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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: (4,4-dioxido-1H-4,1,2-benzothiadiazin-3-yl)(pyrrolidin-1-yl)methanone (4,4-dioxido-1H-4,1,2-benzothiad…

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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) 2.10 1.67 -20.67 1 6 0 79 279.321 1 ↓

Analogs

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Popular Name: 7-methyl-3-(morpholine-4-carbonyl)-1H-4(lambda6),1,2-benzothiadiazine-4,4-dione 7-methyl-3-(morpholine-4-carbony…

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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) 1.97 0.63 -18.98 1 7 0 88 309.347 1 ↓

Analogs

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Popular Name: 3-(azepan-1-ylcarbonyl)-7-methyl-1H-4,1,2-benzothiadiazine 4,4-dioxide 3-(azepan-1-ylcarbonyl)-7-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) 3.54 4.52 -19.43 1 6 0 79 321.402 1 ↓

Analogs

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Popular Name: (1-methyl-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl)-(1-piperidyl)methanone (1-methyl-4,4-dioxo-benzo[e][1,3…

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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) 1.32 3.45 -21.8 0 6 0 70 307.375 1 ↓

Analogs

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Popular Name: azepan-1-yl-(1-isopentyl-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl)methanone azepan-1-yl-(1-isopentyl-4,4-dio…

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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) 3.48 7.5 -20.31 0 6 0 70 377.51 4 ↓

Analogs

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Popular Name: (1-isopropyl-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl)-morpholino-methanone (1-isopropyl-4,4-dioxo-benzo[e][…

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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 2.51 -20.98 0 7 0 79 337.401 2 ↓

Analogs

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Popular Name: 6-methyl-4,4-dioxo-1-(p-tolyl)benzo[e][1,3,4]thiadiazine-3-carbonitrile 6-methyl-4,4-dioxo-1-(p-tolyl)be…

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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) 3.42 6 -10.94 0 5 0 74 311.366 1 ↓

Analogs

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Popular Name: [6-fluoro-4,4-dioxo-1-(p-tolyl)benzo[e][1,3,4]thiadiazin-3-yl]-morpholino-methanone [6-fluoro-4,4-dioxo-1-(p-tolyl)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) 2.54 5.05 -16.62 0 7 0 79 403.435 2 ↓

Analogs

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Popular Name: 6-fluoro-4,4-dioxo-1-(p-tolyl)-N-[[(2S)-tetrahydrofuran-2-yl]methyl]benzo[e][1,3,4]thiadiazine-3-car 6-fluoro-4,4-dioxo-1-(p-tolyl)-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) 2.83 4.53 -15.88 1 7 0 88 417.462 4 ↓
Hi High (pH 8-9.5) 3.01 2.32 -62.67 0 7 -1 94 416.454 4 ↓

Analogs

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Popular Name: 6-fluoro-4,4-dioxo-1-(p-tolyl)-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzo[e][1,3,4]thiadiazine-3-car 6-fluoro-4,4-dioxo-1-(p-tolyl)-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) 2.83 4.56 -15.95 1 7 0 88 417.462 4 ↓
Hi High (pH 8-9.5) 3.01 2.33 -64.55 0 7 -1 94 416.454 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) 0.68 3.7 -23.61 0 8 0 96 351.384 4 ↓

Analogs

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Popular Name: isopropyl isopropyl

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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 5.35 -22.94 0 8 0 96 379.438 5 ↓

Analogs

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Popular Name: (1-benzyl-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl)-pyrrolidin-1-yl-methanone (1-benzyl-4,4-dioxo-benzo[e][1,3…

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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) 2.21 6.44 -24.15 0 6 0 70 369.446 3 ↓

Analogs

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Popular Name: [1-(o-tolylmethyl)-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-(o-tolylmethyl)-4,4-dioxo-ben…

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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) 2.61 6.68 -24.22 0 6 0 70 383.473 3 ↓

Analogs

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Popular Name: [1-(m-tolylmethyl)-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-(m-tolylmethyl)-4,4-dioxo-ben…

