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Analogs

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Popular Name: N4-(4,5-dihydrothiazol-2-yl)-N1,N1-dimethyl-benzene-1,4-diamine N4-(4,5-dihydrothiazol-2-yl)-N1,…

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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) 2.19 5.44 -27.56 2 3 1 29 222.337 3 ↓

Analogs

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Popular Name: N1-[(4R)-4-ethyl-4,5-dihydrothiazol-2-yl]-N4,N4-dimethyl-benzene-1,4-diamine N1-[(4R)-4-ethyl-4,5-dihydrothia…

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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 6.95 -25.64 2 3 1 29 250.391 4 ↓

Analogs

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Popular Name: N1-[(4S)-4-ethyl-4,5-dihydrothiazol-2-yl]-N4,N4-dimethyl-benzene-1,4-diamine N1-[(4S)-4-ethyl-4,5-dihydrothia…

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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 6.95 -25.61 2 3 1 29 250.391 4 ↓

Analogs

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Popular Name: N1-(4,4-dimethyl-5H-thiazol-2-yl)-N4,N4-dimethyl-benzene-1,4-diamine N1-(4,4-dimethyl-5H-thiazol-2-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) 3.00 6.79 -24.7 2 3 1 29 250.391 3 ↓

Analogs

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Popular Name: N4,N4-dimethyl-N1-[(4R)-4-methyl-4,5-dihydrothiazol-2-yl]benzene-1,4-diamine N4,N4-dimethyl-N1-[(4R)-4-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) 2.53 6.16 -26.26 2 3 1 29 236.364 3 ↓

Analogs

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Popular Name: N4,N4-dimethyl-N1-[(4S)-4-methyl-4,5-dihydrothiazol-2-yl]benzene-1,4-diamine N4,N4-dimethyl-N1-[(4S)-4-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) 2.53 6.16 -25.86 2 3 1 29 236.364 3 ↓

Analogs

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Popular Name: N4,N4-diethyl-N1-[(4R)-4-ethyl-4,5-dihydrothiazol-2-yl]benzene-1,4-diamine N4,N4-diethyl-N1-[(4R)-4-ethyl-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) 3.81 8.85 -25.05 2 3 1 29 278.445 6 ↓
Hi High (pH 8-9.5) 3.81 8 -4.82 1 3 0 28 277.437 6 ↓
Mid Mid (pH 6-8) 3.81 8.95 -27.28 3 3 0 30 279.453 6 ↓

Analogs

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Popular Name: N4,N4-diethyl-N1-[(4S)-4-ethyl-4,5-dihydrothiazol-2-yl]benzene-1,4-diamine N4,N4-diethyl-N1-[(4S)-4-ethyl-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) 3.81 8.85 -24.99 2 3 1 29 278.445 6 ↓
Hi High (pH 8-9.5) 3.81 8.01 -4.84 1 3 0 28 277.437 6 ↓
Mid Mid (pH 6-8) 3.81 8.94 -25.56 3 3 0 30 279.453 6 ↓

Analogs

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Popular Name: N4-(4,4-dimethyl-5H-thiazol-2-yl)-N1,N1-diethyl-benzene-1,4-diamine N4-(4,4-dimethyl-5H-thiazol-2-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) 3.76 8.69 -24.1 2 3 1 29 278.445 5 ↓
Hi High (pH 8-9.5) 3.76 7.82 -5.16 1 3 0 28 277.437 5 ↓
Mid Mid (pH 6-8) 3.76 8.81 -25.9 3 3 0 30 279.453 5 ↓

Analogs

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Popular Name: N1,N1-diethyl-N4-[(5S)-5-methyl-4,5-dihydrothiazol-2-yl]benzene-1,4-diamine N1,N1-diethyl-N4-[(5S)-5-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) 3.31 8.03 -26.05 2 3 1 29 264.418 5 ↓
Hi High (pH 8-9.5) 3.31 7.98 -5.35 1 3 0 28 263.41 5 ↓
Mid Mid (pH 6-8) 3.31 8.13 -25.18 3 3 0 30 265.426 5 ↓

Analogs

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Popular Name: N1,N1-diethyl-N4-[(5R)-5-methyl-4,5-dihydrothiazol-2-yl]benzene-1,4-diamine N1,N1-diethyl-N4-[(5R)-5-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) 3.31 8.03 -26.35 2 3 1 29 264.418 5 ↓
Hi High (pH 8-9.5) 3.31 7.98 -5.37 1 3 0 28 263.41 5 ↓
Mid Mid (pH 6-8) 3.31 8.13 -24.56 3 3 0 30 265.426 5 ↓

