UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-methyl-N-[(2-morpholino-3-pyridyl)methyl]pyrazolo[1,5-a]quinazolin-5-amine 2-methyl-N-[(2-morpholino-3-pyri…

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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) 2.70 8.92 -53.71 2 7 1 69 375.456 4 ↓
Mid Mid (pH 6-8) 2.70 8.49 -16.98 1 7 0 68 374.448 4 ↓

Analogs

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Popular Name: 2-[(1R)-1-[(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]ethyl]phenol 2-[(1R)-1-[(2-methylpyrazolo[1,5…

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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) 4.20 8.12 -19.38 2 5 0 62 318.38 3 ↓
Hi High (pH 8-9.5) 4.20 8.91 -57.98 1 5 -1 65 317.372 3 ↓

Analogs

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Popular Name: 2-[(1S)-1-[(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]ethyl]phenol 2-[(1S)-1-[(2-methylpyrazolo[1,5…

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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) 4.20 8.34 -19.92 2 5 0 62 318.38 3 ↓
Hi High (pH 8-9.5) 4.20 9.12 -61.49 1 5 -1 65 317.372 3 ↓

Analogs

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Popular Name: 5-oxo-N-(1,1,3,3-tetramethylbutyl)-1H-pyrazolo[1,5-a]quinazoline-3-carboxamide 5-oxo-N-(1,1,3,3-tetramethylbuty…

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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) 3.91 5.89 -58.88 1 6 -1 82 339.419 4 ↓

Analogs

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Popular Name: N-[(1R)-1,3-dimethylbutyl]-N-methyl-5-oxo-1H-pyrazolo[1,5-a]quinazoline-3-carboxamide N-[(1R)-1,3-dimethylbutyl]-N-met…

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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) 2.88 6.12 -60.24 0 6 -1 74 325.392 4 ↓

Analogs

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Popular Name: N-[(1S)-1,3-dimethylbutyl]-N-methyl-5-oxo-1H-pyrazolo[1,5-a]quinazoline-3-carboxamide N-[(1S)-1,3-dimethylbutyl]-N-met…

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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) 2.88 6.12 -60.81 0 6 -1 74 325.392 4 ↓

Analogs

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Popular Name: N-ethyl-N-(2-furylmethyl)-5-oxo-1H-pyrazolo[1,5-a]quinazoline-3-carboxamide N-ethyl-N-(2-furylmethyl)-5-oxo-…

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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) 1.93 5.41 -58.09 0 7 -1 87 335.343 4 ↓

Analogs

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Popular Name: N-allyl-N-benzyl-5-oxo-1H-pyrazolo[1,5-a]quinazoline-3-carboxamide N-allyl-N-benzyl-5-oxo-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) 2.94 7.6 -61.5 0 6 -1 74 357.393 5 ↓

Analogs

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Popular Name: N-(cyclobutylmethyl)-5-oxo-1H-pyrazolo[1,5-a]quinazoline-3-carboxamide N-(cyclobutylmethyl)-5-oxo-1H-py…

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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) 2.17 3.55 -59.53 1 6 -1 82 295.322 3 ↓

Analogs

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Popular Name: N-(3,3-dimethylbutyl)-5-oxo-1H-pyrazolo[1,5-a]quinazoline-3-carboxamide N-(3,3-dimethylbutyl)-5-oxo-1H-p…

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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) 3.10 3.9 -59.73 1 6 -1 82 311.365 4 ↓

Analogs

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Popular Name: N,N-dibutyl-5-oxo-1H-pyrazolo[1,5-a]quinazoline-3-carboxamide N,N-dibutyl-5-oxo-1H-pyrazolo[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) 3.77 7.34 -59.42 0 6 -1 74 339.419 7 ↓

Analogs

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Popular Name: [2-fluoro-4-[[(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]methyl]phenyl]methanol [2-fluoro-4-[[(2-methylpyrazolo[…

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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) 3.13 7.65 -14.44 2 5 0 62 336.37 4 ↓

Analogs

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Popular Name: (1R,2S)-1-[(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]indan-2-ol (1R,2S)-1-[(2-methylpyrazolo[1,5…

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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) 3.23 8.33 -15.5 2 5 0 62 330.391 2 ↓

Analogs

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Popular Name: 3-chloro-5-[5-(2-furyl)tetrazol-2-yl]-2-methyl-pyrazolo[1,5-a]quinazoline 3-chloro-5-[5-(2-furyl)tetrazol-…

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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) 3.39 8.68 -14.63 0 8 0 87 351.757 2 ↓

Analogs

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Popular Name: 3-chloro-5-[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-2-methyl-pyrazolo[1,5-a]quinazoline 3-chloro-5-[(5-ethyl-4H-1,2,4-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) 3.78 9.34 -14.17 1 6 0 72 344.831 3 ↓

Analogs

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Popular Name: 3-chloro-2-methyl-5-(4-methylsulfonyl-1,4-diazepan-1-yl)pyrazolo[1,5-a]quinazoline 3-chloro-2-methyl-5-(4-methylsul…

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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) 2.69 6.46 -18.6 0 7 0 71 393.9 2 ↓

Analogs

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Popular Name: 3-chloro-2-methyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]pyrazolo[1,5-a]quinazolin-5-amine 3-chloro-2-methyl-N-[3-(4-pyrimi…

