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Analogs

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Popular Name: (5S)-N-[(1S)-1-(4-fluorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1S)-1-(4-fluorophenyl)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) 4.10 9.86 -32.62 2 2 1 26 301.41 4 ↓
Hi High (pH 8-9.5) 4.10 9.85 -33.3 2 2 1 26 301.41 3 ↓
Hi High (pH 8-9.5) 4.10 9.13 -6.75 1 2 0 24 300.402 3 ↓

Analogs

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Popular Name: (5S)-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1R)-1-(4-fluorophenyl)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) 4.10 9.86 -32.47 2 2 1 26 301.41 4 ↓
Hi High (pH 8-9.5) 4.10 9.13 -6.77 1 2 0 24 300.402 3 ↓
Hi High (pH 8-9.5) 4.10 9.88 -33 2 2 1 26 301.41 3 ↓

Analogs

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Popular Name: (5R)-N-[(1S)-1-(4-fluorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1S)-1-(4-fluorophenyl)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) 4.10 9.86 -32.54 2 2 1 26 301.41 4 ↓
Hi High (pH 8-9.5) 4.10 9.88 -33.05 2 2 1 26 301.41 3 ↓
Hi High (pH 8-9.5) 4.10 9.14 -6.8 1 2 0 24 300.402 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1R)-1-(4-fluorophenyl)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) 4.10 9.86 -32.64 2 2 1 26 301.41 4 ↓
Hi High (pH 8-9.5) 4.10 9.13 -6.74 1 2 0 24 300.402 3 ↓
Hi High (pH 8-9.5) 4.10 9.86 -33.27 2 2 1 26 301.41 3 ↓

Analogs

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Popular Name: (5S)-N-[(1S)-1-(2-chlorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1S)-1-(2-chlorophenyl)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) 4.57 10.26 -29.82 2 2 1 26 317.865 4 ↓
Hi High (pH 8-9.5) 4.57 10.25 -28.15 2 2 1 26 317.865 3 ↓
Hi High (pH 8-9.5) 4.57 9.61 -5.81 1 2 0 24 316.857 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-N-[(1R)-1-(2-chlorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1R)-1-(2-chlorophenyl)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) 4.57 10.23 -29.63 2 2 1 26 317.865 4 ↓
Hi High (pH 8-9.5) 4.57 10.24 -28.11 2 2 1 26 317.865 3 ↓
Hi High (pH 8-9.5) 4.57 9.6 -6.01 1 2 0 24 316.857 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1S)-1-(2-chlorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1S)-1-(2-chlorophenyl)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) 4.57 10.25 -29.66 2 2 1 26 317.865 4 ↓
Hi High (pH 8-9.5) 4.57 10.28 -27.99 2 2 1 26 317.865 3 ↓
Hi High (pH 8-9.5) 4.57 9.59 -5.91 1 2 0 24 316.857 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1R)-1-(2-chlorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1R)-1-(2-chlorophenyl)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) 4.57 10.23 -29.85 2 2 1 26 317.865 4 ↓
Hi High (pH 8-9.5) 4.57 10.24 -28.03 2 2 1 26 317.865 3 ↓
Hi High (pH 8-9.5) 4.57 9.6 -5.83 1 2 0 24 316.857 3 ↓