Analogs

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Popular Name: N1-(4,4-diethyl-5H-thiazol-2-yl)-N4,N4-diethyl-benzene-1,4-diamine N1-(4,4-diethyl-5H-thiazol-2-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) 4.76 9.92 -24.06 2 3 1 29 306.499 7 ↓
Hi High (pH 8-9.5) 4.76 9.06 -4.54 1 3 0 28 305.491 7 ↓
Mid Mid (pH 6-8) 4.76 10.02 -19.65 3 3 0 30 307.507 7 ↓

Analogs

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Popular Name: N1,N1-diethyl-N4-[(4R)-4-isobutyl-4,5-dihydrothiazol-2-yl]benzene-1,4-diamine N1,N1-diethyl-N4-[(4R)-4-isobuty…

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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 10.13 -25.58 2 3 1 29 306.499 7 ↓
Hi High (pH 8-9.5) 4.59 9.32 -4.6 1 3 0 28 305.491 7 ↓
Mid Mid (pH 6-8) 4.59 10.22 -25.59 3 3 0 30 307.507 7 ↓

Analogs

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Popular Name: N1,N1-diethyl-N4-[(4S)-4-isobutyl-4,5-dihydrothiazol-2-yl]benzene-1,4-diamine N1,N1-diethyl-N4-[(4S)-4-isobuty…

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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 10.16 -25.57 2 3 1 29 306.499 7 ↓
Hi High (pH 8-9.5) 4.59 9.28 -4.64 1 3 0 28 305.491 7 ↓
Mid Mid (pH 6-8) 4.59 10.25 -26.15 3 3 0 30 307.507 7 ↓

Analogs

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Popular Name: (5R)-5-(bromomethyl)-N-methyl-N-phenyl-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) 3.06 8.23 -29.61 1 2 1 17 286.218 3 ↓
Hi High (pH 8-9.5) 3.06 7.3 -5.82 0 2 0 16 285.21 3 ↓

Analogs

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Popular Name: (5S)-5-(bromomethyl)-N-methyl-N-phenyl-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) 3.06 8.24 -29.66 1 2 1 17 286.218 3 ↓
Hi High (pH 8-9.5) 3.06 7.3 -5.82 0 2 0 16 285.21 3 ↓

Analogs

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Popular Name: (5R)-5-(bromomethyl)-N-ethyl-N-phenyl-4,5-dihydrothiazol-2-amine (5R)-5-(bromomethyl)-N-ethyl-N-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) 3.44 9.12 -29.17 1 2 1 17 300.245 4 ↓
Hi High (pH 8-9.5) 3.44 8.2 -5.55 0 2 0 16 299.237 4 ↓

Analogs

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Popular Name: (5S)-5-(bromomethyl)-N-ethyl-N-phenyl-4,5-dihydrothiazol-2-amine (5S)-5-(bromomethyl)-N-ethyl-N-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) 3.44 9.13 -29.17 1 2 1 17 300.245 4 ↓
Hi High (pH 8-9.5) 3.44 8.2 -5.56 0 2 0 16 299.237 4 ↓

Analogs

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Popular Name: (5R)-5-(bromomethyl)-N-methyl-N-(p-tolyl)-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) 3.51 8.9 -29.6 1 2 1 17 300.245 3 ↓
Hi High (pH 8-9.5) 3.51 7.98 -5.8 0 2 0 16 299.237 3 ↓

Analogs

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Popular Name: (5S)-5-(bromomethyl)-N-methyl-N-(p-tolyl)-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) 3.51 8.91 -29.64 1 2 1 17 300.245 3 ↓
Hi High (pH 8-9.5) 3.51 7.98 -5.85 0 2 0 16 299.237 3 ↓

Analogs

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Popular Name: (5R)-5-(bromomethyl)-N-methyl-N-(m-tolyl)-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) 3.49 8.89 -29.56 1 2 1 17 300.245 3 ↓
Hi High (pH 8-9.5) 3.49 7.97 -5.92 0 2 0 16 299.237 3 ↓

Analogs

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Popular Name: (5S)-5-(bromomethyl)-N-methyl-N-(m-tolyl)-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) 3.49 8.91 -29.67 1 2 1 17 300.245 3 ↓
Hi High (pH 8-9.5) 3.49 7.97 -5.9 0 2 0 16 299.237 3 ↓

Analogs

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Popular Name: (5R)-5-(bromomethyl)-N-(4-fluorophenyl)-N-methyl-4,5-dihydrothiazol-2-amine (5R)-5-(bromomethyl)-N-(4-fluoro…

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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) 3.23 8.3 -32.91 1 2 1 17 304.208 3 ↓
Hi High (pH 8-9.5) 3.23 7.37 -5.54 0 2 0 16 303.2 3 ↓