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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) 2.64 7.11 -24.17 0 6 0 70 383.473 3 ↓

Analogs

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Popular Name: [4,4-dioxo-1-[(4-vinylphenyl)methyl]benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [4,4-dioxo-1-[(4-vinylphenyl)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) 3.06 7.53 -24.86 0 6 0 70 395.484 4 ↓

Analogs

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Popular Name: [1-[(3-methoxyphenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(3-methoxyphenyl)methyl]-4,4…

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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) 2.25 5.74 -26.77 0 7 0 79 399.472 4 ↓

Analogs

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Popular Name: [1-[(2-fluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(2-fluorophenyl)methyl]-4,4-…

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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 6.34 -22.88 0 6 0 70 387.436 3 ↓

Analogs

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Popular Name: [1-[(3-fluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(3-fluorophenyl)methyl]-4,4-…

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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) 2.35 6.49 -26.89 0 6 0 70 387.436 3 ↓

Analogs

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Popular Name: [1-[(4-fluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(4-fluorophenyl)methyl]-4,4-…

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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) 2.38 6.49 -26.4 0 6 0 70 387.436 3 ↓

Analogs

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Popular Name: [1-[(3,5-difluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(3,5-difluorophenyl)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) 2.47 6.54 -26.18 0 6 0 70 405.426 3 ↓

Analogs

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Popular Name: [1-[(2-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(2-chlorophenyl)methyl]-4,4-…

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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) 2.84 6.52 -22.23 0 6 0 70 403.891 3 ↓

Analogs

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Popular Name: [1-[(3-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(3-chlorophenyl)methyl]-4,4-…

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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) 2.87 6.92 -25.87 0 6 0 70 403.891 3 ↓

Analogs

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Popular Name: [1-[(4-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(4-chlorophenyl)methyl]-4,4-…

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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) 2.89 6.94 -25.54 0 6 0 70 403.891 3 ↓

Analogs

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Popular Name: [1-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin [1-[(3-cyclopropyl-1,2,4-oxadiaz…

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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 3.53 -27.44 0 9 0 109 401.448 4 ↓

Analogs

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Popular Name: [1-[(4-fluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(1-piperidyl)methanone [1-[(4-fluorophenyl)methyl]-4,4-…

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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) 2.88 7.25 -23.43 0 6 0 70 401.463 3 ↓

Analogs

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Popular Name: [1-[(3,5-difluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(1-piperidyl)methanone [1-[(3,5-difluorophenyl)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) 2.97 7.31 -22.83 0 6 0 70 419.453 3 ↓

Analogs

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Popular Name: [1-[(2-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(1-piperidyl)methanone [1-[(2-chlorophenyl)methyl]-4,4-…

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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) 3.35 7.31 -21.92 0 6 0 70 417.918 3 ↓

Analogs

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Popular Name: [1-[(3-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(1-piperidyl)methanone [1-[(3-chlorophenyl)methyl]-4,4-…

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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) 3.37 7.68 -22.4 0 6 0 70 417.918 3 ↓

Analogs

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Popular Name: [1-[(4-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(1-piperidyl)methanone [1-[(4-chlorophenyl)methyl]-4,4-…

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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) 3.40 7.69 -22.65 0 6 0 70 417.918 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) 2.05 5.92 -21.75 0 9 0 109 431.47 5 ↓

Analogs

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Popular Name: [1-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(1-piperid [1-[(3-cyclopropyl-1,2,4-oxadiaz…

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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) 1.16 4.35 -23.76 0 9 0 109 415.475 4 ↓

Analogs

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Popular Name: (1-ethyl-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl)-(4-methyl-1-piperidyl)methanone (1-ethyl-4,4-dioxo-benzo[e][1,3,…

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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) 1.94 4.78 -20.65 0 6 0 70 335.429 2 ↓

Analogs

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Popular Name: (1-benzyl-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl)-(4-methyl-1-piperidyl)methanone (1-benzyl-4,4-dioxo-benzo[e][1,3…

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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) 2.96 8.02 -22.89 0 6 0 70 397.5 3 ↓

