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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: (1S)-4-(isoxazol-5-ylmethoxy)indan-1-amine (1S)-4-(isoxazol-5-ylmethoxy)ind…

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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) 0.02 4.08 -50.54 3 4 1 63 231.275 3 ↓
Hi High (pH 8-9.5) 0.02 3.78 -8.71 2 4 0 61 230.267 3 ↓

Analogs

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Popular Name: (1R)-4-(isoxazol-5-ylmethoxy)indan-1-amine (1R)-4-(isoxazol-5-ylmethoxy)ind…

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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) 0.02 4.08 -51.5 3 4 1 63 231.275 3 ↓
Hi High (pH 8-9.5) 0.02 3.79 -9.76 2 4 0 61 230.267 3 ↓

Analogs

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Popular Name: (1S)-4-[(3-methylisoxazol-5-yl)methoxy]indan-1-amine (1S)-4-[(3-methylisoxazol-5-yl)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) 0.24 4.68 -50.81 3 4 1 63 245.302 3 ↓
Hi High (pH 8-9.5) 0.24 4.36 -8.84 2 4 0 61 244.294 3 ↓

Analogs

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Popular Name: (1R)-4-[(3-methylisoxazol-5-yl)methoxy]indan-1-amine (1R)-4-[(3-methylisoxazol-5-yl)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) 0.24 4.67 -51.8 3 4 1 63 245.302 3 ↓
Hi High (pH 8-9.5) 0.24 4.36 -9.88 2 4 0 61 244.294 3 ↓

Analogs

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Popular Name: (1R)-4-(isoxazol-5-ylmethoxy)-N-methyl-indan-1-amine (1R)-4-(isoxazol-5-ylmethoxy)-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) 2.27 5.74 -44.35 2 4 1 52 245.302 4 ↓
Hi High (pH 8-9.5) 2.27 4.49 -8.42 1 4 0 47 244.294 4 ↓

Analogs

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Popular Name: (1S)-4-(isoxazol-5-ylmethoxy)-N-methyl-indan-1-amine (1S)-4-(isoxazol-5-ylmethoxy)-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) 2.27 5.89 -46.13 2 4 1 52 245.302 4 ↓
Hi High (pH 8-9.5) 2.27 4.42 -9.12 1 4 0 47 244.294 4 ↓

Analogs

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Popular Name: (1S)-N-methyl-4-[(3-methylisoxazol-5-yl)methoxy]indan-1-amine (1S)-N-methyl-4-[(3-methylisoxaz…

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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 6.33 -45.66 2 4 1 52 259.329 4 ↓
Hi High (pH 8-9.5) 2.49 5.08 -8.58 1 4 0 47 258.321 4 ↓

Analogs

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Popular Name: (1R)-N-methyl-4-[(3-methylisoxazol-5-yl)methoxy]indan-1-amine (1R)-N-methyl-4-[(3-methylisoxaz…

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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 6.47 -45.95 2 4 1 52 259.329 4 ↓
Hi High (pH 8-9.5) 2.49 4.99 -9.5 1 4 0 47 258.321 4 ↓

Analogs

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Popular Name: (1R)-N-ethyl-4-(isoxazol-5-ylmethoxy)indan-1-amine (1R)-N-ethyl-4-(isoxazol-5-ylmet…

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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) 2.65 6.57 -42.96 2 4 1 52 259.329 5 ↓

Analogs

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Popular Name: (1S)-N-ethyl-4-(isoxazol-5-ylmethoxy)indan-1-amine (1S)-N-ethyl-4-(isoxazol-5-ylmet…

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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) 2.65 6.75 -44.64 2 4 1 52 259.329 5 ↓

Analogs

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Popular Name: (1R)-N-ethyl-4-[(3-methylisoxazol-5-yl)methoxy]indan-1-amine (1R)-N-ethyl-4-[(3-methylisoxazo…

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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) 2.87 7.16 -43.21 2 4 1 52 273.356 5 ↓

Analogs

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Popular Name: (1S)-N-ethyl-4-[(3-methylisoxazol-5-yl)methoxy]indan-1-amine (1S)-N-ethyl-4-[(3-methylisoxazo…

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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) 2.87 7.33 -44.95 2 4 1 52 273.356 5 ↓

Analogs

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Popular Name: (1R)-4-(isoxazol-5-ylmethoxy)-N-propyl-indan-1-amine (1R)-4-(isoxazol-5-ylmethoxy)-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) 3.15 7.34 -43.66 2 4 1 52 273.356 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-4-(isoxazol-5-ylmethoxy)-N-propyl-indan-1-amine (1S)-4-(isoxazol-5-ylmethoxy)-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) 3.15 7.51 -45.52 2 4 1 52 273.356 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-4-[(3-methylisoxazol-5-yl)methoxy]-N-propyl-indan-1-amine (1R)-4-[(3-methylisoxazol-5-yl)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) 3.37 7.92 -43.92 2 4 1 52 287.383 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-4-[(3-methylisoxazol-5-yl)methoxy]-N-propyl-indan-1-amine (1S)-4-[(3-methylisoxazol-5-yl)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) 3.37 8.09 -45.83 2 4 1 52 287.383 6 ↓

Analogs

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Popular Name: (1S)-4-(isoxazol-5-ylmethoxy)indan-1-ol (1S)-4-(isoxazol-5-ylmethoxy)ind…

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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) 1.72 3.47 -10.64 1 4 0 55 231.251 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-4-(isoxazol-5-ylmethoxy)indan-1-ol (1R)-4-(isoxazol-5-ylmethoxy)ind…

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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) 1.72 3.47 -10.84 1 4 0 55 231.251 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-4-[(3-methylisoxazol-5-yl)methoxy]indan-1-ol (1S)-4-[(3-methylisoxazol-5-yl)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 4.05 -10.84 1 4 0 55 245.278 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-4-[(3-methylisoxazol-5-yl)methoxy]indan-1-ol (1R)-4-[(3-methylisoxazol-5-yl)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 4.06 -11.04 1 4 0 55 245.278 3 ↓

Parameters Provided:

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Structural Results Found: (before additional filtering)

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