Analogs

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Popular Name: (5S)-5-(bromomethyl)-N-(4-fluorophenyl)-N-methyl-4,5-dihydrothiazol-2-amine (5S)-5-(bromomethyl)-N-(4-fluoro…

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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) 3.23 8.31 -32.92 1 2 1 17 304.208 3 ↓
Hi High (pH 8-9.5) 3.23 7.37 -5.59 0 2 0 16 303.2 3 ↓

Analogs

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Popular Name: (5R)-5-(bromomethyl)-N-methyl-N-(o-tolyl)-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) 3.46 9.16 -29.67 1 2 1 17 300.245 3 ↓
Hi High (pH 8-9.5) 3.46 8.14 -5.75 0 2 0 16 299.237 3 ↓

Analogs

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Popular Name: (5S)-5-(bromomethyl)-N-methyl-N-(o-tolyl)-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) 3.46 9.16 -29.73 1 2 1 17 300.245 3 ↓
Hi High (pH 8-9.5) 3.46 8.14 -5.79 0 2 0 16 299.237 3 ↓

Analogs

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Popular Name: (5R)-5-(bromomethyl)-N-(2-fluorophenyl)-N-methyl-4,5-dihydrothiazol-2-amine (5R)-5-(bromomethyl)-N-(2-fluoro…

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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) 3.18 8.43 -30.17 1 2 1 17 304.208 3 ↓
Hi High (pH 8-9.5) 3.18 7.41 -7.69 0 2 0 16 303.2 3 ↓

Analogs

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Popular Name: (5S)-5-(bromomethyl)-N-(2-fluorophenyl)-N-methyl-4,5-dihydrothiazol-2-amine (5S)-5-(bromomethyl)-N-(2-fluoro…

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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) 3.18 8.43 -30.21 1 2 1 17 304.208 3 ↓
Hi High (pH 8-9.5) 3.18 7.41 -7.76 0 2 0 16 303.2 3 ↓

Analogs

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Popular Name: (5R)-5-(bromomethyl)-N-(3-fluorophenyl)-N-methyl-4,5-dihydrothiazol-2-amine (5R)-5-(bromomethyl)-N-(3-fluoro…

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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) 3.20 8.29 -32.18 1 2 1 17 304.208 3 ↓
Mid Mid (pH 6-8) 3.20 7.37 -5.81 0 2 0 16 303.2 3 ↓

Analogs

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Popular Name: (5S)-5-(bromomethyl)-N-(3-fluorophenyl)-N-methyl-4,5-dihydrothiazol-2-amine (5S)-5-(bromomethyl)-N-(3-fluoro…

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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) 3.20 8.3 -32.23 1 2 1 17 304.208 3 ↓
Mid Mid (pH 6-8) 3.20 7.37 -5.87 0 2 0 16 303.2 3 ↓

Analogs

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Popular Name: (4R)-4-ethyl-N-(4-methoxy-3-methyl-phenyl)-4,5-dihydrothiazol-2-amine (4R)-4-ethyl-N-(4-methoxy-3-meth…

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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) 3.39 6.59 -27.81 2 3 1 35 251.375 4 ↓
Mid Mid (pH 6-8) 3.39 6.18 -8.11 1 3 0 34 250.367 3 ↓

Analogs

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Popular Name: (4S)-4-ethyl-N-(4-methoxy-3-methyl-phenyl)-4,5-dihydrothiazol-2-amine (4S)-4-ethyl-N-(4-methoxy-3-meth…

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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) 3.39 6.59 -27.79 2 3 1 35 251.375 4 ↓
Mid Mid (pH 6-8) 3.39 6.18 -7.77 1 3 0 34 250.367 3 ↓

Analogs

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Popular Name: N-(4-methoxy-3-methyl-phenyl)-4,4-dimethyl-5H-thiazol-2-amine N-(4-methoxy-3-methyl-phenyl)-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) 3.34 6.42 -26.72 2 3 1 35 251.375 3 ↓
Mid Mid (pH 6-8) 3.34 5.77 -7.89 1 3 0 34 250.367 2 ↓

Analogs

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Popular Name: (4R)-N-(4-methoxy-3-methyl-phenyl)-4-methyl-4,5-dihydrothiazol-2-amine (4R)-N-(4-methoxy-3-methyl-pheny…

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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) 2.86 5.79 -28.42 2 3 1 35 237.348 3 ↓
Mid Mid (pH 6-8) 2.86 5.33 -8.38 1 3 0 34 236.34 2 ↓

Analogs

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Popular Name: (4S)-N-(4-methoxy-3-methyl-phenyl)-4-methyl-4,5-dihydrothiazol-2-amine (4S)-N-(4-methoxy-3-methyl-pheny…

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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) 2.86 5.78 -28.02 2 3 1 35 237.348 3 ↓
Mid Mid (pH 6-8) 2.86 5.34 -7.89 1 3 0 34 236.34 2 ↓

