UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (4-[1,3]Thiazolo[5,4-{b}]pyridin-2-ylphenyl)amine (4-[1,3]Thiazolo[5,4-{b}]pyridin…

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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 -3.22 -10.42 2 3 0 52 227.292 1 ↓

Analogs

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Popular Name: N-sec-butyl-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-4-carboxamide N-sec-butyl-1-thiazolo[5,4-b]pyr…

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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 5.4 -15.93 1 5 0 58 318.446 4 ↓

Analogs

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Popular Name: N-sec-butyl-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-4-carboxamide N-sec-butyl-1-thiazolo[5,4-b]pyr…

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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 5.41 -15.92 1 5 0 58 318.446 4 ↓

Analogs

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Popular Name: N-isopropyl-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-4-carboxamide N-isopropyl-1-thiazolo[5,4-b]pyr…

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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) 2.25 4.45 -15.96 1 5 0 58 304.419 3 ↓

Analogs

20996227
20996227
15770068
15770068
15770089
15770089
15770171
15770171

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Popular Name: N-propyl-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-4-carboxamide N-propyl-1-thiazolo[5,4-b]pyridi…

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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) 2.46 4.38 -16.07 1 5 0 58 304.419 4 ↓

Analogs

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Popular Name: N-cyclopropyl-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-4-carboxamide N-cyclopropyl-1-thiazolo[5,4-b]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) 1.94 4.56 -15.69 1 5 0 58 302.403 3 ↓

Analogs

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Popular Name: N-(2-methoxyethyl)-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-4-carboxamide N-(2-methoxyethyl)-1-thiazolo[5,…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.56 2.7 -16.03 1 6 0 67 320.418 5 ↓

Analogs

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Popular Name: N-allyl-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-4-carboxamide N-allyl-1-thiazolo[5,4-b]pyridin…

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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 4.2 -15.71 1 5 0 58 302.403 4 ↓

Analogs

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Popular Name: (3R)-N-isopropyl-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3R)-N-isopropyl-1-thiazolo[5,4-…

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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) 2.25 4.43 -13.3 1 5 0 58 304.419 3 ↓

Analogs

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Popular Name: (3S)-N-isopropyl-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3S)-N-isopropyl-1-thiazolo[5,4-…

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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) 2.25 4.43 -13.34 1 5 0 58 304.419 3 ↓

Analogs

15770363
15770363
15770365
15770365
15770378
15770378
15770380
15770380
15770410
15770410

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-propyl-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3R)-N-propyl-1-thiazolo[5,4-b]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) 2.46 4.36 -13.34 1 5 0 58 304.419 4 ↓

Analogs

15770378
15770378
15770380
15770380
15770410
15770410
15770412
15770412

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Popular Name: (3S)-N-propyl-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3S)-N-propyl-1-thiazolo[5,4-b]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) 2.46 4.36 -13.34 1 5 0 58 304.419 4 ↓

Analogs

4232446
4232446

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Popular Name: N-(2-methyl-4-thiazolo[5,4-b]pyridin-2-yl-phenyl)-2,1,3-benzothiadiazole-5-carboxamide N-(2-methyl-4-thiazolo[5,4-b]pyr…

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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) 4.73 6.97 -17.88 1 6 0 81 403.492 3 ↓

Analogs

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Popular Name: N-(2-methyl-3-thiazolo[5,4-b]pyridin-2-yl-phenyl)benzofuran-2-carboxamide N-(2-methyl-3-thiazolo[5,4-b]pyr…

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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) 5.20 9.23 -12.81 1 5 0 68 385.448 3 ↓

Analogs

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Popular Name: (2-butyl-4-methyl-thiazol-5-yl)-(4-thiazolo[5,4-b]pyridin-2-ylpiperazin-1-yl)methanone (2-butyl-4-methyl-thiazol-5-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) 3.36 8.54 -13.53 0 6 0 62 401.561 5 ↓

Analogs

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Popular Name: 2-cyclopentyl-1-(4-thiazolo[5,4-b]pyridin-2-ylpiperazin-1-yl)ethanone 2-cyclopentyl-1-(4-thiazolo[5,4-…

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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) 2.96 8.33 -14 0 5 0 49 330.457 3 ↓

Analogs

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Popular Name: 2-[4-(o-tolylmethyl)piperazin-1-yl]thiazolo[5,4-b]pyridine 2-[4-(o-tolylmethyl)piperazin-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) 3.39 8.26 -9.14 0 4 0 32 324.453 3 ↓
Mid Mid (pH 6-8) 3.39 10.13 -48.11 1 4 1 33 325.461 3 ↓

Analogs

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Popular Name: N-[2-(3,4-difluoroanilino)-2-oxo-ethyl]-2-(4-thiazolo[5,4-b]pyridin-2-ylpiperazin-1-yl)acetamide N-[2-(3,4-difluoroanilino)-2-oxo…

