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Analogs

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Popular Name: 2-(3,5-dioxomorpholin-4-yl)-5-nitro-benzoic 2-(3,5-dioxomorpholin-4-yl)-5-ni…

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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) 0.51 4.98 -57.21 0 9 -1 133 279.184 3 ↓

Analogs

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Popular Name: 2-(3,5-dioxomorpholin-4-yl)-4-nitro-benzoic 2-(3,5-dioxomorpholin-4-yl)-4-ni…

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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) 0.51 5 -50.78 0 9 -1 133 279.184 3 ↓

Analogs

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Popular Name: 2-(3,5-dioxomorpholin-4-yl)-5-iodo-benzoic 2-(3,5-dioxomorpholin-4-yl)-5-io…

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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) 1.63 5.37 -58.03 0 6 -1 87 360.083 2 ↓

Analogs

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Popular Name: 3,5-dibromo-2-(3,5-dioxomorpholin-4-yl)benzoic 3,5-dibromo-2-(3,5-dioxomorpholi…

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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 5.9 -53.19 0 6 -1 87 391.979 2 ↓

Analogs

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Popular Name: 2-(3,5-dioxomorpholin-4-yl)-3,5-dimethyl-benzoic 2-(3,5-dioxomorpholin-4-yl)-3,5-…

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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) 1.37 5.98 -64.33 0 6 -1 87 262.241 2 ↓

Analogs

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Popular Name: 3-bromo-2-(3,5-dioxomorpholin-4-yl)benzoic 3-bromo-2-(3,5-dioxomorpholin-4-…

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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) 1.33 5.27 -52.77 0 6 -1 87 313.083 2 ↓

Analogs

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Popular Name: 5-amino-2-(3,5-dioxomorpholin-4-yl)benzoic 5-amino-2-(3,5-dioxomorpholin-4-…

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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) -0.38 2.15 -63.11 2 7 -1 113 249.202 2 ↓

Analogs

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Popular Name: 4-amino-2-(3,5-dioxomorpholin-4-yl)benzoic 4-amino-2-(3,5-dioxomorpholin-4-…

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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) -0.38 2.15 -64.6 2 7 -1 113 249.202 2 ↓

Analogs

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Popular Name: 3-amino-4-(3,5-dioxomorpholin-4-yl)benzoic 3-amino-4-(3,5-dioxomorpholin-4-…

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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) -0.15 2.17 -58.26 2 7 -1 113 249.202 2 ↓

Analogs

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Popular Name: 4-(3,5-dioxomorpholin-4-yl)-3-fluoro-benzoic 4-(3,5-dioxomorpholin-4-yl)-3-fl…

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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) 0.53 3.93 -54.9 0 6 -1 87 252.177 2 ↓

Analogs

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Popular Name: 4-(5-amino-2-methoxy-phenyl)morpholine-3,5-dione 4-(5-amino-2-methoxy-phenyl)morp…

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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) -0.41 0.55 -15.16 2 6 0 82 236.227 2 ↓

Analogs

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Popular Name: 4-(2-amino-4-methoxy-phenyl)morpholine-3,5-dione 4-(2-amino-4-methoxy-phenyl)morp…

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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) 0.00 0.9 -12.81 2 6 0 82 236.227 2 ↓

Analogs

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Popular Name: 4-[2-amino-4-(trifluoromethyl)phenyl]morpholine-3,5-dione 4-[2-amino-4-(trifluoromethyl)ph…

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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) 0.83 2.63 -11.27 2 5 0 73 274.198 2 ↓

Analogs

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Popular Name: 4-(4-amino-2-methoxy-phenyl)morpholine-3,5-dione 4-(4-amino-2-methoxy-phenyl)morp…

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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) -0.41 0.56 -15 2 6 0 82 236.227 2 ↓

Analogs

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Popular Name: 4-[4-amino-3-(trifluoromethyl)phenyl]morpholine-3,5-dione 4-[4-amino-3-(trifluoromethyl)ph…

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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) 0.83 2.25 -11.84 2 5 0 73 274.198 2 ↓

Analogs

41044241
41044241

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Popular Name: 4-(3-amino-2,6-dimethyl-phenyl)morpholine-3,5-dione 4-(3-amino-2,6-dimethyl-phenyl)m…

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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) 0.76 3.28 -12.66 2 5 0 73 234.255 1 ↓

Analogs

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Popular Name: 4-(3-amino-4-ethyl-phenyl)morpholine-3,5-dione 4-(3-amino-4-ethyl-phenyl)morpho…

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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) 0.85 2.61 -12.73 2 5 0 73 234.255 2 ↓