Analogs

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Popular Name: (4R)-4-isobutyl-N-(4-methoxy-3-methyl-phenyl)-4,5-dihydrothiazol-2-amine (4R)-4-isobutyl-N-(4-methoxy-3-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) 4.17 7.87 -28.33 2 3 1 35 279.429 5 ↓
Hi High (pH 8-9.5) 4.17 7.43 -7.83 1 3 0 34 278.421 4 ↓

Analogs

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Popular Name: (4S)-4-isobutyl-N-(4-methoxy-3-methyl-phenyl)-4,5-dihydrothiazol-2-amine (4S)-4-isobutyl-N-(4-methoxy-3-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) 4.17 7.87 -28.41 2 3 1 35 279.429 5 ↓
Hi High (pH 8-9.5) 4.17 7.45 -7.47 1 3 0 34 278.421 4 ↓

Analogs

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Popular Name: (4R)-4-methyl-N-(2-propylphenyl)-4,5-dihydrothiazol-2-amine (4R)-4-methyl-N-(2-propylphenyl)…

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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) 3.68 7.71 -7.09 1 2 0 24 234.368 3 ↓
Mid Mid (pH 6-8) 3.68 7.97 -26.75 2 2 1 26 235.376 4 ↓

Analogs

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Popular Name: (4S)-4-methyl-N-(2-propylphenyl)-4,5-dihydrothiazol-2-amine (4S)-4-methyl-N-(2-propylphenyl)…

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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) 3.68 7.67 -6.94 1 2 0 24 234.368 3 ↓
Mid Mid (pH 6-8) 3.68 7.96 -26.28 2 2 1 26 235.376 4 ↓

Analogs

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Popular Name: (4R)-4-ethyl-N-(4-fluoro-2-methoxy-phenyl)-4,5-dihydrothiazol-2-amine (4R)-4-ethyl-N-(4-fluoro-2-metho…

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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) 3.11 5.87 -27.58 2 3 1 35 255.338 4 ↓
Mid Mid (pH 6-8) 3.11 5.59 -8.23 1 3 0 34 254.33 3 ↓

Analogs

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Popular Name: (4S)-4-ethyl-N-(4-fluoro-2-methoxy-phenyl)-4,5-dihydrothiazol-2-amine (4S)-4-ethyl-N-(4-fluoro-2-metho…

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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) 3.11 5.84 -27.49 2 3 1 35 255.338 4 ↓
Mid Mid (pH 6-8) 3.11 5.61 -8.25 1 3 0 34 254.33 3 ↓

Analogs

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Popular Name: N-(4-fluoro-2-methoxy-phenyl)-4,4-dimethyl-5H-thiazol-2-amine N-(4-fluoro-2-methoxy-phenyl)-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) 3.05 5.68 -26.26 2 3 1 35 255.338 3 ↓
Mid Mid (pH 6-8) 3.05 5.44 -8.02 1 3 0 34 254.33 2 ↓

Analogs

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Popular Name: (4R)-N-(4-fluoro-2-methoxy-phenyl)-4-methyl-4,5-dihydrothiazol-2-amine (4R)-N-(4-fluoro-2-methoxy-pheny…

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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) 2.57 5.05 -28.03 2 3 1 35 241.311 3 ↓
Mid Mid (pH 6-8) 2.57 4.77 -8.47 1 3 0 34 240.303 2 ↓

Analogs

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Popular Name: (4S)-N-(4-fluoro-2-methoxy-phenyl)-4-methyl-4,5-dihydrothiazol-2-amine (4S)-N-(4-fluoro-2-methoxy-pheny…

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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) 2.57 5.04 -27.72 2 3 1 35 241.311 3 ↓
Mid Mid (pH 6-8) 2.57 4.74 -8.49 1 3 0 34 240.303 2 ↓

Analogs

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Popular Name: (4R)-N-(4-fluoro-2-methoxy-phenyl)-4-isobutyl-4,5-dihydrothiazol-2-amine (4R)-N-(4-fluoro-2-methoxy-pheny…

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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 7.15 -28.26 2 3 1 35 283.392 5 ↓
Mid Mid (pH 6-8) 3.88 6.88 -7.96 1 3 0 34 282.384 4 ↓

Analogs

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Popular Name: (4S)-N-(4-fluoro-2-methoxy-phenyl)-4-isobutyl-4,5-dihydrothiazol-2-amine (4S)-N-(4-fluoro-2-methoxy-pheny…

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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 7.18 -28.33 2 3 1 35 283.392 5 ↓
Mid Mid (pH 6-8) 3.88 6.89 -7.95 1 3 0 34 282.384 4 ↓

Parameters Provided:

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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 = 91796 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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