -38.22 2 6 1 71 293.343 6 ↓
Mid Mid (pH 6-8) 2.09 3.19 -8.64 1 6 0 69 292.335 6 ↓

Analogs

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Popular Name: (4S)-2-[(3,4-dimethoxyphenyl)methylamino]-4-ethyl-4-methyl-oxazol-5-one (4S)-2-[(3,4-dimethoxyphenyl)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) 2.09 4.29 -38.17 2 6 1 71 293.343 6 ↓
Mid Mid (pH 6-8) 2.09 3.11 -8.68 1 6 0 69 292.335 6 ↓

Analogs

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Popular Name: (4R)-4-methyl-2-[[3-(morpholinomethyl)phenyl]methylamino]-4H-oxazol-5-one (4R)-4-methyl-2-[[3-(morpholinom…

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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) 1.09 2.97 -36.1 2 6 1 65 304.37 5 ↓
Mid Mid (pH 6-8) 1.09 1.32 -6.19 1 6 0 63 303.362 5 ↓
Lo Low (pH 4.5-6) 1.09 5.22 -90.35 3 6 2 66 305.378 5 ↓

Analogs

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Popular Name: (4S)-4-methyl-2-[[3-(morpholinomethyl)phenyl]methylamino]-4H-oxazol-5-one (4S)-4-methyl-2-[[3-(morpholinom…

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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) 1.09 2.97 -36.12 2 6 1 65 304.37 5 ↓
Mid Mid (pH 6-8) 1.09 1.32 -6.21 1 6 0 63 303.362 5 ↓
Lo Low (pH 4.5-6) 1.09 5.22 -90.48 3 6 2 66 305.378 5 ↓

Analogs

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Popular Name: 2-[2-[2-(butylamino)ethylsulfanyl]ethyl]-4,4-dimethyl-oxazol-5-one 2-[2-[2-(butylamino)ethylsulfany…

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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) 2.44 5.44 -43.96 2 4 1 55 273.422 9 ↓

Analogs

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Popular Name: 2-[2-[2-(4,4-dimethyl-5-oxo-oxazol-2-yl)ethylsulfanyl]acetyl]oxyethyl 2-[2-[2-(4,4-dimethyl-5-oxo-oxaz…

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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) 2.35 7.49 -17.31 0 10 0 130 488.584 15 ↓

Analogs

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Popular Name: (4R)-4-methyl-2-[2-[2-[2-[2-[(4S)-4-methyl-4-nonyl-5-oxo-oxazol-2-yl]ethylsulfanyl]ethoxy]ethylsulfa (4R)-4-methyl-2-[2-[2-[2-[2-[(4S…

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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) 9.38 18.38 -9.09 0 7 0 87 640.997 28 ↓

Analogs

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Popular Name: (4S)-4-methyl-2-[2-[2-[2-[2-[(4S)-4-methyl-4-nonyl-5-oxo-oxazol-2-yl]ethylsulfanyl]ethoxy]ethylsulfa (4S)-4-methyl-2-[2-[2-[2-[2-[(4S…

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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) 9.38 18.3 -9.1 0 7 0 87 640.997 28 ↓

Analogs

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Popular Name: (4R)-4-methyl-2-[2-[2-[2-[2-[(4R)-4-methyl-4-nonyl-5-oxo-oxazol-2-yl]ethylsulfanyl]ethoxy]ethylsulfa (4R)-4-methyl-2-[2-[2-[2-[2-[(4R…

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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) 9.38 18.45 -9.11 0 7 0 87 640.997 28 ↓

Analogs

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Popular Name: 4,4-dimethyl-2-[2-(2-sulfanylethylsulfanyl)ethyl]oxazol-5-one 4,4-dimethyl-2-[2-(2-sulfanyleth…

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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) 1.89 4 -4.96 0 3 0 39 233.358 5 ↓

