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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: N-(1,3-thiazol-5-ylmethyl)cyclopentanamine N-(1,3-thiazol-5-ylmethyl)cyclop…

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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) 2.07 4.48 -40.1 2 2 1 29 183.3 3 ↓
Hi High (pH 8-9.5) 2.07 3.25 -3.56 1 2 0 25 182.292 3 ↓

Analogs

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Popular Name: 1-methyl-N-(thiazol-5-ylmethyl)cyclopentanamine 1-methyl-N-(thiazol-5-ylmethyl)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) 2.51 4.83 -37.49 2 2 1 29 197.327 3 ↓
Hi High (pH 8-9.5) 2.51 3.61 -3.5 1 2 0 25 196.319 3 ↓

Analogs

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Popular Name: (1S,2R)-2-methoxy-N-(thiazol-5-ylmethyl)cyclopentanamine (1S,2R)-2-methoxy-N-(thiazol-5-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) 1.53 3.97 -37.6 2 3 1 39 213.326 4 ↓
Mid Mid (pH 6-8) 1.53 2.77 -4.96 1 3 0 34 212.318 4 ↓

Analogs

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Popular Name: (1S,2S)-2-methoxy-N-(thiazol-5-ylmethyl)cyclopentanamine (1S,2S)-2-methoxy-N-(thiazol-5-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) 1.53 3.5 -41.29 2 3 1 39 213.326 4 ↓
Mid Mid (pH 6-8) 1.53 2.28 -4.4 1 3 0 34 212.318 4 ↓

Analogs

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Popular Name: (1R,2R)-2-methoxy-N-(thiazol-5-ylmethyl)cyclopentanamine (1R,2R)-2-methoxy-N-(thiazol-5-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) 1.53 3.44 -40.75 2 3 1 39 213.326 4 ↓
Mid Mid (pH 6-8) 1.53 2.3 -4.82 1 3 0 34 212.318 4 ↓

Analogs

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Popular Name: (1R,2S)-2-methoxy-N-(thiazol-5-ylmethyl)cyclopentanamine (1R,2S)-2-methoxy-N-(thiazol-5-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) 1.53 3.97 -37.63 2 3 1 39 213.326 4 ↓
Mid Mid (pH 6-8) 1.53 2.83 -5.02 1 3 0 34 212.318 4 ↓

Analogs

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Popular Name: [1-(thiazol-5-ylmethylamino)cyclopentyl]methanol [1-(thiazol-5-ylmethylamino)cycl…

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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) 1.50 1.6 -36.07 3 3 1 50 213.326 4 ↓
Mid Mid (pH 6-8) 1.50 0.36 -5.69 2 3 0 45 212.318 4 ↓

Analogs

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Popular Name: (1S,2R)-2-[[(1R)-1-(2,4-dimethylthiazol-5-yl)ethyl]amino]cyclopentanecarbonitrile (1S,2R)-2-[[(1R)-1-(2,4-dimethyl…

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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 5.55 -10.53 1 3 0 49 249.383 3 ↓
Mid Mid (pH 6-8) 2.21 6.57 -42.92 2 3 1 53 250.391 3 ↓

Analogs

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Popular Name: (1S,2R)-2-[[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]amino]cyclopentanecarbonitrile (1S,2R)-2-[[(1S)-1-(2,4-dimethyl…

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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 5.43 -9.89 1 3 0 49 249.383 3 ↓
Mid Mid (pH 6-8) 2.21 6.63 -38.59 2 3 1 53 250.391 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S)-2-[[(1R)-1-(2,4-dimethylthiazol-5-yl)ethyl]amino]cyclopentanecarbonitrile (1S,2S)-2-[[(1R)-1-(2,4-dimethyl…

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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 5.22 -10.5 1 3 0 49 249.383 3 ↓
Mid Mid (pH 6-8) 2.21 6.43 -50.64 2 3 1 53 250.391 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S)-2-[[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]amino]cyclopentanecarbonitrile (1S,2S)-2-[[(1S)-1-(2,4-dimethyl…

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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 5.35 -8.49 1 3 0 49 249.383 3 ↓
Mid Mid (pH 6-8) 2.21 6.38 -47.85 2 3 1 53 250.391 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2R)-2-[(2-methylthiazol-5-yl)methylamino]cyclopentanecarbonitrile (1S,2R)-2-[(2-methylthiazol-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) 1.43 4.39 -10.19 1 3 0 49 221.329 3 ↓
Mid Mid (pH 6-8) 1.43 5.59 -46 2 3 1 53 222.337 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S)-2-[(2-methylthiazol-5-yl)methylamino]cyclopentanecarbonitrile (1S,2S)-2-[(2-methylthiazol-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) 1.43 4.21 -8.9 1 3 0 49 221.329 3 ↓
Mid Mid (pH 6-8) 1.43 5.38 -50.94 2 3 1 53 222.337 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R)-2-[(2-methylthiazol-5-yl)methylamino]cyclopentanecarbonitrile (1R,2R)-2-[(2-methylthiazol-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) 1.43 4.2 -8.03 1 3 0 49 221.329 3 ↓
Mid Mid (pH 6-8) 1.43 5.44 -52.67 2 3 1 53 222.337 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S)-2-[(2-methylthiazol-5-yl)methylamino]cyclopentanecarbonitrile (1R,2S)-2-[(2-methylthiazol-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) 1.43 4.59 -10.43 1 3 0 49 221.329 3 ↓
Mid Mid (pH 6-8) 1.43 5.55 -47.52 2 3 1 53 222.337 3 ↓

