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Analogs

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Popular Name: 4-[2-(5-chloro-2-fluoro-phenyl)thiazol-4-yl]aniline 4-[2-(5-chloro-2-fluoro-phenyl)t…

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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) 4.30 7.47 -7.57 2 2 0 39 304.777 2 ↓

Analogs

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Popular Name: 3-[2-(5-chloro-2-fluoro-phenyl)thiazol-4-yl]aniline 3-[2-(5-chloro-2-fluoro-phenyl)t…

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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) 4.28 7.46 -7.51 2 2 0 39 304.777 2 ↓

Analogs

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Popular Name: 2-[2-(5-chloro-2-fluoro-phenyl)thiazol-4-yl]aniline 2-[2-(5-chloro-2-fluoro-phenyl)t…

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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) 4.66 7.81 -5.88 2 2 0 39 304.777 2 ↓

Analogs

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Popular Name: 4-[2-(2-chloro-6-fluoro-phenyl)thiazol-4-yl]aniline 4-[2-(2-chloro-6-fluoro-phenyl)t…

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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) 4.28 7.78 -9.76 2 2 0 39 304.777 2 ↓

Analogs

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Popular Name: 3-[2-(2-chloro-6-fluoro-phenyl)thiazol-4-yl]aniline 3-[2-(2-chloro-6-fluoro-phenyl)t…

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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) 4.26 7.48 -10.95 2 2 0 39 304.777 2 ↓

Analogs

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Popular Name: 2-[2-(2-chloro-6-fluoro-phenyl)thiazol-4-yl]aniline 2-[2-(2-chloro-6-fluoro-phenyl)t…

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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) 4.64 7.83 -8.81 2 2 0 39 304.777 2 ↓

Analogs

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Popular Name: 2-[2-(5-chloro-2-methoxy-phenyl)-4-(p-tolyl)thiazol-5-yl]acetic 2-[2-(5-chloro-2-methoxy-phenyl)…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.24 0.27 -55.82 0 4 -1 62 372.853 5 ↓

Analogs

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Popular Name: 2-(4-methoxyphenyl)-4-(4-methylsulfonylphenyl)thiazole 2-(4-methoxyphenyl)-4-(4-methyls…

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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 5.95 -14.92 0 4 0 56 345.445 4 ↓

Analogs

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Popular Name: 4-(4-methylsulfonylphenyl)-2-(p-tolyl)thiazole 4-(4-methylsulfonylphenyl)-2-(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) 3.78 7.32 -14.51 0 3 0 47 329.446 3 ↓

Analogs

14240418
14240418

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Popular Name: N-[4-[2-(3,4-dimethoxyphenyl)thiazol-4-yl]phenyl]-2,2-dimethyl-propanamide N-[4-[2-(3,4-dimethoxyphenyl)thi…

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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) 4.99 9.25 -15.71 1 5 0 60 396.512 6 ↓

Analogs

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Popular Name: 2-(4-isopropylphenyl)-4-(4-methylsulfonylphenyl)thiazole 2-(4-isopropylphenyl)-4-(4-methy…

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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) 4.84 8.56 -14.08 0 3 0 47 357.5 4 ↓

Analogs

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Popular Name: N-[4-[2-(3-chlorophenyl)thiazol-4-yl]-3-fluoro-phenyl]acetamide N-[4-[2-(3-chlorophenyl)thiazol-…

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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) 4.42 8.5 -10.84 1 3 0 42 346.814 3 ↓

Analogs

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Popular Name: 2-(3-chlorophenyl)-4-(4-methylsulfonylphenyl)thiazole 2-(3-chlorophenyl)-4-(4-methylsu…

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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) 3.98 7.16 -13.87 0 3 0 47 349.864 3 ↓

Analogs

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Popular Name: N-[4-[2-(3-chlorophenyl)thiazol-4-yl]phenyl]methanesulfonamide N-[4-[2-(3-chlorophenyl)thiazol-…

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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) 4.35 6.23 -12.81 1 4 0 59 364.879 4 ↓
Hi High (pH 8-9.5) 4.35 6.3 -40.4 0 4 -1 61 363.871 4 ↓

Analogs

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Popular Name: 2-(5-bromo-2-methoxy-phenyl)-4-(4-methylsulfonylphenyl)thiazole 2-(5-bromo-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) 4.12 6.75 -16.15 0 4 0 56 424.341 4 ↓

Analogs

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Popular Name: N-[4-[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]phenyl]methanesulfonamide N-[4-[2-(5-bromo-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) 4.49 5.99 -50.71 0 5 -1 70 438.348 5 ↓
Lo Low (pH 4.5-6) 4.49 5.83 -17.47 1 5 0 68 439.356 5 ↓

Analogs

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Popular Name: 4-[2-(4-ethylphenyl)thiazol-4-yl]benzene-1,3-diol 4-[2-(4-ethylphenyl)thiazol-4-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) 4.60 5.29 -8.99 2 3 0 53 297.379 3 ↓

