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Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-amino-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-1H-pyrrole-2-carboxamide 4-amino-N-methyl-N-[(1-methylpyr…

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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) -0.28 2.47 -13.12 3 6 0 80 233.275 3 ↓
Mid Mid (pH 6-8) -0.72 1.2 -53.63 3 6 1 78 234.283 3 ↓

Analogs

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Popular Name: 4-amino-N,1-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrole-2-carboxamide 4-amino-N,1-dimethyl-N-[(1-methy…

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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) -0.22 3.52 -14.63 2 6 0 69 247.302 3 ↓

Analogs

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Popular Name: 4-amino-1-ethyl-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrole-2-carboxamide 4-amino-1-ethyl-N-methyl-N-[(1-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) 0.16 4.39 -13.83 2 6 0 69 261.329 4 ↓

Analogs

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Popular Name: 4-amino-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-1-propyl-pyrrole-2-carboxamide 4-amino-N-methyl-N-[(1-methylpyr…

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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) 0.66 5.14 -13.59 2 6 0 69 275.356 5 ↓

Analogs

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Popular Name: 4-amino-1-isopropyl-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrole-2-carboxamide 4-amino-1-isopropyl-N-methyl-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) 0.52 4.96 -14.2 2 6 0 69 275.356 4 ↓

Analogs

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Popular Name: 4-amino-N-(1H-pyrazol-4-ylmethyl)-1H-pyrrole-2-carboxamide 4-amino-N-(1H-pyrazol-4-ylmethyl…

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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) -0.60 -1.24 -12.04 5 6 0 100 205.221 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-amino-1-methyl-N-(1H-pyrazol-4-ylmethyl)pyrrole-2-carboxamide 4-amino-1-methyl-N-(1H-pyrazol-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) -0.53 0.39 -10.18 4 6 0 89 219.248 3 ↓

Analogs

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Popular Name: 4-amino-1-ethyl-N-(1H-pyrazol-4-ylmethyl)pyrrole-2-carboxamide 4-amino-1-ethyl-N-(1H-pyrazol-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 1.26 -9.78 4 6 0 89 233.275 4 ↓

Analogs

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Popular Name: 4-amino-1-propyl-N-(1H-pyrazol-4-ylmethyl)pyrrole-2-carboxamide 4-amino-1-propyl-N-(1H-pyrazol-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) 0.35 2.02 -9.72 4 6 0 89 247.302 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-amino-1-isopropyl-N-(1H-pyrazol-4-ylmethyl)pyrrole-2-carboxamide 4-amino-1-isopropyl-N-(1H-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) 0.21 1.84 -9.77 4 6 0 89 247.302 4 ↓

Analogs

37986558
37986558
37986788
37986788

Draw Identity 99% 90% 80% 70%

Popular Name: 1,5-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrole-2-carboxamide 1,5-dimethyl-N-[(1-methylpyrazol…

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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) 0.35 4.34 -10.65 1 5 0 52 232.287 3 ↓

Analogs

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Popular Name: 4-bromo-N,1-diethyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrole-2-carboxamide 4-bromo-N,1-diethyl-N-[(1-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) 1.86 8.01 -12.12 0 5 0 43 339.237 5 ↓

Analogs

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Popular Name: N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-N-(2-methoxyethyl)-1H-pyrrole-2-carboxamide N-[(1-ethyl-3,5-dimethyl-pyrazol…

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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) 1.11 7.21 -13.14 1 6 0 63 304.394 7 ↓

Analogs

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Popular Name: ethyl ethyl

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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) 1.04 6.81 -16.69 1 7 0 80 318.377 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)-1H-pyrrole-2-carboxamide 4-amino-N-methyl-N-(1H-pyrazol-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) -0.35 1.16 -16.22 4 6 0 91 219.248 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-N-methyl-N-(1H-pyrazol-4-ylmethyl)-1H-pyrrole-2-carboxamide 4-chloro-N-methyl-N-(1H-pyrazol-…

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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) 0.84 3.82 -16.26 2 5 0 65 238.678 3 ↓

Analogs

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Popular Name: N-methyl-N-(1H-pyrazol-4-ylmethyl)-1H-pyrrole-2-carboxamide N-methyl-N-(1H-pyrazol-4-ylmethy…

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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 3.29 -16.31 2 5 0 65 204.233 3 ↓

Analogs

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Popular Name: N,1-dimethyl-N-(1H-pyrazol-4-ylmethyl)pyrrole-2-carboxamide N,1-dimethyl-N-(1H-pyrazol-4-ylm…

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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) 0.31 4.35 -10.48 1 5 0 54 218.26 3 ↓

Analogs

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Popular Name: 4-acetyl-3,5-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]-1H-pyrrole-2-carboxamide 4-acetyl-3,5-dimethyl-N-[(1-meth…

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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) 0.49 4.01 -15.45 2 6 0 80 274.324 4 ↓