Analogs

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Popular Name: 2-[2-[2-(2-anilinoethoxy)ethylsulfanyl]ethyl]-4,4-dimethyl-oxazol-5-one 2-[2-[2-(2-anilinoethoxy)ethylsu…

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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) 3.03 5.85 -7.25 1 5 0 60 336.457 10 ↓

Analogs

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Popular Name: 2-[(1R)-2-[2-[2-[(2S)-2-(4,4-dimethyl-5-oxo-oxazol-2-yl)propyl]sulfanylethoxy]ethylsulfanyl]-1-methy 2-[(1R)-2-[2-[2-[(2S)-2-(4,4-dim…

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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) 3.75 6.5 -8.43 0 7 0 87 444.619 12 ↓

Analogs

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Popular Name: 2-[(1S)-2-[2-[2-[(2S)-2-(4,4-dimethyl-5-oxo-oxazol-2-yl)propyl]sulfanylethoxy]ethylsulfanyl]-1-methy 2-[(1S)-2-[2-[2-[(2S)-2-(4,4-dim…

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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) 3.75 6.5 -8.26 0 7 0 87 444.619 12 ↓

Analogs

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Popular Name: 2-[(1R)-2-[2-[2-[(2R)-2-(4,4-dimethyl-5-oxo-oxazol-2-yl)propyl]sulfanylethoxy]ethylsulfanyl]-1-methy 2-[(1R)-2-[2-[2-[(2R)-2-(4,4-dim…

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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) 3.75 6.5 -8.31 0 7 0 87 444.619 12 ↓

Analogs

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Popular Name: 2-[2-(2-hydroxyethylsulfanyl)ethyl]-4,4-dimethyl-oxazol-5-one 2-[2-(2-hydroxyethylsulfanyl)eth…

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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) 0.93 0.46 -6.33 1 4 0 59 217.29 5 ↓

Analogs

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Popular Name: 2-[2-[2-[2-[2-(4,4-dimethyl-5-oxo-oxazol-2-yl)ethyl-methyl-amino]ethoxy]ethyl-methyl-amino]ethyl]-4, 2-[2-[2-[2-[2-(4,4-dimethyl-5-ox…

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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) 1.81 0.6 -9.41 0 9 0 93 410.515 12 ↓
Mid Mid (pH 6-8) 1.81 3.02 -47.41 1 9 1 94 411.523 12 ↓
Lo Low (pH 4.5-6) 1.81 5.4 -114.87 2 9 2 95 412.531 12 ↓

Analogs

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Popular Name: 2-[2-[2-[2-[2-(4,4-dimethyl-5-oxo-oxazol-2-yl)ethylsulfanyl]ethylsulfanyl]ethylsulfanyl]ethyl]-4,4-d 2-[2-[2-[2-[2-(4,4-dimethyl-5-ox…

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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) 3.34 7.62 -9.04 0 6 0 77 432.633 12 ↓

Analogs

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Popular Name: 2-[3-[2-(4,4-dimethyl-5-oxo-oxazol-2-yl)ethylsulfanyl]propanoyloxy]ethyl 2-[3-[2-(4,4-dimethyl-5-oxo-oxaz…

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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) 2.28 9.1 -14.47 0 10 0 130 516.638 17 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[2-[2-[2-(4,4-dimethyl-5-oxo-oxazol-2-yl)ethylsulfanyl]ethylsulfanyl]ethyl]-4,4-dimethyl-oxazol-5- 2-[2-[2-[2-(4,4-dimethyl-5-oxo-o…

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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) 2.82 5.49 -8.75 0 6 0 77 372.512 9 ↓

Analogs

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Popular Name: 4,4-Dimethyl-2-vinyloxazol-5(4H)-one 4,4-Dimethyl-2-vinyloxazol-5(4H)…

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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) 1.41 0.99 -5.47 0 3 0 38 139.154 1 ↓

Parameters Provided:

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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 = 185303 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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