Analogs

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Popular Name: (5S)-N-[(1S)-1-(3-chlorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1S)-1-(3-chlorophenyl)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) 4.59 10.3 -31.49 2 2 1 26 317.865 4 ↓
Hi High (pH 8-9.5) 4.59 10.29 -31.4 2 2 1 26 317.865 3 ↓
Hi High (pH 8-9.5) 4.59 9.58 -5.66 1 2 0 24 316.857 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-N-[(1R)-1-(3-chlorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1R)-1-(3-chlorophenyl)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) 4.59 10.3 -31.28 2 2 1 26 317.865 4 ↓
Hi High (pH 8-9.5) 4.59 9.58 -5.84 1 2 0 24 316.857 3 ↓
Hi High (pH 8-9.5) 4.59 10.32 -31.12 2 2 1 26 317.865 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1S)-1-(3-chlorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1S)-1-(3-chlorophenyl)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) 4.59 10.3 -31.27 2 2 1 26 317.865 4 ↓
Hi High (pH 8-9.5) 4.59 9.58 -5.84 1 2 0 24 316.857 3 ↓
Hi High (pH 8-9.5) 4.59 10.32 -31.16 2 2 1 26 317.865 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1R)-1-(3-chlorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1R)-1-(3-chlorophenyl)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) 4.59 10.3 -31.47 2 2 1 26 317.865 4 ↓
Hi High (pH 8-9.5) 4.59 10.3 -31.32 2 2 1 26 317.865 3 ↓
Hi High (pH 8-9.5) 4.59 9.57 -5.59 1 2 0 24 316.857 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-N-[(1S)-1-(4-chlorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1S)-1-(4-chlorophenyl)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) 4.61 10.31 -31.73 2 2 1 26 317.865 4 ↓
Hi High (pH 8-9.5) 4.61 9.59 -6.25 1 2 0 24 316.857 3 ↓
Hi High (pH 8-9.5) 4.61 10.3 -32.38 2 2 1 26 317.865 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-N-[(1R)-1-(4-chlorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1R)-1-(4-chlorophenyl)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) 4.61 10.31 -31.66 2 2 1 26 317.865 4 ↓
Hi High (pH 8-9.5) 4.61 10.33 -32.05 2 2 1 26 317.865 3 ↓
Hi High (pH 8-9.5) 4.61 9.59 -6.24 1 2 0 24 316.857 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1S)-1-(4-chlorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1S)-1-(4-chlorophenyl)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) 4.61 10.31 -31.65 2 2 1 26 317.865 4 ↓
Hi High (pH 8-9.5) 4.61 10.33 -32.12 2 2 1 26 317.865 3 ↓
Hi High (pH 8-9.5) 4.61 9.59 -6.29 1 2 0 24 316.857 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1R)-1-(4-chlorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1R)-1-(4-chlorophenyl)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) 4.61 10.31 -31.75 2 2 1 26 317.865 4 ↓
Hi High (pH 8-9.5) 4.61 10.31 -32.27 2 2 1 26 317.865 3 ↓
Hi High (pH 8-9.5) 4.61 9.58 -6.2 1 2 0 24 316.857 3 ↓

Analogs

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Popular Name: (5S)-N-[(1S)-1-(4-bromophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1S)-1-(4-bromophenyl)et…

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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) 4.74 10.41 -31.86 2 2 1 26 362.316 4 ↓
Hi High (pH 8-9.5) 4.74 9.69 -6.13 1 2 0 24 361.308 3 ↓
Hi High (pH 8-9.5) 4.74 10.41 -32.52 2 2 1 26 362.316 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-N-[(1R)-1-(4-bromophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1R)-1-(4-bromophenyl)et…

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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) 4.74 10.41 -31.73 2 2 1 26 362.316 4 ↓
Hi High (pH 8-9.5) 4.74 9.69 -6.22 1 2 0 24 361.308 3 ↓
Hi High (pH 8-9.5) 4.74 10.43 -32.21 2 2 1 26 362.316 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1S)-1-(4-bromophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1S)-1-(4-bromophenyl)et…

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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) 4.74 10.42 -31.77 2 2 1 26 362.316 4 ↓
Hi High (pH 8-9.5) 4.74 10.44 -32.18 2 2 1 26 362.316 3 ↓
Hi High (pH 8-9.5) 4.74 9.7 -6.21 1 2 0 24 361.308 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1R)-1-(4-bromophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1R)-1-(4-bromophenyl)et…

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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) 4.74 10.42 -31.84 2 2 1 26 362.316 4 ↓
Hi High (pH 8-9.5) 4.74 9.69 -6.15 1 2 0 24 361.308 3 ↓
Hi High (pH 8-9.5) 4.74 10.41 -32.38 2 2 1 26 362.316 3 ↓

