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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-amino-N-[(1S)-2-(4-fluorophenyl)-1-methyl-ethyl]thiazole-4-carboxamide 2-amino-N-[(1S)-2-(4-fluoropheny…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.21 4.87 -10.49 3 4 0 68 279.34 4 ↓

Analogs

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Popular Name: 2-amino-N-[(1R)-2-(4-fluorophenyl)-1-methyl-ethyl]thiazole-4-carboxamide 2-amino-N-[(1R)-2-(4-fluoropheny…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.21 4.86 -10.47 3 4 0 68 279.34 4 ↓

Analogs

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Popular Name: 2-acetamido-N-allyl-N-phenethyl-thiazole-4-carboxamide 2-acetamido-N-allyl-N-phenethyl-…

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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) 2.34 9.03 -12.75 1 5 0 62 329.425 7 ↓

Analogs

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Popular Name: N-[(2R)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]thiazole-4-carboxamide N-[(2R)-2-(dimethylamino)-2-(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) 1.94 4.71 -41.22 2 5 1 56 306.411 6 ↓
Mid Mid (pH 6-8) 1.94 2.82 -10.75 1 5 0 54 305.403 6 ↓

Analogs

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Popular Name: N-[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]thiazole-4-carboxamide N-[(2S)-2-(dimethylamino)-2-(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) 1.94 4.71 -41.56 2 5 1 56 306.411 6 ↓
Mid Mid (pH 6-8) 1.94 2.18 -10.19 1 5 0 54 305.403 6 ↓

Analogs

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Popular Name: N-[(2R)-2-(diethylamino)-2-phenyl-ethyl]thiazole-4-carboxamide N-[(2R)-2-(diethylamino)-2-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) 2.66 6.65 -34.81 2 4 1 46 304.439 7 ↓
Hi High (pH 8-9.5) 2.66 5.04 -8.32 1 4 0 45 303.431 7 ↓

Analogs

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Popular Name: N-[(2S)-2-(diethylamino)-2-phenyl-ethyl]thiazole-4-carboxamide N-[(2S)-2-(diethylamino)-2-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) 2.66 6.1 -35.72 2 4 1 46 304.439 7 ↓
Hi High (pH 8-9.5) 2.66 4.34 -8.78 1 4 0 45 303.431 7 ↓

Analogs

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Popular Name: N-[(1S)-2-(2,6-difluorophenyl)-1-methyl-ethyl]thiazole-4-carboxamide N-[(1S)-2-(2,6-difluorophenyl)-1…

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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) 2.67 5.44 -10.84 1 3 0 42 282.315 4 ↓

Analogs

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Popular Name: N-[(1R)-2-(2,6-difluorophenyl)-1-methyl-ethyl]thiazole-4-carboxamide N-[(1R)-2-(2,6-difluorophenyl)-1…

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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) 2.67 5.43 -10.83 1 3 0 42 282.315 4 ↓

Analogs

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Popular Name: N-[(1R)-1-methyl-2-(o-tolyl)ethyl]thiazole-4-carboxamide N-[(1R)-1-methyl-2-(o-tolyl)ethy…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.84 5.64 -10.17 1 3 0 42 260.362 4 ↓

Analogs

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Popular Name: N-[(1S)-1-methyl-2-(o-tolyl)ethyl]thiazole-4-carboxamide N-[(1S)-1-methyl-2-(o-tolyl)ethy…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.84 5.7 -10.06 1 3 0 42 260.362 4 ↓

Analogs

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Popular Name: N-[(1S)-2-(2-methoxyphenyl)-1-methyl-ethyl]thiazole-4-carboxamide N-[(1S)-2-(2-methoxyphenyl)-1-me…

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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) 2.44 4.6 -11.51 1 4 0 51 276.361 5 ↓

Analogs

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Popular Name: N-[(1R)-2-(2-methoxyphenyl)-1-methyl-ethyl]thiazole-4-carboxamide N-[(1R)-2-(2-methoxyphenyl)-1-me…

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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) 2.44 5.14 -11.06 1 4 0 51 276.361 5 ↓

Analogs

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Popular Name: N-[(2R)-2-phenylpropyl]thiazole-4-carboxamide N-[(2R)-2-phenylpropyl]thiazole-…

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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) 2.90 4.89 -9.55 1 3 0 42 246.335 4 ↓

Analogs

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Popular Name: N-[(2S)-2-phenylpropyl]thiazole-4-carboxamide N-[(2S)-2-phenylpropyl]thiazole-…

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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) 2.90 4.88 -9.54 1 3 0 42 246.335 4 ↓

Analogs

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Popular Name: N-[2-[4-(difluoromethoxy)phenyl]ethyl]thiazole-4-carboxamide N-[2-[4-(difluoromethoxy)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) 2.72 3.89 -13.11 1 4 0 51 298.314 6 ↓

