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Popular Name: (5R)-5-(bromomethyl)-N-methyl-N-[(4-methylthiazol-5-yl)methyl]-4,5-dihydrothiazol-2-amine (5R)-5-(bromomethyl)-N-methyl-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) 2.15 6.11 -33.42 1 3 1 30 321.289 4 ↓
Hi High (pH 8-9.5) 2.15 6.35 -7.67 0 3 0 28 320.281 4 ↓

Analogs

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Popular Name: (5S)-5-(bromomethyl)-N-methyl-N-[(4-methylthiazol-5-yl)methyl]-4,5-dihydrothiazol-2-amine (5S)-5-(bromomethyl)-N-methyl-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) 2.15 6.11 -33.79 1 3 1 30 321.289 4 ↓
Hi High (pH 8-9.5) 2.15 6.35 -7.59 0 3 0 28 320.281 4 ↓

Analogs

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Popular Name: N-[(1R)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4,5-dihydrothiazol-2-amine N-[(1R)-1-(2,4-dimethylthiazol-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) 1.46 4.68 -30.93 2 3 1 39 242.393 3 ↓
Hi High (pH 8-9.5) 1.46 3.81 -9.59 1 3 0 37 241.385 2 ↓
Hi High (pH 8-9.5) 1.46 4.67 -31.02 2 3 1 39 242.393 2 ↓

Analogs

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Popular Name: N-[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4,5-dihydrothiazol-2-amine N-[(1S)-1-(2,4-dimethylthiazol-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) 1.46 4.69 -31 2 3 1 39 242.393 3 ↓
Hi High (pH 8-9.5) 1.46 4.7 -30.84 2 3 1 39 242.393 2 ↓
Hi High (pH 8-9.5) 1.46 3.82 -9.62 1 3 0 37 241.385 2 ↓

Analogs

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Popular Name: (4R)-N-[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4-ethyl-4,5-dihydrothiazol-2-amine (4R)-N-[(1S)-1-(2,4-dimethylthia…

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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) 2.32 6.21 -29.3 2 3 1 39 270.447 4 ↓
Hi High (pH 8-9.5) 2.32 5.23 -8.02 1 3 0 37 269.439 3 ↓

Analogs

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Popular Name: (4S)-N-[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4-ethyl-4,5-dihydrothiazol-2-amine (4S)-N-[(1S)-1-(2,4-dimethylthia…

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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) 2.32 6.21 -29.33 2 3 1 39 270.447 4 ↓
Hi High (pH 8-9.5) 2.32 5.23 -8.13 1 3 0 37 269.439 3 ↓

Analogs

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Popular Name: (4R)-N-[(1R)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4-ethyl-4,5-dihydrothiazol-2-amine (4R)-N-[(1R)-1-(2,4-dimethylthia…

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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) 2.32 6.22 -29.32 2 3 1 39 270.447 4 ↓
Hi High (pH 8-9.5) 2.32 5.24 -8.13 1 3 0 37 269.439 3 ↓

Analogs

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Popular Name: (4S)-N-[(1R)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4-ethyl-4,5-dihydrothiazol-2-amine (4S)-N-[(1R)-1-(2,4-dimethylthia…

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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) 2.32 6.22 -29.26 2 3 1 39 270.447 4 ↓
Hi High (pH 8-9.5) 2.32 5.24 -8 1 3 0 37 269.439 3 ↓

Analogs

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Popular Name: N-[(1R)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4,4-dimethyl-5H-thiazol-2-amine N-[(1R)-1-(2,4-dimethylthiazol-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) 2.27 6.05 -28.31 2 3 1 39 270.447 3 ↓
Hi High (pH 8-9.5) 2.27 5.78 -27.6 2 3 1 39 270.447 2 ↓

Analogs

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Popular Name: N-[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4,4-dimethyl-5H-thiazol-2-amine N-[(1S)-1-(2,4-dimethylthiazol-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) 2.27 6.06 -28.36 2 3 1 39 270.447 3 ↓
Hi High (pH 8-9.5) 2.27 5.78 -27.62 2 3 1 39 270.447 2 ↓

Analogs

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Popular Name: (5S)-N-[(1R)-1-(2,4-dimethylthiazol-5-yl)ethyl]-5-methyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1R)-1-(2,4-dimethylthia…

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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 5.38 -29.88 2 3 1 39 256.42 3 ↓
Hi High (pH 8-9.5) 1.82 4.55 -6.16 1 3 0 37 255.412 3 ↓

Analogs

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Popular Name: (5S)-N-[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]-5-methyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1S)-1-(2,4-dimethylthia…

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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 5.39 -29.97 2 3 1 39 256.42 3 ↓
Hi High (pH 8-9.5) 1.82 4.57 -6.1 1 3 0 37 255.412 3 ↓

Analogs

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Popular Name: (5R)-N-[(1R)-1-(2,4-dimethylthiazol-5-yl)ethyl]-5-methyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1R)-1-(2,4-dimethylthia…

