UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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) 2.69 6.12 -53.04 3 3 1 54 220.292 4 ↓
Hi High (pH 8-9.5) 2.69 5.72 -5.88 2 3 0 52 219.284 4 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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 7.12 -5.24 1 3 0 38 219.284 4 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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) 3.26 6.24 -4.63 2 3 0 52 223.247 3 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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 6.87 -7.47 2 6 0 98 250.254 4 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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) 3.52 6.93 -4.91 2 3 0 52 219.284 3 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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) 3.26 6.23 -3.76 2 3 0 52 223.247 3 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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 6.12 -8.55 2 3 0 52 223.247 3 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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) 2.49 6.9 -52.8 3 3 1 54 234.319 5 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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 4.37 -8.33 2 4 0 59 249.31 6 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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 6.11 -48.52 3 3 1 54 220.292 4 ↓
Hi High (pH 8-9.5) 2.67 5.71 -6.88 2 3 0 52 219.284 4 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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 6.79 -3.47 2 3 0 52 284.153 3 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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) 3.41 6.94 -6.51 2 3 0 52 273.254 4 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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) 3.83 9.79 -12.17 0 6 0 81 279.292 6 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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) 3.60 9.24 -11 0 7 0 91 309.318 7 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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) 3.71 8.78 -8.4 0 2 0 26 222.259 3 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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 6.88 -5.3 2 6 0 98 250.254 4 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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) 4.18 7.26 -3.91 2 3 0 52 331.153 3 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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) 3.92 7.59 -4.84 2 3 0 52 233.311 3 ↓

Analogs

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Popular Name: cyclopentyl cyclopentyl

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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) 3.88 6.87 -4.23 2 3 0 52 284.153 3 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 2.97 8.35 -6.81 0 6 0 81 279.292 5 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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 6.4 -7.88 0 5 0 54 359.216 6 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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 7.16 -6.13 0 3 0 36 238.258 4 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.92 8 -6.61 0 3 0 36 289.158 4 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.31 8.42 -7.4 0 6 0 81 279.292 5 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.29 8.81 -14.04 0 7 0 91 309.318 7 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.67 10.26 -15.32 0 5 0 56 347.455 9 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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 5.88 -12.49 2 7 0 107 280.28 5 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.00 7.24 -9.44 0 5 0 54 294.347 7 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.27 7.82 -9.45 0 5 0 54 306.358 8 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.65 7.62 -5.86 0 3 0 36 254.713 4 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 2.75 7.13 -10.98 0 3 0 36 238.258 4 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.18 6.59 -9.29 0 5 0 54 316.3 7 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.61 8.72 -7.21 0 6 0 81 391.161 5 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.13 6.3 -18.16 2 6 0 77 320.389 6 ↓

Analogs

32222340
32222340

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.76 7.71 -7.48 0 3 0 36 299.164 4 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.56 6.68 -9.24 0 4 0 45 286.274 6 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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 8.11 -6.51 0 3 0 36 333.609 4 ↓

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 1.89 6.12 -11.88 1 5 0 65 291.347 6 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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 7.64 -6.76 0 3 0 36 234.295 4 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.92 8 -6.38 0 3 0 36 289.158 4 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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 7.9 -6.56 0 5 0 54 328.792 7 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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 7.23 -5.1 0 3 0 36 256.248 4 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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 7.72 -5.75 0 3 0 36 299.164 4 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.72 8.64 -12.01 0 6 0 81 299.71 5 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.18 7.8 -10.18 0 3 0 36 252.285 4 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.54 7.74 -7.96 0 3 0 36 317.154 4 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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 6.04 -16.56 1 5 0 65 295.31 5 ↓

Analogs

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Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.67 8 -7.44 0 3 0 36 346.164 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

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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) 3.01 6.4 -9.37 0 4 0 45 250.294 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S,2S)-2-methoxycyclopentyl] [(1S,2S)-2-methoxycyclopentyl]

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 7.16 -8.14 0 3 0 36 238.258 4 ↓

Parameters Provided:

ring.id = 22101
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 = 22101 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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//zinc12.docking.org/results/combination?ring.id=22101&filter.purchasability=annotated

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