Analogs

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Popular Name: methyl methyl

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.95 5.52 -13.28 1 5 0 68 290.344 6 ↓

Analogs

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Popular Name: methyl methyl

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.95 5.52 -13.34 1 5 0 68 290.344 6 ↓

Analogs

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Popular Name: N-[(1S)-2-(2-chlorophenyl)-1-methyl-ethyl]thiazole-4-carboxamide N-[(1S)-2-(2-chlorophenyl)-1-met…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.06 5.66 -10.6 1 3 0 42 280.78 4 ↓

Analogs

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Popular Name: N-[(1R)-2-(2-chlorophenyl)-1-methyl-ethyl]thiazole-4-carboxamide N-[(1R)-2-(2-chlorophenyl)-1-met…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.06 5.67 -10.61 1 3 0 42 280.78 4 ↓

Analogs

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Popular Name: N-[(1S)-2-(4-chlorophenyl)-1-methyl-ethyl]thiazole-4-carboxamide N-[(1S)-2-(4-chlorophenyl)-1-met…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.11 5.84 -10.22 1 3 0 42 280.78 4 ↓

Analogs

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Popular Name: N-[(1R)-2-(4-chlorophenyl)-1-methyl-ethyl]thiazole-4-carboxamide N-[(1R)-2-(4-chlorophenyl)-1-met…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.11 5.83 -10.24 1 3 0 42 280.78 4 ↓

Analogs

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Popular Name: N-[(1S)-2-(4-bromophenyl)-1-methyl-ethyl]thiazole-4-carboxamide N-[(1S)-2-(4-bromophenyl)-1-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) 3.24 5.95 -10.22 1 3 0 42 325.231 4 ↓

Analogs

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Popular Name: N-[(1R)-2-(4-bromophenyl)-1-methyl-ethyl]thiazole-4-carboxamide N-[(1R)-2-(4-bromophenyl)-1-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) 3.24 5.94 -10.18 1 3 0 42 325.231 4 ↓

Analogs

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Popular Name: N-ethyl-N-phenethyl-thiazole-4-carboxamide N-ethyl-N-phenethyl-thiazole-4-c…

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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) 2.73 8.41 -9.85 0 3 0 33 260.362 5 ↓

Analogs

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Popular Name: N-methyl-N-phenethyl-thiazole-4-carboxamide N-methyl-N-phenethyl-thiazole-4-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.35 7.05 -10.15 0 3 0 33 246.335 4 ↓

Analogs

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Popular Name: N-[2-(4-nitrophenyl)ethyl]thiazole-4-carboxamide N-[2-(4-nitrophenyl)ethyl]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) 2.06 5.02 -14.35 1 6 0 88 277.305 5 ↓

Analogs

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Popular Name: N-[(2R)-2-(dimethylamino)-2-phenyl-ethyl]thiazole-4-carboxamide N-[(2R)-2-(dimethylamino)-2-phen…

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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) 1.91 5.41 -39.62 2 4 1 46 276.385 5 ↓
Mid Mid (pH 6-8) 1.91 3.52 -9.37 1 4 0 45 275.377 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(dimethylamino)-2-phenyl-ethyl]thiazole-4-carboxamide N-[(2S)-2-(dimethylamino)-2-phen…

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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) 1.91 5.41 -40 2 4 1 46 276.385 5 ↓
Mid Mid (pH 6-8) 1.91 2.89 -9.11 1 4 0 45 275.377 5 ↓

Analogs

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Popular Name: N-[2-(m-tolyl)ethyl]thiazole-4-carboxamide N-[2-(m-tolyl)ethyl]thiazole-4-c…

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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 4.97 -9.95 1 3 0 42 246.335 4 ↓

Analogs

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Popular Name: N-[2-(3,5-difluorophenyl)ethyl]thiazole-4-carboxamide N-[2-(3,5-difluorophenyl)ethyl]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) 2.36 4.44 -10.44 1 3 0 42 268.288 4 ↓

Analogs

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Popular Name: N-[(1S)-2-(4-fluorophenyl)-1-methyl-ethyl]thiazole-4-carboxamide N-[(1S)-2-(4-fluorophenyl)-1-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) 2.60 5.39 -10.98 1 3 0 42 264.325 4 ↓

Analogs

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Popular Name: N-[(1R)-2-(4-fluorophenyl)-1-methyl-ethyl]thiazole-4-carboxamide N-[(1R)-2-(4-fluorophenyl)-1-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) 2.60 5.38 -10.98 1 3 0 42 264.325 4 ↓

Analogs

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Popular Name: N-[(1S)-1-methyl-2-phenyl-ethyl]thiazole-4-carboxamide N-[(1S)-1-methyl-2-phenyl-ethyl]…

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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) 2.44 5.32 -10.09 1 3 0 42 246.335 4 ↓

Analogs

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Popular Name: N-[(1R)-1-methyl-2-phenyl-ethyl]thiazole-4-carboxamide N-[(1R)-1-methyl-2-phenyl-ethyl]…

