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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 3-(4-oxocinnolin-1-yl)-N-(3,4,5-trimethoxyphenyl)propanamide 3-(4-oxocinnolin-1-yl)-N-(3,4,5-…

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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) 1.11 6.21 -19.07 1 8 0 92 383.404 7 ↓

Analogs

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Popular Name: N-(2-methoxy-5-nitro-phenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(2-methoxy-5-nitro-phenyl)-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) 1.42 7.21 -18.57 1 9 0 119 368.349 6 ↓

Analogs

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Popular Name: N-[4-(difluoromethylsulfanyl)phenyl]-3-(4-oxocinnolin-1-yl)propanamide N-[4-(difluoromethylsulfanyl)phe…

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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) 2.47 8.37 -16.16 1 5 0 64 375.4 6 ↓

Analogs

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Popular Name: N-(4-methyl-3-nitro-phenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(4-methyl-3-nitro-phenyl)-3-(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) 1.82 8.42 -16.6 1 8 0 110 352.35 5 ↓

Analogs

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Popular Name: butyl butyl

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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) 3.09 10.24 -16.62 1 7 0 90 393.443 9 ↓

Analogs

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Popular Name: N-(2-bromophenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(2-bromophenyl)-3-(4-oxocinnol…

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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) 2.24 7.85 -12.36 1 5 0 64 372.222 4 ↓

Analogs

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Popular Name: N-(2-methyl-5-nitro-phenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(2-methyl-5-nitro-phenyl)-3-(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) 1.82 8.68 -20.85 1 8 0 110 352.35 5 ↓

Analogs

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Popular Name: N-(3,4-dichlorophenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(3,4-dichlorophenyl)-3-(4-oxoc…

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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) 2.76 8.06 -15.38 1 5 0 64 362.216 4 ↓

Analogs

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Popular Name: N-(3-acetamidophenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(3-acetamidophenyl)-3-(4-oxoci…

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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) 0.68 5.99 -19.1 2 7 0 93 350.378 5 ↓

Analogs

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Popular Name: N-(2,4-dichlorophenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(2,4-dichlorophenyl)-3-(4-oxoc…

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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) 2.76 8.22 -12.05 1 5 0 64 362.216 4 ↓

Analogs

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Popular Name: N-(3,5-dichlorophenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(3,5-dichlorophenyl)-3-(4-oxoc…

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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) 2.76 8.11 -13.58 1 5 0 64 362.216 4 ↓

Analogs

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Popular Name: N-(4-fluoro-3-nitro-phenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(4-fluoro-3-nitro-phenyl)-3-(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) 1.53 7.82 -22.9 1 8 0 110 356.313 5 ↓

Analogs

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Popular Name: N-(2,5-dimethoxyphenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(2,5-dimethoxyphenyl)-3-(4-oxo…

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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) 1.52 5.78 -15.42 1 7 0 82 353.378 6 ↓

Analogs

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Popular Name: N-(3,4-dimethoxyphenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(3,4-dimethoxyphenyl)-3-(4-oxo…

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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) 1.13 6.28 -17.08 1 7 0 82 353.378 6 ↓

Analogs

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Popular Name: N-(2-methyl-3-nitro-phenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(2-methyl-3-nitro-phenyl)-3-(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) 1.79 8.57 -16.88 1 8 0 110 352.35 5 ↓

Analogs

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Popular Name: 3-(4-oxocinnolin-1-yl)-N-[4-(trifluoromethylsulfanyl)phenyl]propanamide 3-(4-oxocinnolin-1-yl)-N-[4-(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) 5.46 8.57 -14.75 1 5 0 64 393.39 6 ↓

Analogs

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Popular Name: N-[4-(diethylamino)phenyl]-3-(4-oxocinnolin-1-yl)propanamide N-[4-(diethylamino)phenyl]-3-(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) 2.33 9.48 -90.29 2 6 0 68 365.457 7 ↓
Mid Mid (pH 6-8) 2.33 9.37 -13.73 1 6 0 67 364.449 7 ↓

Analogs

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Popular Name: N-(2-isopropyl-6-methyl-phenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(2-isopropyl-6-methyl-phenyl)-…

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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) 1.94 10.16 -12.94 1 5 0 64 349.434 5 ↓

Analogs

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Popular Name: N-isobutyl-2-[3-(4-oxocinnolin-1-yl)propanoylamino]benzamide N-isobutyl-2-[3-(4-oxocinnolin-1…

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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) 1.75 8.24 -14.62 2 7 0 93 392.459 7 ↓

Analogs

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Popular Name: N-(5-chloro-2,4-dimethoxy-phenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(5-chloro-2,4-dimethoxy-phenyl…

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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) 2.13 6.35 -15.65 1 7 0 82 387.823 6 ↓

Analogs

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Popular Name: propyl propyl

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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) 2.53 9.46 -16.74 1 7 0 90 379.416 8 ↓

Analogs

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Popular Name: N-(3-chloro-2,6-diethyl-phenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(3-chloro-2,6-diethyl-phenyl)-…

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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) 2.91 10.55 -13.27 1 5 0 64 383.879 6 ↓