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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) 2.62 4.47 -19.72 2 8 0 90 446.483 6 ↓

Analogs

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Popular Name: (2R)-N-(4-methoxyphenyl)-2-phenyl-2-(4-thiazolo[5,4-b]pyridin-2-ylpiperazin-1-yl)acetamide (2R)-N-(4-methoxyphenyl)-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) 4.03 8.93 -14.42 1 7 0 71 459.575 6 ↓

Analogs

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Popular Name: (2S)-N-(4-methoxyphenyl)-2-phenyl-2-(4-thiazolo[5,4-b]pyridin-2-ylpiperazin-1-yl)acetamide (2S)-N-(4-methoxyphenyl)-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) 4.03 8.79 -14.73 1 7 0 71 459.575 6 ↓

Analogs

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Popular Name: (3-methyl-2-furyl)-(4-thiazolo[5,4-b]pyridin-2-ylpiperazin-1-yl)methanone (3-methyl-2-furyl)-(4-thiazolo[5…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.26 6.69 -13.25 0 6 0 62 328.397 2 ↓

Analogs

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Popular Name: (3,5-dimethylisoxazol-4-yl)-(4-thiazolo[5,4-b]pyridin-2-ylpiperazin-1-yl)methanone (3,5-dimethylisoxazol-4-yl)-(4-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) 1.01 6.38 -14.87 0 7 0 75 343.412 2 ↓

Analogs

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Popular Name: (4-thiazolo[5,4-b]pyridin-2-ylpiperazin-1-yl)-(3-thienyl)methanone (4-thiazolo[5,4-b]pyridin-2-ylpi…

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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) 1.74 6.66 -13.95 0 5 0 49 330.438 2 ↓

Analogs

35504968
35504968
35504971
35504971
35504974
35504974
35514884
35514884
35514891
35514891

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Popular Name: N-(3-chloro-4-fluoro-phenyl)-4-thiazolo[5,4-b]pyridin-2-yl-1,4-diazepane-1-carboxamide N-(3-chloro-4-fluoro-phenyl)-4-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) 3.98 9.29 -14.99 1 6 0 61 405.886 2 ↓

Analogs

35504974
35504974
35514884
35514884
35514891
35514891

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Popular Name: ethyl 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) 3.62 11.13 -19.26 1 8 0 88 439.541 6 ↓

Analogs

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Popular Name: azepan-1-yl-[(3S)-1-thiazolo[5,4-b]pyridin-2-yl-3-piperidyl]methanone azepan-1-yl-[(3S)-1-thiazolo[5,4…

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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) 3.23 9.04 -11.05 0 5 0 49 344.484 2 ↓

Analogs

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Popular Name: azepan-1-yl-[(3R)-1-thiazolo[5,4-b]pyridin-2-yl-3-piperidyl]methanone azepan-1-yl-[(3R)-1-thiazolo[5,4…

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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) 3.23 9.07 -11.15 0 5 0 49 344.484 2 ↓

Analogs

15770424
15770424
15770426
15770426

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Popular Name: (4-benzylpiperazin-1-yl)-[(3R)-1-thiazolo[5,4-b]pyridin-2-yl-3-piperidyl]methanone (4-benzylpiperazin-1-yl)-[(3R)-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) 3.11 9.21 -12.15 0 6 0 53 421.57 4 ↓
Mid Mid (pH 6-8) 3.11 11.41 -51.11 1 6 1 54 422.578 4 ↓

Analogs

15770424
15770424
15770426
15770426

Draw Identity 99% 90% 80% 70%

Popular Name: (4-benzylpiperazin-1-yl)-[(3S)-1-thiazolo[5,4-b]pyridin-2-yl-3-piperidyl]methanone (4-benzylpiperazin-1-yl)-[(3S)-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) 3.11 9.25 -11.77 0 6 0 53 421.57 4 ↓
Mid Mid (pH 6-8) 3.11 11.46 -50.07 1 6 1 54 422.578 4 ↓

Analogs

35505087
35505087
35505091
35505091
20996374
20996374
20996372
20996372

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Popular Name: (4-propylpiperazin-1-yl)-[(3R)-1-thiazolo[5,4-b]pyridin-2-yl-3-piperidyl]methanone (4-propylpiperazin-1-yl)-[(3R)-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) 2.59 9.25 -47.87 1 6 1 54 374.534 4 ↓
Mid Mid (pH 6-8) 2.59 7.03 -10.93 0 6 0 53 373.526 4 ↓

Analogs

35505087
35505087
35505091
35505091
20996374
20996374
20996372
20996372

Draw Identity 99% 90% 80% 70%

Popular Name: (4-propylpiperazin-1-yl)-[(3S)-1-thiazolo[5,4-b]pyridin-2-yl-3-piperidyl]methanone (4-propylpiperazin-1-yl)-[(3S)-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) 2.59 9.31 -47.53 1 6 1 54 374.534 4 ↓
Mid Mid (pH 6-8) 2.59 7.09 -11 0 6 0 53 373.526 4 ↓