Analogs

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Popular Name: (5S)-N-[(1R)-1-(o-tolyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1R)-1-(o-tolyl)ethyl]-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) 4.34 10.29 -29.11 2 2 1 26 297.447 4 ↓
Hi High (pH 8-9.5) 4.34 10.31 -29.02 2 2 1 26 297.447 3 ↓
Hi High (pH 8-9.5) 4.34 9.66 -7.14 1 2 0 24 296.439 3 ↓

Analogs

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Popular Name: (5S)-N-[(1S)-1-(o-tolyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1S)-1-(o-tolyl)ethyl]-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) 4.34 10.37 -29.2 2 2 1 26 297.447 4 ↓
Hi High (pH 8-9.5) 4.34 9.71 -6.93 1 2 0 24 296.439 3 ↓
Hi High (pH 8-9.5) 4.34 10.36 -29.22 2 2 1 26 297.447 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1R)-1-(o-tolyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1R)-1-(o-tolyl)ethyl]-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) 4.34 10.29 -29.19 2 2 1 26 297.447 4 ↓
Hi High (pH 8-9.5) 4.34 9.65 -6.94 1 2 0 24 296.439 3 ↓
Hi High (pH 8-9.5) 4.34 10.3 -29.1 2 2 1 26 297.447 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1S)-1-(o-tolyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1S)-1-(o-tolyl)ethyl]-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) 4.34 10.35 -29.12 2 2 1 26 297.447 4 ↓
Hi High (pH 8-9.5) 4.34 9.7 -7.17 1 2 0 24 296.439 3 ↓
Hi High (pH 8-9.5) 4.34 10.38 -29.07 2 2 1 26 297.447 3 ↓

Analogs

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Popular Name: (5S)-N-[(1S)-1-(2-fluorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1S)-1-(2-fluorophenyl)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) 4.05 9.86 -30.41 2 2 1 26 301.41 4 ↓
Hi High (pH 8-9.5) 4.05 9.86 -28.66 2 2 1 26 301.41 3 ↓
Hi High (pH 8-9.5) 4.05 9.27 -6.28 1 2 0 24 300.402 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-N-[(1R)-1-(2-fluorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1R)-1-(2-fluorophenyl)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) 4.05 9.87 -30.26 2 2 1 26 301.41 4 ↓
Hi High (pH 8-9.5) 4.05 9.89 -28.64 2 2 1 26 301.41 3 ↓
Hi High (pH 8-9.5) 4.05 9.23 -6.56 1 2 0 24 300.402 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1S)-1-(2-fluorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1S)-1-(2-fluorophenyl)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) 4.05 9.85 -30.22 2 2 1 26 301.41 4 ↓
Hi High (pH 8-9.5) 4.05 9.27 -6.4 1 2 0 24 300.402 3 ↓
Hi High (pH 8-9.5) 4.05 9.9 -28.62 2 2 1 26 301.41 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1R)-1-(2-fluorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1R)-1-(2-fluorophenyl)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) 4.05 9.88 -30.48 2 2 1 26 301.41 4 ↓
Hi High (pH 8-9.5) 4.05 9.87 -28.59 2 2 1 26 301.41 3 ↓
Hi High (pH 8-9.5) 4.05 9.23 -6.2 1 2 0 24 300.402 3 ↓

Analogs

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Popular Name: (5S)-N-[(1S)-1-(3-fluorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1S)-1-(3-fluorophenyl)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) 4.07 9.86 -32.4 2 2 1 26 301.41 4 ↓
Hi High (pH 8-9.5) 4.07 9.85 -32.25 2 2 1 26 301.41 3 ↓
Hi High (pH 8-9.5) 4.07 9.13 -6.04 1 2 0 24 300.402 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-N-[(1R)-1-(3-fluorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1R)-1-(3-fluorophenyl)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) 4.07 9.86 -32.12 2 2 1 26 301.41 4 ↓
Hi High (pH 8-9.5) 4.07 9.13 -6.25 1 2 0 24 300.402 3 ↓
Hi High (pH 8-9.5) 4.07 9.88 -32.01 2 2 1 26 301.41 3 ↓

