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Analogs

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Popular Name: 5-chloro-2-methoxy-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]benzamide 5-chloro-2-methoxy-N-[3-[3-(trif…

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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) 5.04 10.19 -10.83 1 3 0 38 367.754 4 ↓

Analogs

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Popular Name: 4-methyl-3-nitro-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]benzamide 4-methyl-3-nitro-N-[3-[3-(triflu…

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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) 4.16 10.28 -16.34 1 5 0 75 362.307 4 ↓

Analogs

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Popular Name: 2-bromo-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]benzamide 2-bromo-N-[3-[3-(trifluoromethyl…

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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) 4.59 9.72 -10.47 1 2 0 29 382.179 3 ↓

Analogs

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Popular Name: 2,4-dichloro-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]benzamide 2,4-dichloro-N-[3-[3-(trifluorom…

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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) 5.11 10.11 -9.93 1 2 0 29 372.173 3 ↓

Analogs

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Popular Name: 3-(difluoromethoxy)-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]benzamide 3-(difluoromethoxy)-N-[3-[3-(tri…

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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) 4.42 8.66 -12.55 1 3 0 38 369.289 5 ↓

Analogs

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Popular Name: 3-iodo-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]benzamide 3-iodo-N-[3-[3-(trifluoromethyl)…

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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) 4.89 10.18 -10.3 1 2 0 29 429.179 3 ↓

Analogs

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Popular Name: 2-chloro-4-nitro-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]benzamide 2-chloro-4-nitro-N-[3-[3-(triflu…

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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) 4.39 10.27 -12.64 1 5 0 75 382.725 4 ↓

Analogs

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Popular Name: 2,3-dichloro-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]benzamide 2,3-dichloro-N-[3-[3-(trifluorom…

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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) 5.09 10.04 -13.46 1 2 0 29 372.173 3 ↓

Analogs

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Popular Name: 3-chloro-4-ethoxy-5-methoxy-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]benzamide 3-chloro-4-ethoxy-5-methoxy-N-[3…

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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) 4.65 9.91 -9.92 1 4 0 48 411.807 6 ↓

Analogs

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Popular Name: 4-bromo-3-(dimethylsulfamoyl)-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]benzamide 4-bromo-3-(dimethylsulfamoyl)-N-…

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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) 3.88 7.53 -16.25 1 5 0 66 489.313 5 ↓

Analogs

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Popular Name: 2,4-difluoro-N-(3-phenylprop-2-ynyl)benzamide 2,4-difluoro-N-(3-phenylprop-2-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) 3.21 8.24 -10.13 1 2 0 29 271.266 2 ↓

Analogs

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Popular Name: 4-methoxy-N-(3-phenylprop-2-ynyl)benzamide 4-methoxy-N-(3-phenylprop-2-ynyl…

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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) 3.01 7.4 -8.7 1 3 0 38 265.312 3 ↓

Analogs

25071729
25071729
25253564
25253564
39126060
39126060

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Popular Name: N-(3-phenylprop-2-ynyl)benzamide N-(3-phenylprop-2-ynyl)benzamide

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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) 2.96 8.09 -8.27 1 2 0 29 235.286 2 ↓

Analogs

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Popular Name: N-isobutyl-2-methyl-N-(3-phenylprop-2-ynyl)-5-sulfamoyl-benzamide N-isobutyl-2-methyl-N-(3-phenylp…

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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 7.87 -17.26 2 5 0 80 384.501 5 ↓

Analogs

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Popular Name: 3,5-dihydroxy-4-methyl-N-(3-phenylprop-2-ynyl)-N-propyl-benzamide 3,5-dihydroxy-4-methyl-N-(3-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) 3.89 6.63 -10.46 2 4 0 61 323.392 4 ↓

Analogs

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Popular Name: N-butyl-3-cyano-N-(3-phenylprop-2-ynyl)benzamide N-butyl-3-cyano-N-(3-phenylprop-…

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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) 3.90 12.67 -11.31 0 3 0 44 316.404 5 ↓

Analogs

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Popular Name: 4-(hydroxymethyl)-N-(3-phenylprop-2-ynyl)-N-propyl-benzamide 4-(hydroxymethyl)-N-(3-phenylpro…

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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 8.84 -10.96 1 3 0 41 307.393 5 ↓

