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Analogs

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Popular Name: N-[2-[(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)amino]ethyl]acetamide N-[2-[(5-phenyl-6,7-dihydropyrro…

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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) 1.98 6.81 -12.14 2 6 0 70 297.362 5 ↓
Mid Mid (pH 6-8) 1.98 7.21 -36.23 3 6 1 71 298.37 5 ↓

Analogs

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Popular Name: N-methyl-N-[2-[(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)amino]ethyl]methanesulfonamide N-methyl-N-[2-[(5-phenyl-6,7-dih…

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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) 2.24 6.52 -16.8 1 7 0 78 347.444 6 ↓
Mid Mid (pH 6-8) 2.24 6.92 -32.71 2 7 1 80 348.452 6 ↓

Analogs

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Popular Name: N-[[4-(dimethylamino)tetrahydropyran-4-yl]methyl]-5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-amin N-[[4-(dimethylamino)tetrahydrop…

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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 10.06 -37.13 2 6 1 55 354.478 5 ↓
Hi High (pH 8-9.5) 3.31 7.89 -6.39 1 6 0 54 353.47 5 ↓
Mid Mid (pH 6-8) 3.31 10.46 -90.82 3 6 2 56 355.486 5 ↓

Analogs

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Popular Name: 1-ethyl-4-(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)piperazin-2-one 1-ethyl-4-(5-phenyl-6,7-dihydrop…

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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) 2.79 10.73 -10.8 0 6 0 53 323.4 3 ↓
Lo Low (pH 4.5-6) 2.79 11.05 -32.05 1 6 1 54 324.408 3 ↓
Lo Low (pH 4.5-6) 2.79 11.06 -32.12 1 6 1 54 324.408 3 ↓

Analogs

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Popular Name: cyclopropyl-[(3S)-3-[[(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)amino]methyl]-1-piperidyl]me cyclopropyl-[(3S)-3-[[(5-phenyl-…

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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 12.18 -12.82 1 6 0 61 377.492 5 ↓
Mid Mid (pH 6-8) 3.83 12.57 -32.74 2 6 1 63 378.5 5 ↓

Analogs

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Popular Name: cyclopropyl-[(3R)-3-[[(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)amino]methyl]-1-piperidyl]me cyclopropyl-[(3R)-3-[[(5-phenyl-…

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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 12.17 -12.86 1 6 0 61 377.492 5 ↓
Mid Mid (pH 6-8) 3.83 12.56 -32.86 2 6 1 63 378.5 5 ↓

Analogs

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Popular Name: 1-[2-[(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)amino]ethyl]pyrrolidine-2,5-dione 1-[2-[(5-phenyl-6,7-dihydropyrro…

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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) 1.91 8.95 -15.21 1 7 0 78 337.383 5 ↓
Mid Mid (pH 6-8) 1.91 9.34 -30.87 2 7 1 80 338.391 5 ↓

Analogs

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Popular Name: 3-[(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)amino]-1-pyrrolidin-1-yl-propan-1-one 3-[(5-phenyl-6,7-dihydropyrrolo[…

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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) 2.86 10.01 -14.23 1 6 0 61 337.427 5 ↓
Mid Mid (pH 6-8) 2.86 10.4 -29.28 2 6 1 63 338.435 5 ↓

Analogs

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Popular Name: 2-[(3S)-3-[[(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)amino]methyl]-1-piperidyl]ethanol 2-[(3S)-3-[[(5-phenyl-6,7-dihydr…

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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 9.11 -37.08 3 6 1 66 354.478 6 ↓
Mid Mid (pH 6-8) 3.01 9.5 -81.65 4 6 2 67 355.486 6 ↓

Analogs

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Popular Name: 2-[(3R)-3-[[(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)amino]methyl]-1-piperidyl]ethanol 2-[(3R)-3-[[(5-phenyl-6,7-dihydr…

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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 9.12 -36.9 3 6 1 66 354.478 6 ↓
Mid Mid (pH 6-8) 3.01 9.51 -81.83 4 6 2 67 355.486 6 ↓

Analogs

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Popular Name: (3S)-1-[2-[(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)amino]ethyl]piperidin-3-ol (3S)-1-[2-[(5-phenyl-6,7-dihydro…

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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) 2.62 8.28 -38.32 3 6 1 66 340.451 5 ↓
Mid Mid (pH 6-8) 2.62 8.68 -94.02 4 6 2 67 341.459 5 ↓

Analogs

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Popular Name: (3R)-1-[2-[(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)amino]ethyl]piperidin-3-ol (3R)-1-[2-[(5-phenyl-6,7-dihydro…

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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) 2.62 8.28 -38.34 3 6 1 66 340.451 5 ↓
Mid Mid (pH 6-8) 2.62 8.68 -94.01 4 6 2 67 341.459 5 ↓

Analogs

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Popular Name: N-methyl-N-[(3R)-1-(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)pyrrolidin-3-yl]acetamide N-methyl-N-[(3R)-1-(5-phenyl-6,7…

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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) 2.71 10.89 -11.84 0 6 0 53 337.427 3 ↓
Mid Mid (pH 6-8) 2.71 11.27 -34.25 1 6 1 54 338.435 3 ↓
Mid Mid (pH 6-8) 2.71 11.33 -33.32 1 6 1 54 338.435 3 ↓