Analogs

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Popular Name: (5R)-N-[(1S)-1-(3-fluorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1S)-1-(3-fluorophenyl)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) 4.07 9.86 -32.2 2 2 1 26 301.41 4 ↓
Hi High (pH 8-9.5) 4.07 9.88 -31.94 2 2 1 26 301.41 3 ↓
Hi High (pH 8-9.5) 4.07 9.14 -6.23 1 2 0 24 300.402 3 ↓

Analogs

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Popular Name: (5R)-N-[(1R)-1-(3-fluorophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1R)-1-(3-fluorophenyl)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) 4.07 9.86 -32.38 2 2 1 26 301.41 4 ↓
Hi High (pH 8-9.5) 4.07 9.13 -6.06 1 2 0 24 300.402 3 ↓
Hi High (pH 8-9.5) 4.07 9.86 -32.11 2 2 1 26 301.41 3 ↓

Analogs

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Popular Name: (5S)-5-phenyl-N-[(1R)-1-(p-tolyl)ethyl]-4,5-dihydrothiazol-2-amine (5S)-5-phenyl-N-[(1R)-1-(p-tolyl…

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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) 4.38 10.46 -28.75 2 2 1 26 297.447 4 ↓

Analogs

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Popular Name: (5S)-5-phenyl-N-[(1S)-1-(p-tolyl)ethyl]-4,5-dihydrothiazol-2-amine (5S)-5-phenyl-N-[(1S)-1-(p-tolyl…

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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) 4.38 10.46 -28.89 2 2 1 26 297.447 4 ↓

Analogs

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Popular Name: (5R)-5-phenyl-N-[(1R)-1-(p-tolyl)ethyl]-4,5-dihydrothiazol-2-amine (5R)-5-phenyl-N-[(1R)-1-(p-tolyl…

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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) 4.38 10.47 -28.91 2 2 1 26 297.447 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-5-phenyl-N-[(1S)-1-(p-tolyl)ethyl]-4,5-dihydrothiazol-2-amine (5R)-5-phenyl-N-[(1S)-1-(p-tolyl…

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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) 4.38 10.47 -28.79 2 2 1 26 297.447 4 ↓

Analogs

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Popular Name: (5S)-N-[(1S)-1-(3-bromophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1S)-1-(3-bromophenyl)et…

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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) 4.72 10.4 -31.56 2 2 1 26 362.316 4 ↓

Analogs

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Popular Name: (5S)-N-[(1R)-1-(3-bromophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(1R)-1-(3-bromophenyl)et…

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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) 4.72 10.4 -31.34 2 2 1 26 362.316 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1S)-1-(3-bromophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1S)-1-(3-bromophenyl)et…

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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) 4.72 10.41 -31.4 2 2 1 26 362.316 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-N-[(1R)-1-(3-bromophenyl)ethyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(1R)-1-(3-bromophenyl)et…

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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) 4.72 10.41 -31.54 2 2 1 26 362.316 4 ↓

Analogs

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Popular Name: (5R)-N-[(3,4-difluorophenyl)methyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(3,4-difluorophenyl)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) 3.63 9.16 -36.59 2 2 1 26 305.373 4 ↓
Hi High (pH 8-9.5) 3.63 9.08 -38.61 2 2 1 26 305.373 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-N-[(3,4-difluorophenyl)methyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5S)-N-[(3,4-difluorophenyl)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) 3.63 9.16 -36.79 2 2 1 26 305.373 4 ↓
Hi High (pH 8-9.5) 3.63 9.11 -38.47 2 2 1 26 305.373 3 ↓

Parameters Provided:

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