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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) 2.44 5.31 -10.06 1 3 0 42 246.335 4 ↓

Analogs

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Popular Name: N-[(2S)-2-amino-2-phenyl-ethyl]thiazole-4-carboxamide N-[(2S)-2-amino-2-phenyl-ethyl]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) -0.58 1.91 -48.38 4 4 1 70 248.331 4 ↓
Mid Mid (pH 6-8) -0.58 1.55 -9.71 3 4 0 68 247.323 4 ↓

Analogs

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Popular Name: N-[(2R)-2-amino-2-phenyl-ethyl]thiazole-4-carboxamide N-[(2R)-2-amino-2-phenyl-ethyl]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) -0.58 1.91 -48.37 4 4 1 70 248.331 4 ↓
Mid Mid (pH 6-8) -0.58 1.47 -9.53 3 4 0 68 247.323 4 ↓

Analogs

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Popular Name: N-[(2S)-2-(dimethylamino)-2-(p-tolyl)ethyl]-2-(methoxymethyl)thiazole-4-carboxamide N-[(2S)-2-(dimethylamino)-2-(p-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) 2.05 5.87 -40.17 2 5 1 56 334.465 7 ↓
Mid Mid (pH 6-8) 2.05 3.63 -8.88 1 5 0 54 333.457 7 ↓

Analogs

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Popular Name: N-[(2R)-2-(dimethylamino)-2-(p-tolyl)ethyl]-2-(methoxymethyl)thiazole-4-carboxamide N-[(2R)-2-(dimethylamino)-2-(p-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) 2.05 5.87 -40 2 5 1 56 334.465 7 ↓
Mid Mid (pH 6-8) 2.05 3.85 -9.46 1 5 0 54 333.457 7 ↓

Analogs

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Popular Name: N-phenethylthiazole-4-carboxamide N-phenethylthiazole-4-carboxamide

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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) 2.11 4.31 -9.89 1 3 0 42 232.308 4 ↓

Analogs

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Popular Name: N-[2-(4-fluorophenyl)ethyl]thiazole-4-carboxamide N-[2-(4-fluorophenyl)ethyl]thiaz…

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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 4.37 -10.73 1 3 0 42 250.298 4 ↓

Analogs

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Popular Name: N-[2-(4-methoxyphenyl)ethyl]thiazole-4-carboxamide N-[2-(4-methoxyphenyl)ethyl]thia…

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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) 2.16 3.61 -11.43 1 4 0 51 262.334 5 ↓

Analogs

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Popular Name: N-[2-(4-sulfamoylphenyl)ethyl]thiazole-4-carboxamide N-[2-(4-sulfamoylphenyl)ethyl]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) 0.80 -0.73 -18.02 3 6 0 102 311.388 5 ↓

Analogs

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Popular Name: N-[2-(3,4-dimethoxyphenyl)ethyl]thiazole-4-carboxamide N-[2-(3,4-dimethoxyphenyl)ethyl]…

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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) 1.75 3.5 -14 1 5 0 60 292.36 6 ↓

Analogs

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Popular Name: N-[2-(3-chlorophenyl)-2-methyl-propyl]thiazole-4-carboxamide N-[2-(3-chlorophenyl)-2-methyl-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) 3.73 5.88 -8.74 1 3 0 42 294.807 4 ↓

Analogs

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Popular Name: N-[2-(4-chlorophenyl)ethyl]thiazole-4-carboxamide N-[2-(4-chlorophenyl)ethyl]thiaz…

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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) 2.78 4.83 -10.03 1 3 0 42 266.753 4 ↓

Analogs

16227983
16227983
16227984
16227984
16234766
16234766

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Popular Name: N-[2-(4-hydroxyphenyl)ethyl]-2-(methoxymethyl)thiazole-4-carboxamide N-[2-(4-hydroxyphenyl)ethyl]-2-(…

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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) 1.31 1.24 -11.69 2 5 0 71 292.36 6 ↓

Analogs

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Popular Name: 2-methyl-N-[2-(o-tolyl)ethyl]thiazole-4-carboxamide 2-methyl-N-[2-(o-tolyl)ethyl]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) 2.22 5.5 -9.44 1 3 0 42 260.362 4 ↓

Analogs

33880983
33880983

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Popular Name: N-[2-(3-chlorophenyl)ethyl]-2-methyl-thiazole-4-carboxamide N-[2-(3-chlorophenyl)ethyl]-2-me…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.47 5.55 -9.77 1 3 0 42 280.78 4 ↓

Analogs

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Popular Name: 2-methyl-N-(2-methyl-2-phenyl-propyl)thiazole-4-carboxamide 2-methyl-N-(2-methyl-2-phenyl-pr…

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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) 2.79 6.09 -8.97 1 3 0 42 274.389 4 ↓

Parameters Provided:

ring.id = 15216
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 = 15216 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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