Analogs

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Popular Name: N,N-diethyl-3-[3-(4-oxocinnolin-1-yl)propanoylamino]benzamide N,N-diethyl-3-[3-(4-oxocinnolin-…

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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) 1.18 8.83 -21.28 1 7 0 84 392.459 7 ↓

Analogs

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Popular Name: N-ethyl-3-[3-(4-oxocinnolin-1-yl)propanoylamino]benzamide N-ethyl-3-[3-(4-oxocinnolin-1-yl…

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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) 1.02 6.19 -21.95 2 7 0 93 364.405 6 ↓

Analogs

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Popular Name: N-methyl-4-[3-(4-oxocinnolin-1-yl)propanoylamino]benzamide N-methyl-4-[3-(4-oxocinnolin-1-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) 0.67 5.36 -19.55 2 7 0 93 350.378 5 ↓

Analogs

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Popular Name: N-(4-bromo-2-methyl-phenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(4-bromo-2-methyl-phenyl)-3-(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) 2.67 8.58 -13.6 1 5 0 64 386.249 4 ↓

Analogs

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Popular Name: 3-(4-oxocinnolin-1-yl)-N-(2-propoxyphenyl)propanamide 3-(4-oxocinnolin-1-yl)-N-(2-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) 2.37 8.24 -12.84 1 6 0 73 351.406 7 ↓

Analogs

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Popular Name: N-methyl-3-[3-(4-oxocinnolin-1-yl)propanoylamino]benzamide N-methyl-3-[3-(4-oxocinnolin-1-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) 0.65 5.35 -22.44 2 7 0 93 350.378 5 ↓

Analogs

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Popular Name: ethyl 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) 2.00 8.64 -19.15 1 7 0 90 365.389 7 ↓

Analogs

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Popular Name: N-methyl-2-[3-(4-oxocinnolin-1-yl)propanoylamino]benzamide N-methyl-2-[3-(4-oxocinnolin-1-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) 0.62 5.89 -15.55 2 7 0 93 350.378 5 ↓

Analogs

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Popular Name: N-allyl-2-[3-(4-oxocinnolin-1-yl)propanoylamino]benzamide N-allyl-2-[3-(4-oxocinnolin-1-yl…

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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) 1.27 7.28 -14.67 2 7 0 93 376.416 7 ↓

Analogs

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Popular Name: N-(4-acetamidophenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(4-acetamidophenyl)-3-(4-oxoci…

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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) 0.70 5.99 -21.16 2 7 0 93 350.378 5 ↓

Analogs

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Popular Name: N-(4-bromophenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(4-bromophenyl)-3-(4-oxocinnol…

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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) 2.29 7.7 -13.76 1 5 0 64 372.222 4 ↓

Analogs

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Popular Name: N-(3-bromophenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(3-bromophenyl)-3-(4-oxocinnol…

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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) 2.27 7.7 -14.73 1 5 0 64 372.222 4 ↓

Analogs

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Popular Name: N-(5-chloro-2-methoxy-phenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(5-chloro-2-methoxy-phenyl)-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) 2.14 7.01 -13.81 1 6 0 73 357.797 5 ↓

Analogs

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Popular Name: 3-(4-oxocinnolin-1-yl)-N-[4-(trifluoromethoxy)phenyl]propanamide 3-(4-oxocinnolin-1-yl)-N-[4-(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) 2.45 6.87 -14.76 1 6 0 73 377.322 6 ↓

Analogs

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Popular Name: ethyl 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) 2.03 8.66 -16.99 1 7 0 90 365.389 7 ↓

Analogs

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Popular Name: N-(4-bromo-3-methyl-phenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(4-bromo-3-methyl-phenyl)-3-(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) 2.67 8.26 -13.82 1 5 0 64 386.249 4 ↓

Analogs

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Popular Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-3-(4-oxocinnolin-1-yl)propanamide N-[4-chloro-3-(trifluoromethyl)p…

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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) 2.98 8.5 -14.72 1 5 0 64 395.768 5 ↓

Analogs

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Popular Name: N-(2,4-dimethoxyphenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(2,4-dimethoxyphenyl)-3-(4-oxo…

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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) 1.52 5.79 -14.21 1 7 0 82 353.378 6 ↓

Analogs

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Popular Name: N-(2-bromo-4-methyl-phenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(2-bromo-4-methyl-phenyl)-3-(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) 2.67 8.49 -12.07 1 5 0 64 386.249 4 ↓

Analogs

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Popular Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(4-chloro-2-methoxy-5-methyl-p…

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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) 2.52 7.61 -13.1 1 6 0 73 371.824 5 ↓

Analogs

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Popular Name: N-[4-(difluoromethoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide N-[4-(difluoromethoxy)phenyl]-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) 2.09 6.65 -17.14 1 6 0 73 359.332 6 ↓

Analogs

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Popular Name: N-(4,5-dimethoxy-2-methyl-phenyl)-3-(4-oxocinnolin-1-yl)propanamide N-(4,5-dimethoxy-2-methyl-phenyl…

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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) 1.50 7.17 -17.6 1 7 0 82 367.405 6 ↓

Parameters Provided:

ring.id = 32481
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 = 32481 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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