Analogs

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Popular Name: N-methyl-N-[(3S)-1-(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)pyrrolidin-3-yl]acetamide N-methyl-N-[(3S)-1-(5-phenyl-6,7…

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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) 2.71 10.75 -13.16 0 6 0 53 337.427 3 ↓
Mid Mid (pH 6-8) 2.71 11.15 -33.43 1 6 1 54 338.435 3 ↓
Mid Mid (pH 6-8) 2.71 11.19 -32.79 1 6 1 54 338.435 3 ↓

Analogs

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Popular Name: 5-phenyl-2-[4-[2-(4-pyridyl)ethyl]piperazin-1-yl]-6,7-dihydropyrrolo[3,2-d]pyrimidine 5-phenyl-2-[4-[2-(4-pyridyl)ethy…

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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 12.04 -9.52 0 6 0 48 386.503 5 ↓
Mid Mid (pH 6-8) 3.60 14.25 -47.73 1 6 1 50 387.511 5 ↓
Mid Mid (pH 6-8) 3.60 14.6 -101.19 2 6 2 51 388.519 5 ↓

Analogs

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Popular Name: N-(2-morpholinoethyl)-5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-amine N-(2-morpholinoethyl)-5-phenyl-6…

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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) 2.71 6.95 -7.82 1 6 0 54 325.416 5 ↓
Mid Mid (pH 6-8) 2.71 7.35 -28.79 2 6 1 55 326.424 5 ↓
Mid Mid (pH 6-8) 2.71 9.21 -39.53 2 6 1 55 326.424 5 ↓

Analogs

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Popular Name: N-[(1S)-2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-amine N-[(1S)-2-methoxy-1-(2-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) 3.09 9.02 -9.53 1 7 0 68 350.426 6 ↓
Mid Mid (pH 6-8) 3.09 9.36 -34.78 2 7 1 69 351.434 6 ↓

Analogs

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Popular Name: N-[(1R)-2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-amine N-[(1R)-2-methoxy-1-(2-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) 3.09 9 -9.61 1 7 0 68 350.426 6 ↓
Mid Mid (pH 6-8) 3.09 9.38 -34.75 2 7 1 69 351.434 6 ↓

Analogs

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Popular Name: 4-methyl-2-[2-[(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)amino]ethyl]-1H-pyrimidin-6-one 4-methyl-2-[2-[(5-phenyl-6,7-dih…

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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) 2.71 9.11 -15.18 2 7 0 87 348.41 5 ↓
Mid Mid (pH 6-8) 2.71 9.5 -39.56 3 7 1 88 349.418 5 ↓

Analogs

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Popular Name: N-[2-[(4R)-4H-imidazol-4-yl]ethyl]-5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-amine N-[2-[(4R)-4H-imidazol-4-yl]ethy…

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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 10.27 -38.31 3 6 1 71 307.381 5 ↓
Mid Mid (pH 6-8) 2.87 9.8 -12.95 2 6 0 70 306.373 5 ↓
Lo Low (pH 4.5-6) 2.87 10.66 -81.77 4 6 2 72 308.389 5 ↓

Analogs

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Popular Name: N-[(2-aminopyrimidin-5-yl)methyl]-N-methyl-5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-amine N-[(2-aminopyrimidin-5-yl)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) 2.29 11.13 -10.48 2 7 0 84 333.399 4 ↓
Mid Mid (pH 6-8) 2.29 11.46 -31.28 3 7 1 85 334.407 4 ↓
Mid Mid (pH 6-8) 2.29 11.45 -31.77 3 7 1 85 334.407 4 ↓

Analogs

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Popular Name: N,N-dimethyl-4-[(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)amino]butanamide N,N-dimethyl-4-[(5-phenyl-6,7-di…

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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) 2.29 9.52 -12.76 1 6 0 61 325.416 6 ↓
Mid Mid (pH 6-8) 2.29 9.91 -35.59 2 6 1 63 326.424 6 ↓

Analogs

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Popular Name: 5-phenyl-N-(2-pyrrolidin-1-ylethyl)-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-amine 5-phenyl-N-(2-pyrrolidin-1-yleth…

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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 10.93 -36.46 2 5 1 45 310.425 5 ↓
Hi High (pH 8-9.5) 3.27 8.49 -6.84 1 5 0 44 309.417 5 ↓
Mid Mid (pH 6-8) 3.27 11.34 -89.76 3 5 2 47 311.433 5 ↓

Analogs

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Popular Name: N-[(1S)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin- N-[(1S)-1-[4-(2-methoxyethyl)-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) 2.41 11.12 -12.26 1 8 0 81 365.441 7 ↓
Mid Mid (pH 6-8) 2.41 11.49 -35.32 2 8 1 82 366.449 7 ↓

Analogs

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Popular Name: N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin- N-[(1R)-1-[4-(2-methoxyethyl)-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) 2.41 11.19 -12.39 1 8 0 81 365.441 7 ↓
Mid Mid (pH 6-8) 2.41 11.56 -35.2 2 8 1 82 366.449 7 ↓

Parameters Provided:

ring.id = 397409
filter.purchasability = annotated
page.format = targets
page.num = 1

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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 = 397409 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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