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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 5.38 -30.19 2 3 1 39 256.42 3 ↓
Hi High (pH 8-9.5) 1.82 4.55 -6.14 1 3 0 37 255.412 3 ↓

Analogs

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Popular Name: (5R)-N-[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]-5-methyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1S)-1-(2,4-dimethylthia…

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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 5.39 -30.18 2 3 1 39 256.42 3 ↓
Hi High (pH 8-9.5) 1.82 4.57 -6.12 1 3 0 37 255.412 3 ↓

Analogs

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Popular Name: (4R)-N-[(1R)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4-methyl-4,5-dihydrothiazol-2-amine (4R)-N-[(1R)-1-(2,4-dimethylthia…

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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 5.42 -29.71 2 3 1 39 256.42 3 ↓

Analogs

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Popular Name: (4R)-N-[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4-methyl-4,5-dihydrothiazol-2-amine (4R)-N-[(1S)-1-(2,4-dimethylthia…

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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 5.43 -29.84 2 3 1 39 256.42 3 ↓

Analogs

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Popular Name: (4S)-N-[(1R)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4-methyl-4,5-dihydrothiazol-2-amine (4S)-N-[(1R)-1-(2,4-dimethylthia…

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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 5.41 -29.38 2 3 1 39 256.42 3 ↓

Analogs

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Popular Name: (4S)-N-[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4-methyl-4,5-dihydrothiazol-2-amine (4S)-N-[(1S)-1-(2,4-dimethylthia…

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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 5.42 -29.45 2 3 1 39 256.42 3 ↓

Analogs

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Popular Name: (4R)-N-[(1R)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4-isobutyl-4,5-dihydrothiazol-2-amine (4R)-N-[(1R)-1-(2,4-dimethylthia…

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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) 3.10 7.48 -30.03 2 3 1 39 298.501 5 ↓

Analogs

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Popular Name: (4R)-N-[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4-isobutyl-4,5-dihydrothiazol-2-amine (4R)-N-[(1S)-1-(2,4-dimethylthia…

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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) 3.10 7.49 -29.96 2 3 1 39 298.501 5 ↓

Analogs

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Popular Name: (4S)-N-[(1R)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4-isobutyl-4,5-dihydrothiazol-2-amine (4S)-N-[(1R)-1-(2,4-dimethylthia…

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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) 3.10 7.5 -30.03 2 3 1 39 298.501 5 ↓

Analogs

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Popular Name: (4S)-N-[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]-4-isobutyl-4,5-dihydrothiazol-2-amine (4S)-N-[(1S)-1-(2,4-dimethylthia…

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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) 3.10 7.51 -29.97 2 3 1 39 298.501 5 ↓

Analogs

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Popular Name: N-[(2-methylthiazol-5-yl)methyl]-4,5-dihydrothiazol-2-amine N-[(2-methylthiazol-5-yl)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 3.46 -30.83 2 3 1 39 214.339 3 ↓
Hi High (pH 8-9.5) 0.68 2.28 -8.82 1 3 0 37 213.331 2 ↓
Hi High (pH 8-9.5) 0.68 3.31 -29.95 2 3 1 39 214.339 2 ↓

Analogs

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Popular Name: (4R)-4-ethyl-N-[(2-methylthiazol-5-yl)methyl]-4,5-dihydrothiazol-2-amine (4R)-4-ethyl-N-[(2-methylthiazol…

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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) 1.54 4.98 -29.35 2 3 1 39 242.393 4 ↓
Hi High (pH 8-9.5) 1.54 3.93 -8.05 1 3 0 37 241.385 3 ↓
Hi High (pH 8-9.5) 1.54 4.95 -29.32 2 3 1 39 242.393 3 ↓

Analogs

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Popular Name: (4S)-4-ethyl-N-[(2-methylthiazol-5-yl)methyl]-4,5-dihydrothiazol-2-amine (4S)-4-ethyl-N-[(2-methylthiazol…

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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) 1.54 4.98 -29.37 2 3 1 39 242.393 4 ↓
Hi High (pH 8-9.5) 1.54 3.93 -8.05 1 3 0 37 241.385 3 ↓
Hi High (pH 8-9.5) 1.54 4.95 -29.33 2 3 1 39 242.393 3 ↓

Analogs

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Popular Name: (4R)-4-methyl-N-[(2-methylthiazol-5-yl)methyl]-4,5-dihydrothiazol-2-amine (4R)-4-methyl-N-[(2-methylthiazo…

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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) 1.01 4.19 -29.79 2 3 1 39 228.366 3 ↓
Hi High (pH 8-9.5) 1.01 4.14 -29.2 2 3 1 39 228.366 2 ↓

Analogs

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Popular Name: (4S)-4-methyl-N-[(2-methylthiazol-5-yl)methyl]-4,5-dihydrothiazol-2-amine (4S)-4-methyl-N-[(2-methylthiazo…

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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) 1.01 4.18 -29.37 2 3 1 39 228.366 3 ↓
Hi High (pH 8-9.5) 1.01 4.11 -29.29 2 3 1 39 228.366 2 ↓

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
page.num = 1

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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 = 444401 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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