Analogs

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Popular Name: 4-[2-(4-ethylphenyl)thiazol-4-yl]benzene-1,2-diol 4-[2-(4-ethylphenyl)thiazol-4-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) 4.41 5.61 -10.47 2 3 0 53 297.379 3 ↓

Analogs

11831465
11831465

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Popular Name: 2-[2-(3-butoxyphenyl)-4-(p-tolyl)thiazol-5-yl]acetic 2-[2-(3-butoxyphenyl)-4-(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) 6.04 0.32 -54.37 0 4 -1 62 380.489 8 ↓

Analogs

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Popular Name: 2-[2-(4-ethoxyphenyl)-4-(p-tolyl)thiazol-5-yl]acetic 2-[2-(4-ethoxyphenyl)-4-(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) 5.01 0.12 -53.05 0 4 -1 62 352.435 6 ↓

Analogs

11953264
11953264
11993549
11993549

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Popular Name: 2-[2-(3-ethoxy-4-methoxy-phenyl)-4-(p-tolyl)thiazol-5-yl]acetic 2-[2-(3-ethoxy-4-methoxy-phenyl)…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.60 0.45 -53.94 0 5 -1 71 382.461 7 ↓

Analogs

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Popular Name: 2-[2-(3-hydroxy-4-methoxy-phenyl)-4-(p-tolyl)thiazol-5-yl]acetic 2-[2-(3-hydroxy-4-methoxy-phenyl…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.91 -1.51 -54.97 1 5 -1 82 354.407 5 ↓

Analogs

11862480
11862480
11803432
11803432

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Popular Name: 2-[2-(3-pentoxyphenyl)-4-(p-tolyl)thiazol-5-yl]acetic 2-[2-(3-pentoxyphenyl)-4-(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) 6.55 0.44 -54.27 0 4 -1 62 394.516 9 ↓

Analogs

11862295
11862295

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Popular Name: 2-[2-(3-methoxy-4-propoxy-phenyl)-4-(p-tolyl)thiazol-5-yl]acetic 2-[2-(3-methoxy-4-propoxy-phenyl…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.10 0.52 -53.47 0 5 -1 71 396.488 8 ↓

Analogs

11891498
11891498

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Popular Name: 2-[2-(4-propoxyphenyl)-4-(p-tolyl)thiazol-5-yl]acetic 2-[2-(4-propoxyphenyl)-4-(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) 5.51 0.2 -52.68 0 4 -1 62 366.462 7 ↓

Analogs

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Popular Name: 2-[2-[4-(2-dimethylaminoethoxy)phenyl]-4-(p-tolyl)thiazol-5-yl]acetic 2-[2-[4-(2-dimethylaminoethoxy)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) 4.66 0.84 -80.99 1 5 0 67 396.512 8 ↓

Analogs

11953264
11953264
11803954
11803954

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Popular Name: 2-[2-(4-ethoxy-3-methoxy-phenyl)-4-(p-tolyl)thiazol-5-yl]acetic 2-[2-(4-ethoxy-3-methoxy-phenyl)…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.60 0.45 -53.82 0 5 -1 71 382.461 7 ↓

Analogs

8395543
8395543

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Popular Name: 2-[2-(3-ethoxyphenyl)-4-(p-tolyl)thiazol-5-yl]acetic 2-[2-(3-ethoxyphenyl)-4-(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) 4.98 0.12 -54.68 0 4 -1 62 352.435 6 ↓

Analogs

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Popular Name: 2-[2-(2-ethoxy-4-methoxy-phenyl)-4-(p-tolyl)thiazol-5-yl]acetic 2-[2-(2-ethoxy-4-methoxy-phenyl)…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.99 0.46 -57.39 0 5 -1 71 382.461 7 ↓

Analogs

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Popular Name: 4-(o-tolyl)-2-phenyl-thiazole-5-carboxylic 4-(o-tolyl)-2-phenyl-thiazole-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) 4.67 10.16 -53.92 0 3 -1 53 294.355 3 ↓

Analogs

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Popular Name: 4-[2-(3-chloro-2-fluoro-phenyl)thiazol-4-yl]aniline 4-[2-(3-chloro-2-fluoro-phenyl)t…

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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) 4.28 7.69 -11.5 2 2 0 39 304.777 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[2-(3-chloro-2-fluoro-phenyl)thiazol-4-yl]aniline 3-[2-(3-chloro-2-fluoro-phenyl)t…

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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) 4.26 7.45 -8.39 2 2 0 39 304.777 2 ↓

Analogs

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Popular Name: 2-[2-(3-chloro-2-fluoro-phenyl)thiazol-4-yl]aniline 2-[2-(3-chloro-2-fluoro-phenyl)t…

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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) 4.64 7.8 -6.8 2 2 0 39 304.777 2 ↓

Analogs

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Popular Name: N-[4-[2-(3-chlorophenyl)-5-methyl-thiazol-4-yl]phenyl]methanesulfonamide N-[4-[2-(3-chlorophenyl)-5-methy…