Analogs

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Popular Name: 2-cyano-N-isobutyl-N-(3-phenylprop-2-ynyl)benzamide 2-cyano-N-isobutyl-N-(3-phenylpr…

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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) 3.56 12.28 -15.28 0 3 0 44 316.404 4 ↓

Analogs

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Popular Name: 3-bromo-4-iodo-N-(3-phenylprop-2-ynyl)benzamide 3-bromo-4-iodo-N-(3-phenylprop-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) 4.78 9.7 -7.82 1 2 0 29 440.078 2 ↓

Analogs

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Popular Name: 5-bromo-2-iodo-N-(3-phenylprop-2-ynyl)benzamide 5-bromo-2-iodo-N-(3-phenylprop-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) 4.78 9.79 -6.18 1 2 0 29 440.078 2 ↓

Analogs

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Popular Name: 2,3-dimethyl-N-(3-phenylprop-2-ynyl)benzamide 2,3-dimethyl-N-(3-phenylprop-2-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) 3.76 9.33 -7.63 1 2 0 29 263.34 2 ↓

Analogs

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Popular Name: 2-chloro-6-hydroxy-N-(3-phenylprop-2-ynyl)benzamide 2-chloro-6-hydroxy-N-(3-phenylpr…

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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) 3.53 5.59 -9.7 2 3 0 49 285.73 2 ↓
Hi High (pH 8-9.5) 3.53 6.36 -46.15 1 3 -1 52 284.722 2 ↓

Analogs

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Popular Name: 4-bromo-2-chloro-N-(3-phenylprop-2-ynyl)benzamide 4-bromo-2-chloro-N-(3-phenylprop…

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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) 4.37 9.22 -8.03 1 2 0 29 348.627 2 ↓

Analogs

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Popular Name: 4-chloro-3-iodo-N-(3-phenylprop-2-ynyl)benzamide 4-chloro-3-iodo-N-(3-phenylprop-…

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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) 4.64 9.62 -8.1 1 2 0 29 395.627 2 ↓

Analogs

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Popular Name: 2-hydroxy-5-methyl-N-(3-phenylprop-2-ynyl)benzamide 2-hydroxy-5-methyl-N-(3-phenylpr…

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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) 3.87 7.31 -10 2 3 0 49 265.312 2 ↓
Hi High (pH 8-9.5) 3.87 8.32 -54.43 1 3 -1 52 264.304 2 ↓

Analogs

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Popular Name: 2-hydroxy-4-methyl-N-(3-phenylprop-2-ynyl)benzamide 2-hydroxy-4-methyl-N-(3-phenylpr…

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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) 3.87 7.31 -10.2 2 3 0 49 265.312 2 ↓
Hi High (pH 8-9.5) 3.87 8.31 -55.37 1 3 -1 52 264.304 2 ↓

Analogs

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Popular Name: 3-methyl-N-(3-phenylprop-2-ynyl)benzamide 3-methyl-N-(3-phenylprop-2-ynyl)…

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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) 3.38 8.76 -8.55 1 2 0 29 249.313 2 ↓

Analogs

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Popular Name: 3-chloro-4-hydroxy-N-(3-phenylprop-2-ynyl)benzamide 3-chloro-4-hydroxy-N-(3-phenylpr…

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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 5.8 -9.94 2 3 0 49 285.73 2 ↓
Hi High (pH 8-9.5) 3.34 6.58 -40.91 1 3 -1 52 284.722 2 ↓

Analogs

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Popular Name: 2-hydroxy-N-(3-phenylprop-2-ynyl)benzamide 2-hydroxy-N-(3-phenylprop-2-ynyl…

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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 6.63 -10.24 2 3 0 49 251.285 2 ↓
Hi High (pH 8-9.5) 3.44 7.64 -53.78 1 3 -1 52 250.277 2 ↓

Analogs

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Popular Name: 2-fluoro-6-methoxy-N-(3-phenylprop-2-ynyl)-N-propyl-benzamide 2-fluoro-6-methoxy-N-(3-phenylpr…

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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) 3.73 11.21 -15.6 0 3 0 30 325.383 5 ↓

Analogs

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Popular Name: 4-bromo-3-fluoro-N-(3-phenylprop-2-ynyl)benzamide 4-bromo-3-fluoro-N-(3-phenylprop…

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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) 3.86 8.76 -8.58 1 2 0 29 332.172 2 ↓

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filter.purchasability = annotated
page.format = targets
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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 = 95615 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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