Analogs

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Popular Name: 4-[4-(2-aminoethoxy)phenyl]morpholine-3,5-dione 4-[4-(2-aminoethoxy)phenyl]morph…

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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) -0.61 0.91 -51.81 3 6 1 83 251.262 4 ↓
Hi High (pH 8-9.5) -0.61 0.47 -13.48 2 6 0 82 250.254 4 ↓

Analogs

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Popular Name: 4-[2-(2-aminoethoxy)phenyl]morpholine-3,5-dione 4-[2-(2-aminoethoxy)phenyl]morph…

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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) -0.66 1.07 -49.06 3 6 1 83 251.262 4 ↓
Hi High (pH 8-9.5) -0.66 0.64 -15.11 2 6 0 82 250.254 4 ↓

Analogs

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Popular Name: 4-[2-(aminomethyl)-3-fluoro-phenyl]morpholine-3,5-dione 4-[2-(aminomethyl)-3-fluoro-phen…

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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) -0.22 1.73 -38.35 3 5 1 74 239.226 2 ↓
Hi High (pH 8-9.5) -0.22 1.23 -11.83 2 5 0 73 238.218 2 ↓

Analogs

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Popular Name: 4-[4-(2-amino-1,1-dimethyl-ethyl)phenyl]morpholine-3,5-dione 4-[4-(2-amino-1,1-dimethyl-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) 0.48 2.95 -54.37 3 5 1 74 263.317 3 ↓

Analogs

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Popular Name: 3-(3,5-dioxomorpholin-4-yl)benzoic 3-(3,5-dioxomorpholin-4-yl)benzoic

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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) 0.42 3.79 -61.81 0 6 -1 87 234.187 2 ↓

Analogs

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Popular Name: 2-(3,5-dioxomorpholin-4-yl)benzoic 2-(3,5-dioxomorpholin-4-yl)benzoic

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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) 0.57 4.28 -62.45 0 6 -1 87 234.187 2 ↓

Analogs

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Popular Name: 4-(3,5-dioxomorpholin-4-yl)benzoic 4-(3,5-dioxomorpholin-4-yl)benzoic

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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) 0.44 3.79 -56.6 0 6 -1 87 234.187 2 ↓

Analogs

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Popular Name: 4-chloro-2-(3,5-dioxomorpholin-4-yl)benzoic 4-chloro-2-(3,5-dioxomorpholin-4…

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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) 1.23 4.8 -56.07 0 6 -1 87 268.632 2 ↓

Analogs

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Popular Name: 3-(3,5-dioxomorpholin-4-yl)-4-methyl-benzoic 3-(3,5-dioxomorpholin-4-yl)-4-me…

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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) 0.82 4.82 -59.9 0 6 -1 87 248.214 2 ↓

Analogs

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Popular Name: 2-(3,5-dioxomorpholin-4-yl)-4,5-dimethoxy-benzoic 2-(3,5-dioxomorpholin-4-yl)-4,5-…

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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) 0.19 3.5 -61.03 0 8 -1 105 294.239 4 ↓

Analogs

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Popular Name: 2-[4-(3,5-dioxomorpholin-4-yl)phenyl]acetic 2-[4-(3,5-dioxomorpholin-4-yl)ph…

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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) -0.05 4.57 -55.81 0 6 -1 87 248.214 3 ↓

Analogs

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Popular Name: 5-chloro-2-(3,5-dioxomorpholin-4-yl)benzoic 5-chloro-2-(3,5-dioxomorpholin-4…

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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) 1.23 4.79 -58.16 0 6 -1 87 268.632 2 ↓

Analogs

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Popular Name: 4-(3,5-dioxomorpholin-4-yl)-2-hydroxy-benzoic 4-(3,5-dioxomorpholin-4-yl)-2-hy…

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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) 0.44 1.85 -58.28 1 7 -1 107 250.186 2 ↓

Analogs

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Popular Name: 2-(3,5-dioxomorpholin-4-yl)-3-methyl-benzoic 2-(3,5-dioxomorpholin-4-yl)-3-me…

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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) 0.97 5.31 -63.48 0 6 -1 87 248.214 2 ↓

Analogs

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Popular Name: 4-(3,5-dioxomorpholin-4-yl)-3-methyl-benzoic 4-(3,5-dioxomorpholin-4-yl)-3-me…

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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) 0.82 4.82 -57.55 0 6 -1 87 248.214 2 ↓

Analogs

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Popular Name: 2-(3,5-dioxomorpholin-4-yl)-4-fluoro-benzoic 2-(3,5-dioxomorpholin-4-yl)-4-fl…

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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) 0.71 4.35 -55.56 0 6 -1 87 252.177 2 ↓