Analogs

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Popular Name: N-[(2-tert-butylthiazol-5-yl)methyl]-1-methyl-cyclopentanamine N-[(2-tert-butylthiazol-5-yl)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) 3.95 7.42 -36.87 2 2 1 29 253.435 4 ↓
Hi High (pH 8-9.5) 3.95 6.2 -3.43 1 2 0 25 252.427 4 ↓

Analogs

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Popular Name: N-[(2-tert-butylthiazol-5-yl)methyl]cyclopentanamine N-[(2-tert-butylthiazol-5-yl)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) 3.50 7.07 -39.56 2 2 1 29 239.408 4 ↓
Hi High (pH 8-9.5) 3.50 5.84 -3.56 1 2 0 25 238.4 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [1-[(2-tert-butylthiazol-5-yl)methylamino]cyclopentyl]methanol [1-[(2-tert-butylthiazol-5-yl)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) 2.94 4.18 -35.46 3 3 1 50 269.434 5 ↓
Mid Mid (pH 6-8) 2.94 2.94 -5.73 2 3 0 45 268.426 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2R)-2-[(2-tert-butylthiazol-5-yl)methylamino]cyclopentanecarbonitrile (1S,2R)-2-[(2-tert-butylthiazol-…

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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) 3.15 6.25 -9.84 1 3 0 49 263.41 4 ↓
Mid Mid (pH 6-8) 3.15 7.45 -45.63 2 3 1 53 264.418 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S)-2-[(2-tert-butylthiazol-5-yl)methylamino]cyclopentanecarbonitrile (1S,2S)-2-[(2-tert-butylthiazol-…

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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) 3.15 6.06 -8.47 1 3 0 49 263.41 4 ↓
Mid Mid (pH 6-8) 3.15 7.23 -50.51 2 3 1 53 264.418 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R)-2-[(2-tert-butylthiazol-5-yl)methylamino]cyclopentanecarbonitrile (1R,2R)-2-[(2-tert-butylthiazol-…

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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) 3.15 6.06 -7.58 1 3 0 49 263.41 4 ↓
Mid Mid (pH 6-8) 3.15 7.29 -52.35 2 3 1 53 264.418 4 ↓

Analogs

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Popular Name: (1R,2S)-2-[(2-tert-butylthiazol-5-yl)methylamino]cyclopentanecarbonitrile (1R,2S)-2-[(2-tert-butylthiazol-…

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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) 3.15 6.44 -10.06 1 3 0 49 263.41 4 ↓
Mid Mid (pH 6-8) 3.15 7.4 -47.07 2 3 1 53 264.418 4 ↓

Analogs

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Popular Name: N-[(1R)-1-(2,4-dimethylthiazol-5-yl)ethyl]cyclopentanamine N-[(1R)-1-(2,4-dimethylthiazol-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) 2.56 6.21 -37.65 2 2 1 29 225.381 3 ↓
Hi High (pH 8-9.5) 2.56 5.14 -4.64 1 2 0 25 224.373 3 ↓

Analogs

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Popular Name: N-[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]cyclopentanamine N-[(1S)-1-(2,4-dimethylthiazol-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) 2.56 6.17 -37.59 2 2 1 29 225.381 3 ↓
Hi High (pH 8-9.5) 2.56 5.13 -3.82 1 2 0 25 224.373 3 ↓

Analogs

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Popular Name: 5-[(cyclopentylamino)methyl]-N,N-diethyl-thiazol-2-amine 5-[(cyclopentylamino)methyl]-N,N…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.04 8.12 -38.14 2 3 1 33 254.423 6 ↓
Hi High (pH 8-9.5) 3.04 6.88 -4.84 1 3 0 28 253.415 6 ↓

Analogs

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Popular Name: N-[(1R)-1-(4-methylthiazol-5-yl)ethyl]cyclopentanamine N-[(1R)-1-(4-methylthiazol-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) 2.85 5.47 -37.91 2 2 1 29 211.354 3 ↓
Hi High (pH 8-9.5) 2.85 4.4 -4.25 1 2 0 25 210.346 3 ↓

Analogs

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Popular Name: N-[(1S)-1-(4-methylthiazol-5-yl)ethyl]cyclopentanamine N-[(1S)-1-(4-methylthiazol-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) 2.85 5.52 -38.09 2 2 1 29 211.354 3 ↓
Hi High (pH 8-9.5) 2.85 4.29 -3.52 1 2 0 25 210.346 3 ↓

Analogs

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Popular Name: N-[(1R)-1-(2-tert-butyl-4-methyl-thiazol-5-yl)ethyl]cyclopentanamine N-[(1R)-1-(2-tert-butyl-4-methyl…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.29 8.07 -37.22 2 2 1 29 267.462 4 ↓
Hi High (pH 8-9.5) 4.29 6.99 -4.25 1 2 0 25 266.454 4 ↓

Analogs

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Popular Name: N-[(1S)-1-(2-tert-butyl-4-methyl-thiazol-5-yl)ethyl]cyclopentanamine N-[(1S)-1-(2-tert-butyl-4-methyl…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.29 8.12 -37.38 2 2 1 29 267.462 4 ↓
Hi High (pH 8-9.5) 4.29 6.88 -3.46 1 2 0 25 266.454 4 ↓

Parameters Provided:

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filter.purchasability = annotated
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Structural Results Found: (before additional filtering)

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