Analogs

37986758
37986758

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-N-[(1-methylpyrazol-4-yl)methyl]-1H-pyrrole-2-carboxamide 4-chloro-N-[(1-methylpyrazol-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) 0.67 2.73 -12.53 2 5 0 63 238.678 3 ↓

Analogs

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Popular Name: 4-acetyl-1-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrole-2-carboxamide 4-acetyl-1-methyl-N-[(1-methylpy…

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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) -0.04 4.38 -13.75 1 6 0 69 260.297 4 ↓

Analogs

37986758
37986758
37986803
37986803

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-1-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrole-2-carboxamide 4-chloro-1-methyl-N-[(1-methylpy…

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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) 0.74 4.37 -9.81 1 5 0 52 252.705 3 ↓

Analogs

37986926
37986926

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Popular Name: 4,5-dichloro-1-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrole-2-carboxamide 4,5-dichloro-1-methyl-N-[(1-meth…

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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) 1.54 4.7 -8.96 1 5 0 52 287.15 3 ↓

Analogs

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Popular Name: 1,5-dimethyl-N-[(1S)-1-(1,3,5-trimethylpyrazol-4-yl)ethyl]pyrrole-2-carboxamide 1,5-dimethyl-N-[(1S)-1-(1,3,5-tr…

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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) 1.35 6.25 -10.96 1 5 0 52 274.368 3 ↓

Analogs

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Popular Name: 1,5-dimethyl-N-[(1R)-1-(1,3,5-trimethylpyrazol-4-yl)ethyl]pyrrole-2-carboxamide 1,5-dimethyl-N-[(1R)-1-(1,3,5-tr…

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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) 1.35 6.33 -10.53 1 5 0 52 274.368 3 ↓

Analogs

37844294
37844294
37844293
37844293
37844292
37844292
37844291
37844291
37844290
37844290

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Popular Name: 4-bromo-N-[(1R)-1-(1,3,5-trimethylpyrazol-4-yl)ethyl]-1H-pyrrole-2-carboxamide 4-bromo-N-[(1R)-1-(1,3,5-trimeth…

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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) 1.80 4.69 -12.56 2 5 0 63 325.21 3 ↓

Analogs

37844294
37844294
37844293
37844293
37844292
37844292
37844291
37844291
37844290
37844290

Draw Identity 99% 90% 80% 70%

Popular Name: 4-bromo-N-[(1S)-1-(1,3,5-trimethylpyrazol-4-yl)ethyl]-1H-pyrrole-2-carboxamide 4-bromo-N-[(1S)-1-(1,3,5-trimeth…

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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) 1.80 4.72 -14.49 2 5 0 63 325.21 3 ↓

Analogs

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Popular Name: 4-chloro-1-methyl-N-[(1R)-1-(1,3,5-trimethylpyrazol-4-yl)ethyl]pyrrole-2-carboxamide 4-chloro-1-methyl-N-[(1R)-1-(1,3…

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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) 1.74 6.25 -10.02 1 5 0 52 294.786 3 ↓

Analogs

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Popular Name: 4-chloro-1-methyl-N-[(1S)-1-(1,3,5-trimethylpyrazol-4-yl)ethyl]pyrrole-2-carboxamide 4-chloro-1-methyl-N-[(1S)-1-(1,3…

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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) 1.74 6.19 -10.75 1 5 0 52 294.786 3 ↓

Analogs

37986956
37986956
37986957
37986957

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Popular Name: 4-chloro-N-[(1R)-1-(1,3,5-trimethylpyrazol-4-yl)ethyl]-1H-pyrrole-2-carboxamide 4-chloro-N-[(1R)-1-(1,3,5-trimet…

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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) 1.67 4.59 -12.65 2 5 0 63 280.759 3 ↓

Analogs

37986956
37986956
37986957
37986957

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-N-[(1S)-1-(1,3,5-trimethylpyrazol-4-yl)ethyl]-1H-pyrrole-2-carboxamide 4-chloro-N-[(1S)-1-(1,3,5-trimet…

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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) 1.67 4.61 -14.56 2 5 0 63 280.759 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4,5-dichloro-N-ethyl-1-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrole-2-carboxamide 4,5-dichloro-N-ethyl-1-methyl-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) 2.16 7.36 -8.93 0 5 0 43 315.204 4 ↓

Analogs

37986758
37986758

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-N-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1H-pyrrole-2-carboxamide 4-chloro-N-ethyl-N-[(1-methylpyr…

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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) 1.29 6.34 -12.3 1 5 0 54 266.732 4 ↓

Analogs

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Popular Name: (2S)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(1-methylpyrrole-2-carbonyl)amino]acetic (2S)-2-(3,5-dimethyl-1H-pyrazol-…

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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) -0.07 4.56 -60.57 2 7 -1 103 275.288 4 ↓

Analogs

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Popular Name: (2R)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(1-methylpyrrole-2-carbonyl)amino]acetic (2R)-2-(3,5-dimethyl-1H-pyrazol-…

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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) -0.07 4.67 -57.94 2 7 -1 103 275.288 4 ↓

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