Analogs

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Popular Name: [4-(furan-2-carbonyl)piperazin-1-yl]-[(3S)-1-thiazolo[5,4-b]pyridin-2-yl-3-piperidyl]methanone [4-(furan-2-carbonyl)piperazin-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) 2.00 7.93 -16.28 0 8 0 83 425.514 3 ↓

Analogs

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Popular Name: [4-(furan-2-carbonyl)piperazin-1-yl]-[(3R)-1-thiazolo[5,4-b]pyridin-2-yl-3-piperidyl]methanone [4-(furan-2-carbonyl)piperazin-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) 2.00 7.94 -19.51 0 8 0 83 425.514 3 ↓

Analogs

9725121
9725121
9725128
9725128

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Popular Name: (3R)-N-(2-furylmethyl)-N-methyl-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3R)-N-(2-furylmethyl)-N-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) 2.48 7.99 -13.21 0 6 0 62 356.451 4 ↓

Analogs

9725121
9725121
9725128
9725128

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-(2-furylmethyl)-N-methyl-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3S)-N-(2-furylmethyl)-N-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) 2.48 8.06 -12.9 0 6 0 62 356.451 4 ↓

Analogs

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Popular Name: (3R)-N-(4-acetylphenyl)-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3R)-N-(4-acetylphenyl)-1-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) 3.17 8.4 -16.31 1 6 0 75 380.473 4 ↓

Analogs

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Popular Name: (3S)-N-(4-acetylphenyl)-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3S)-N-(4-acetylphenyl)-1-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) 3.17 8.41 -16.24 1 6 0 75 380.473 4 ↓

Analogs

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Popular Name: (3R)-1-thiazolo[5,4-b]pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]piperidine-3-carboxamide (3R)-1-thiazolo[5,4-b]pyridin-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) 4.12 9.17 -11.87 1 5 0 58 406.433 4 ↓

Analogs

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Popular Name: (3S)-1-thiazolo[5,4-b]pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]piperidine-3-carboxamide (3S)-1-thiazolo[5,4-b]pyridin-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) 4.12 9.19 -12 1 5 0 58 406.433 4 ↓

Analogs

35505122
35505122
35505125
35505125

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Popular Name: (3R)-N-(4-chloro-2-methyl-phenyl)-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3R)-N-(4-chloro-2-methyl-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) 4.33 9.32 -12.52 1 5 0 58 386.908 3 ↓

Analogs

35505122
35505122
35505125
35505125

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-(4-chloro-2-methyl-phenyl)-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3S)-N-(4-chloro-2-methyl-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) 4.33 9.31 -12.49 1 5 0 58 386.908 3 ↓

Analogs

35505116
35505116
35505119
35505119

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Popular Name: (3R)-N-(5-chloro-2-methyl-phenyl)-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3R)-N-(5-chloro-2-methyl-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) 4.33 9.34 -13.67 1 5 0 58 386.908 3 ↓

Analogs

35505116
35505116
35505119
35505119

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-(5-chloro-2-methyl-phenyl)-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3S)-N-(5-chloro-2-methyl-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) 4.33 9.32 -13.59 1 5 0 58 386.908 3 ↓

Analogs

15770527
15770527
15770529
15770529

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Popular Name: (3S)-N-[2-(4-chlorophenyl)ethyl]-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3S)-N-[2-(4-chlorophenyl)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) 4.06 9.32 -14.07 1 5 0 58 400.935 5 ↓

Analogs

15770527
15770527
15770529
15770529

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Popular Name: (3R)-N-[2-(4-chlorophenyl)ethyl]-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3R)-N-[2-(4-chlorophenyl)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) 4.06 9.34 -14.09 1 5 0 58 400.935 5 ↓

Analogs

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Popular Name: (3R)-N-(2,6-dimethylphenyl)-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3R)-N-(2,6-dimethylphenyl)-1-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) 3.14 9.44 -12.62 1 5 0 58 366.49 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-(2,6-dimethylphenyl)-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3S)-N-(2,6-dimethylphenyl)-1-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) 3.14 9.76 -13.07 1 5 0 58 366.49 3 ↓

Analogs

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Popular Name: ethyl 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) 3.80 9.48 -19.02 1 7 0 84 410.499 6 ↓

Analogs

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Popular Name: ethyl 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) 3.80 9.5 -19.36 1 7 0 84 410.499 6 ↓

Analogs

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Popular Name: (3R)-N-(4-ethylphenyl)-1-thiazolo[5,4-b]pyridin-2-yl-piperidine-3-carboxamide (3R)-N-(4-ethylphenyl)-1-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) 4.19 9.35 -12.67 1 5 0 58 366.49 4 ↓

Parameters Provided:

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Structural Results Found: (before additional filtering)

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