Analogs

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Popular Name: 5-acetamido-2-(3,5-dioxomorpholin-4-yl)benzoic 5-acetamido-2-(3,5-dioxomorpholi…

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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) -0.23 3.18 -62.98 1 8 -1 116 291.239 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-3-(3,5-dioxomorpholin-4-yl)benzoic 4-chloro-3-(3,5-dioxomorpholin-4…

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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) 1.05 4.62 -54.21 0 6 -1 87 268.632 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3,5-dioxomorpholin-4-yl)-5-methyl-benzoic 2-(3,5-dioxomorpholin-4-yl)-5-me…

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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) 1.00 4.95 -63.12 0 6 -1 87 248.214 2 ↓

Analogs

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Popular Name: 2-[[4-(3,5-dioxomorpholin-4-yl)benzoyl]amino]acetic 2-[[4-(3,5-dioxomorpholin-4-yl)b…

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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) -1.95 2.38 -51.26 1 8 -1 116 291.239 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3,5-dioxomorpholin-4-yl)-5-fluoro-benzoic 2-(3,5-dioxomorpholin-4-yl)-5-fl…

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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) 0.71 4.35 -58.2 0 6 -1 87 252.177 2 ↓

Analogs

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Popular Name: 3,5-dichloro-2-(3,5-dioxomorpholin-4-yl)benzoic 3,5-dichloro-2-(3,5-dioxomorphol…

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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) 1.83 5.61 -53.21 0 6 -1 87 303.077 2 ↓

Analogs

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Popular Name: 2-(3,5-dioxomorpholin-4-yl)-6-fluoro-benzoic 2-(3,5-dioxomorpholin-4-yl)-6-fl…

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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) 0.17 4.32 -65.66 0 6 -1 87 252.177 2 ↓

Analogs

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Popular Name: 5-chloro-4-(3,5-dioxomorpholin-4-yl)-2-methoxy-benzoic 5-chloro-4-(3,5-dioxomorpholin-4…

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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) 1.11 4.7 -60.21 0 7 -1 96 298.658 3 ↓

Analogs

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Popular Name: (E)-3-[4-(3,5-dioxomorpholin-4-yl)phenyl]prop-2-enoic (E)-3-[4-(3,5-dioxomorpholin-4-y…

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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) 0.50 5.08 -56.93 0 6 -1 87 260.225 3 ↓

Analogs

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Popular Name: 5-(3,5-dioxomorpholin-4-yl)benzene-1,3-dicarboxylic 5-(3,5-dioxomorpholin-4-yl)benze…

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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) 0.28 4.35 -121.02 0 8 -2 127 277.188 3 ↓

Analogs

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Popular Name: 4-(3,5-dioxomorpholin-4-yl)-3-nitro-benzoic 4-(3,5-dioxomorpholin-4-yl)-3-ni…

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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) 0.33 4.93 -54.05 0 9 -1 133 279.184 3 ↓

Analogs

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Popular Name: 3-(3,5-dioxomorpholin-4-yl)-4-fluoro-benzoic 3-(3,5-dioxomorpholin-4-yl)-4-fl…

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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) 0.53 3.95 -54.37 0 6 -1 87 252.177 2 ↓

Analogs

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Popular Name: 5-(3,5-dioxomorpholin-4-yl)-2-fluoro-benzoic 5-(3,5-dioxomorpholin-4-yl)-2-fl…

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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) 0.19 3.82 -62.97 0 6 -1 87 252.177 2 ↓

Analogs

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Popular Name: 5-(3,5-dioxomorpholin-4-yl)-2,4-difluoro-benzoic 5-(3,5-dioxomorpholin-4-yl)-2,4-…

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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) 0.28 3.97 -54.56 0 6 -1 87 270.167 2 ↓

Analogs

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Popular Name: 2-chloro-5-(3,5-dioxomorpholin-4-yl)benzoic 2-chloro-5-(3,5-dioxomorpholin-4…

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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) 0.71 4.18 -59.55 0 6 -1 87 268.632 2 ↓

Analogs

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Popular Name: 4-bromo-2-(3,5-dioxomorpholin-4-yl)benzoic 4-bromo-2-(3,5-dioxomorpholin-4-…

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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) 1.36 4.91 -56 0 6 -1 87 313.083 2 ↓

Analogs

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Popular Name: 3-(3,5-dioxomorpholin-4-yl)-5-(trifluoromethyl)benzoic 3-(3,5-dioxomorpholin-4-yl)-5-(t…

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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) 1.26 4.8 -52.7 0 6 -1 87 302.184 3 ↓

Parameters Provided:

ring.id = 282346
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 = 282346 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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