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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-[(3,5-dimethylisoxazol-4-yl)methoxy]indan-1-amine (1S)-4-[(3,5-dimethylisoxazol-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) 0.15 5.2 -50.35 3 4 1 63 259.329 3 ↓
Hi High (pH 8-9.5) 0.15 4.88 -8.28 2 4 0 61 258.321 3 ↓

Analogs

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Popular Name: (1R)-4-[(3,5-dimethylisoxazol-4-yl)methoxy]indan-1-amine (1R)-4-[(3,5-dimethylisoxazol-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) 0.15 5.19 -52.19 3 4 1 63 259.329 3 ↓
Hi High (pH 8-9.5) 0.15 4.88 -9.07 2 4 0 61 258.321 3 ↓

Analogs

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Popular Name: (1S)-4-(isoxazol-4-ylmethoxy)indan-1-amine (1S)-4-(isoxazol-4-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) -0.29 3.91 -49.61 3 4 1 63 231.275 3 ↓
Hi High (pH 8-9.5) -0.29 3.6 -7.89 2 4 0 61 230.267 3 ↓

Analogs

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Popular Name: (1R)-4-(isoxazol-4-ylmethoxy)indan-1-amine (1R)-4-(isoxazol-4-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) -0.29 3.91 -50.99 3 4 1 63 231.275 3 ↓
Hi High (pH 8-9.5) -0.29 3.62 -8.81 2 4 0 61 230.267 3 ↓

Analogs

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Popular Name: (1S)-4-[(3,5-dimethylisoxazol-4-yl)methoxy]-N-methyl-indan-1-amine (1S)-4-[(3,5-dimethylisoxazol-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) 2.40 6.85 -45.3 2 4 1 52 273.356 4 ↓
Hi High (pH 8-9.5) 2.40 5.6 -8.06 1 4 0 47 272.348 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-4-[(3,5-dimethylisoxazol-4-yl)methoxy]-N-methyl-indan-1-amine (1R)-4-[(3,5-dimethylisoxazol-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) 2.40 6.99 -46.35 2 4 1 52 273.356 4 ↓
Hi High (pH 8-9.5) 2.40 5.51 -8.79 1 4 0 47 272.348 4 ↓

Analogs

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Popular Name: (1R)-4-(isoxazol-4-ylmethoxy)-N-methyl-indan-1-amine (1R)-4-(isoxazol-4-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) 1.96 5.57 -44.23 2 4 1 52 245.302 4 ↓
Hi High (pH 8-9.5) 1.96 4.32 -7.71 1 4 0 47 244.294 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-4-(isoxazol-4-ylmethoxy)-N-methyl-indan-1-amine (1S)-4-(isoxazol-4-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) 1.96 5.73 -45.3 2 4 1 52 245.302 4 ↓
Hi High (pH 8-9.5) 1.96 4.25 -8.45 1 4 0 47 244.294 4 ↓

Analogs

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Popular Name: (1R)-4-[(3,5-dimethylisoxazol-4-yl)methoxy]-N-ethyl-indan-1-amine (1R)-4-[(3,5-dimethylisoxazol-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) 2.78 7.71 -43.81 2 4 1 52 287.383 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-4-[(3,5-dimethylisoxazol-4-yl)methoxy]-N-ethyl-indan-1-amine (1S)-4-[(3,5-dimethylisoxazol-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) 2.78 7.89 -44.83 2 4 1 52 287.383 5 ↓

Analogs

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Popular Name: (1R)-N-ethyl-4-(isoxazol-4-ylmethoxy)indan-1-amine (1R)-N-ethyl-4-(isoxazol-4-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) 2.34 6.4 -42.84 2 4 1 52 259.329 5 ↓

Analogs

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Popular Name: (1S)-N-ethyl-4-(isoxazol-4-ylmethoxy)indan-1-amine (1S)-N-ethyl-4-(isoxazol-4-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) 2.34 6.58 -43.92 2 4 1 52 259.329 5 ↓

Analogs

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Popular Name: (1R)-4-(isoxazol-4-ylmethoxy)-N-propyl-indan-1-amine (1R)-4-(isoxazol-4-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) 2.84 7.16 -43.59 2 4 1 52 273.356 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-4-(isoxazol-4-ylmethoxy)-N-propyl-indan-1-amine (1S)-4-(isoxazol-4-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) 2.84 7.34 -44.7 2 4 1 52 273.356 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-4-[(3,5-dimethylisoxazol-4-yl)methoxy]indan-1-ol (1S)-4-[(3,5-dimethylisoxazol-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) 1.85 4.57 -10.4 1 4 0 55 259.305 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-4-[(3,5-dimethylisoxazol-4-yl)methoxy]indan-1-ol (1R)-4-[(3,5-dimethylisoxazol-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) 1.85 4.58 -10.27 1 4 0 55 259.305 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-4-(isoxazol-4-ylmethoxy)indan-1-ol (1S)-4-(isoxazol-4-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) 1.40 3.3 -9.93 1 4 0 55 231.251 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-4-(isoxazol-4-ylmethoxy)indan-1-ol (1R)-4-(isoxazol-4-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) 1.40 3.3 -9.99 1 4 0 55 231.251 3 ↓

Parameters Provided:

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Structural Results Found: (before additional filtering)

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