Analogs

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Popular Name: (4-methyl-1-piperidyl)-[1-(m-tolylmethyl)-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]methanone (4-methyl-1-piperidyl)-[1-(m-tol…

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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 8.71 -23 0 6 0 70 411.527 3 ↓

Analogs

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Popular Name: 3-[[3-(4-methylpiperidine-1-carbonyl)-4,4-dioxo-benzo[e][1,3,4]thiadiazin-1-yl]methyl]benzonitrile 3-[[3-(4-methylpiperidine-1-carb…

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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) 2.69 8.4 -27.34 0 7 0 94 422.51 3 ↓

Analogs

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Popular Name: [1-[(2-fluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(4-methyl-1-piperidyl)methanon [1-[(2-fluorophenyl)methyl]-4,4-…

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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) 3.07 7.89 -21.88 0 6 0 70 415.49 3 ↓

Analogs

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Popular Name: [1-[(2-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(4-methyl-1-piperidyl)methanon [1-[(2-chlorophenyl)methyl]-4,4-…

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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) 3.59 8.07 -21.19 0 6 0 70 431.945 3 ↓

Analogs

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Popular Name: [1-[(3-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(4-methyl-1-piperidyl)methanon [1-[(3-chlorophenyl)methyl]-4,4-…

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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) 3.61 8.53 -23.61 0 6 0 70 431.945 3 ↓

Analogs

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Popular Name: [1-[(4-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(4-methyl-1-piperidyl)methanon [1-[(4-chlorophenyl)methyl]-4,4-…

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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) 3.64 8.54 -24.62 0 6 0 70 431.945 3 ↓

Analogs

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Popular Name: [1-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(4-methyl- [1-[(3-cyclopropyl-1,2,4-oxadiaz…

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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) 1.40 4.99 -21.15 0 9 0 109 429.502 4 ↓

Analogs

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Popular Name: azepan-1-yl-(4,4-dioxo-1-phenethyl-benzo[e][1,3,4]thiadiazin-3-yl)methanone azepan-1-yl-(4,4-dioxo-1-pheneth…

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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) 3.63 9.25 -21.51 0 6 0 70 411.527 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) 1.69 5.74 -22.26 0 8 0 96 379.438 4 ↓

Analogs

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Popular Name: azepan-1-yl-[1-(o-tolylmethyl)-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]methanone azepan-1-yl-[1-(o-tolylmethyl)-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) 3.62 8.64 -17.93 0 6 0 70 411.527 3 ↓

Analogs

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Popular Name: azepan-1-yl-[1-(m-tolylmethyl)-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]methanone azepan-1-yl-[1-(m-tolylmethyl)-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) 3.65 8.86 -23.81 0 6 0 70 411.527 3 ↓

Analogs

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Popular Name: azepan-1-yl-[4,4-dioxo-1-(p-tolylmethyl)benzo[e][1,3,4]thiadiazin-3-yl]methanone azepan-1-yl-[4,4-dioxo-1-(p-toly…

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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) 3.67 8.87 -23.94 0 6 0 70 411.527 3 ↓

Analogs

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Popular Name: azepan-1-yl-[1-[(3-methoxyphenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]methanone azepan-1-yl-[1-[(3-methoxyphenyl…

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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) 3.26 7.49 -25.91 0 7 0 79 427.526 4 ↓

Analogs

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Popular Name: azepan-1-yl-[1-[(2-fluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]methanone azepan-1-yl-[1-[(2-fluorophenyl)…

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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 8.07 -22.68 0 6 0 70 415.49 3 ↓

Analogs

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Popular Name: azepan-1-yl-[1-[(3-fluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]methanone azepan-1-yl-[1-[(3-fluorophenyl)…

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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) 3.36 8.67 -26.17 0 6 0 70 415.49 3 ↓

Analogs

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Popular Name: azepan-1-yl-[1-[(2-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]methanone azepan-1-yl-[1-[(2-chlorophenyl)…

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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) 3.85 8.59 -20.41 0 6 0 70 431.945 3 ↓

Parameters Provided:

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Structural Results Found: (before additional filtering)

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