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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 6.99 -45.33 0 4 -1 61 377.898 4 ↓
Lo Low (pH 4.5-6) 4.57 6.82 -15.14 1 4 0 59 378.906 4 ↓

Analogs

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Popular Name: N-[4-[2-(3-bromophenyl)-5-methyl-thiazol-4-yl]phenyl]methanesulfonamide N-[4-[2-(3-bromophenyl)-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) 4.70 7.09 -45.17 0 4 -1 61 422.349 4 ↓
Lo Low (pH 4.5-6) 4.70 6.92 -15.08 1 4 0 59 423.357 4 ↓

Analogs

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Popular Name: N-[4-[2-(4-ethylphenyl)-5-methyl-thiazol-4-yl]phenyl]methanesulfonamide N-[4-[2-(4-ethylphenyl)-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) 4.83 7.91 -48.13 0 4 -1 61 371.507 5 ↓
Lo Low (pH 4.5-6) 4.83 7.75 -15.68 1 4 0 59 372.515 5 ↓

Analogs

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Popular Name: 4-[2-(3-nitrophenyl)thiazol-4-yl]benzonitrile 4-[2-(3-nitrophenyl)thiazol-4-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) 4.15 10.2 -11.71 0 5 0 83 307.334 3 ↓

Analogs

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Popular Name: 4-[4-(3,4-dihydroxyphenyl)thiazol-2-yl]benzenesulfonamide 4-[4-(3,4-dihydroxyphenyl)thiazo…

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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 -0.87 -17.29 4 6 0 114 348.405 3 ↓

Analogs

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Popular Name: 4-[4-(2,4-dihydroxyphenyl)thiazol-2-yl]benzenesulfonamide 4-[4-(2,4-dihydroxyphenyl)thiazo…

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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 -1.18 -15.68 4 6 0 114 348.405 3 ↓

Analogs

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Popular Name: 4-[2-(2-methoxyphenyl)thiazol-4-yl]benzenesulfonamide 4-[2-(2-methoxyphenyl)thiazol-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) 3.16 3.55 -15.14 2 5 0 82 346.433 4 ↓

Analogs

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Popular Name: 3-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]benzoic 3-[4-(3,4-dimethoxyphenyl)thiazo…

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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) 3.99 8.86 -52.79 0 5 -1 71 340.38 5 ↓

Analogs

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Popular Name: 4-[2-(4-ethoxyphenyl)thiazol-4-yl]benzenesulfonamide 4-[2-(4-ethoxyphenyl)thiazol-4-y…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.59 4.29 -13.88 2 5 0 82 360.46 5 ↓

Analogs

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Popular Name: N,N-dimethyl-4-(2-phenylthiazol-4-yl)benzenesulfonamide N,N-dimethyl-4-(2-phenylthiazol-…

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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) 3.77 7.09 -12.49 0 4 0 50 344.461 4 ↓

Analogs

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Popular Name: 2-(4-chlorophenyl)-4-phenyl-1,3-thiazole 2-(4-chlorophenyl)-4-phenyl-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) 5.14 0.36 -5.72 0 1 0 12 271.772 2 ↓

Analogs

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Popular Name: N,N-dimethyl-3-(2-phenyl-1,3-thiazol-4-yl)benzenesulfonamide N,N-dimethyl-3-(2-phenyl-1,3-thi…

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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) 3.75 -3.47 -14.25 0 4 0 50 344.461 4 ↓

Analogs

60215069
60215069

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Popular Name: 2-(3,4-dimethoxyphenyl)-4-(4-methoxy-3-nitro-phenyl)thiazole 2-(3,4-dimethoxyphenyl)-4-(4-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) 4.05 1.87 -18.23 0 7 0 86 372.402 6 ↓

Analogs

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Popular Name: 4-(4-bromophenyl)-2-(3,4-dimethoxyphenyl)thiazole 4-(4-bromophenyl)-2-(3,4-dimetho…

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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) 4.92 0.11 -8.32 0 3 0 31 376.275 4 ↓

Analogs

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Popular Name: methyl 4-[5-(2-methoxy-2-oxoethyl)-4-phenyl-1,3-thiazol-2-yl]benzenecarboxylate methyl 4-[5-(2-methoxy-2-oxoethy…

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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) 4.91 2.4 -12.3 0 5 0 65 367.426 7 ↓

Analogs

41722564
41722564

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Popular Name: 4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzenecarboxylic acid 4-[4-(4-chlorophenyl)-1,3-thiazo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.05 10.15 -48.17 0 3 -1 53 314.773 3 ↓

Analogs

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Popular Name: 4-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]benzenecarboxylic acid 4-[4-(3,4-dichlorophenyl)-1,3-th…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.66 10.6 -50.12 0 3 -1 53 349.218 3 ↓

Parameters Provided:

ring.id = 28856
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 28856 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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