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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: 3-chloro-4-fluoro-N-[(1-phenylpyrazol-4-yl)methyl]aniline 3-chloro-4-fluoro-N-[(1-phenylpy…

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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 8.86 -9.3 1 3 0 30 301.752 4 ↓

Analogs

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Popular Name: 3-iodo-N-[(1-phenylpyrazol-4-yl)methyl]aniline 3-iodo-N-[(1-phenylpyrazol-4-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) 3.90 9.38 -7.13 1 3 0 30 375.213 4 ↓

Analogs

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Popular Name: 2-chloro-4-methyl-N-[(1-phenylpyrazol-4-yl)methyl]aniline 2-chloro-4-methyl-N-[(1-phenylpy…

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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) 3.90 9.54 -7.22 1 3 0 30 297.789 4 ↓

Analogs

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Popular Name: 2-chloro-4-fluoro-N-[(1-phenylpyrazol-4-yl)methyl]aniline 2-chloro-4-fluoro-N-[(1-phenylpy…

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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 8.96 -8 1 3 0 30 301.752 4 ↓

Analogs

12536547
12536547

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Popular Name: N,N-diethyl-4-[[(1S)-1-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]ethyl]amino]-3-nitro-benzenesulfona N,N-diethyl-4-[[(1S)-1-[1-(4-flu…

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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) 3.74 10.01 -18.34 1 9 0 113 475.546 9 ↓

Analogs

12536546
12536546

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Popular Name: N,N-diethyl-4-[[(1R)-1-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]ethyl]amino]-3-nitro-benzenesulfona N,N-diethyl-4-[[(1R)-1-[1-(4-flu…

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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) 3.74 9.99 -17.84 1 9 0 113 475.546 9 ↓

Analogs

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Popular Name: 4-chloro-3-fluoro-N-[(1-phenylpyrazol-4-yl)methyl]aniline 4-chloro-3-fluoro-N-[(1-phenylpy…

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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 8.86 -9.15 1 3 0 30 301.752 4 ↓

Analogs

30654018
30654018
12608010
12608010
30654014
30654014
30654038
30654038

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Popular Name: 5-bromo-2-methyl-N-[(1-phenylpyrazol-4-yl)methyl]aniline 5-bromo-2-methyl-N-[(1-phenylpyr…

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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 9.71 -7.02 1 3 0 30 342.24 4 ↓

Analogs

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Popular Name: 2-chloro-4-iodo-N-[(1-phenylpyrazol-4-yl)methyl]aniline 2-chloro-4-iodo-N-[(1-phenylpyra…

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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) 4.53 9.98 -7.42 1 3 0 30 409.658 4 ↓

Analogs

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Popular Name: 1-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]phenyl]ethanone 1-[4-[(3,5-dimethyl-1-phenyl-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) 3.19 9.61 -12.42 1 4 0 47 319.408 5 ↓

Analogs

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Popular Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-methoxy-aniline N-[(3,5-dimethyl-1-phenyl-pyrazo…

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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) 3.30 8.59 -8.61 1 4 0 39 307.397 5 ↓

Analogs

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Popular Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,5-dimethoxy-aniline N-[(3,5-dimethyl-1-phenyl-pyrazo…

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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) 3.33 7.87 -9.54 1 5 0 48 337.423 6 ↓

Analogs

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Popular Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-ethoxy-aniline N-[(3,5-dimethyl-1-phenyl-pyrazo…

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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 9.54 -8.64 1 4 0 39 321.424 6 ↓

Analogs

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Popular Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3,4-dimethoxy-aniline N-[(3,5-dimethyl-1-phenyl-pyrazo…

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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 8.37 -11.53 1 5 0 48 337.423 6 ↓

Analogs

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Popular Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,4-difluoro-aniline N-[(3,5-dimethyl-1-phenyl-pyrazo…

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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 9.33 -9.02 1 3 0 30 313.351 4 ↓

Analogs

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Popular Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,5-difluoro-aniline N-[(3,5-dimethyl-1-phenyl-pyrazo…

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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 9.34 -7.82 1 3 0 30 313.351 4 ↓

Analogs

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Popular Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-fluoro-aniline N-[(3,5-dimethyl-1-phenyl-pyrazo…

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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) 3.40 9.27 -8.72 1 3 0 30 295.361 4 ↓

Analogs

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Popular Name: methyl 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) 3.44 9.8 -11.86 1 5 0 56 335.407 6 ↓

Analogs

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Popular Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,4-dimethoxy-aniline N-[(3,5-dimethyl-1-phenyl-pyrazo…

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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) 3.33 7.88 -9.94 1 5 0 48 337.423 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3,5-dimethoxy-aniline N-[(3,5-dimethyl-1-phenyl-pyrazo…

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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) 3.33 7.79 -9.94 1 5 0 48 337.423 6 ↓

Analogs

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Popular Name: (2R)-1-[N-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl]anilino]propan-2-ol (2R)-1-[N-[(5-chloro-3-methyl-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) 3.84 8.97 -8.08 1 4 0 41 355.869 6 ↓

Analogs

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Popular Name: (2S)-1-[N-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl]anilino]propan-2-ol (2S)-1-[N-[(5-chloro-3-methyl-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) 3.84 8.73 -10.9 1 4 0 41 355.869 6 ↓

Analogs

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Popular Name: 2-fluoro-4-[(1-phenylpyrazol-4-yl)methylamino]phenol 2-fluoro-4-[(1-phenylpyrazol-4-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) 2.72 5.5 -10.57 2 4 0 50 283.306 4 ↓

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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