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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) 3.51 12.13 -60.89 2 8 1 76 437.959 6 ↓
Mid Mid (pH 6-8) 3.51 9.82 -20.76 1 8 0 74 436.951 6 ↓

Analogs

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Popular Name: 1,3-benzodioxol-5-yl-[4-(3-chloro-2-methyl-pyrazolo[1,5-a]quinazolin-5-yl)piperazin-1-yl]methanone 1,3-benzodioxol-5-yl-[4-(3-chlor…

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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) 3.50 9.63 -18.19 0 8 0 72 449.898 2 ↓

Analogs

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Popular Name: 3-chloro-2-methyl-N-[2-(2-pyridyl)ethyl]pyrazolo[1,5-a]quinazolin-5-amine 3-chloro-2-methyl-N-[2-(2-pyridy…

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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 9.57 -19.99 1 5 0 55 337.814 4 ↓
Lo Low (pH 4.5-6) 3.54 9.96 -48.25 2 5 1 56 338.822 4 ↓

Analogs

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Popular Name: N-[5-(3-chloro-2-methyl-pyrazolo[1,5-a]quinazolin-5-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-N-cyclopropyl N-[5-(3-chloro-2-methyl-pyrazolo…

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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) 4.01 10.79 -18.04 0 7 0 76 430.946 4 ↓

Analogs

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Popular Name: 3-[(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propane-1-sulfonamide 3-[(2-methylpyrazolo[1,5-a]quina…

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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) 1.36 2.85 -23.66 3 7 0 102 319.39 5 ↓

Analogs

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Popular Name: N-(1-tert-butylpyrazol-4-yl)-3-chloro-2-methyl-pyrazolo[1,5-a]quinazolin-5-amine N-(1-tert-butylpyrazol-4-yl)-3-c…

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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) 4.60 10.73 -18.25 1 6 0 60 354.845 3 ↓

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) 3.72 13.49 -24.48 0 8 0 76 430.512 5 ↓
Lo Low (pH 4.5-6) 3.72 13.74 -52.09 1 8 1 77 431.52 5 ↓

Analogs

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Popular Name: 5-piperidinopyrazolo[1,5-a]quinazoline-3-carbonitrile 5-piperidinopyrazolo[1,5-a]quina…

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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) 2.92 9.24 -13.57 0 5 0 57 277.331 1 ↓

Analogs

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Popular Name: 5-morpholinopyrazolo[1,5-a]quinazoline-3-carbonitrile 5-morpholinopyrazolo[1,5-a]quina…

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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 6.82 -14.67 0 6 0 66 279.303 1 ↓

Analogs

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Popular Name: (1R)-2-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)sulfanyl-1-phenyl-ethanol (1R)-2-(2-methylpyrazolo[1,5-a]q…

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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) 3.85 8.83 -12.8 1 4 0 50 335.432 4 ↓

Analogs

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Popular Name: (1S)-2-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)sulfanyl-1-phenyl-ethanol (1S)-2-(2-methylpyrazolo[1,5-a]q…

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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) 3.85 8.79 -12.8 1 4 0 50 335.432 4 ↓

Analogs

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Popular Name: 3-chloro-2-methyl-5-[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]pyrazolo[1,5-a]quinazoline 3-chloro-2-methyl-5-[4-(p-tolyls…

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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) 4.67 10.23 -20.9 0 7 0 71 469.998 3 ↓

Analogs

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Popular Name: 4-[2-[(3-chloro-2-methyl-pyrazolo[1,5-a]quinazolin-5-yl)amino]ethyl]benzenesulfonamide 4-[2-[(3-chloro-2-methyl-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) 3.41 6.34 -24 3 7 0 102 415.906 5 ↓

Analogs

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Popular Name: 3-chloro-5-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-2-methyl-pyrazolo[1,5-a]quinazoline 3-chloro-5-[4-(2-fluorophenyl)su…

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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) 4.07 8.76 -16.7 0 7 0 71 459.934 3 ↓

Analogs

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Popular Name: 3-chloro-5-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-methyl-pyrazolo[1,5-a]quinazoline 3-chloro-5-[4-(4-fluorophenyl)su…

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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) 4.12 8.91 -16.06 0 7 0 71 459.934 3 ↓

Analogs

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Popular Name: 3-chloro-5-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-2-methyl-pyrazolo[1,5-a]quinazoline 3-chloro-5-[4-(4-fluorophenyl)su…

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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) 4.39 9.98 -16.9 0 7 0 71 473.961 3 ↓

Analogs

16737857
16737857

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Popular Name: N-(3-chloro-2-methyl-pyrazolo[1,5-a]quinazolin-5-yl)-N',N'-dimethyl-ethane-1,2-diamine N-(3-chloro-2-methyl-pyrazolo[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) 2.94 8.92 -50.31 2 5 1 47 304.805 4 ↓

Analogs

25151330
25151330
30861199
30861199

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Popular Name: [4-[[(3-chloro-2-methyl-pyrazolo[1,5-a]quinazolin-5-yl)amino]methyl]phenyl]-(1-piperidyl)methanone [4-[[(3-chloro-2-methyl-pyrazolo…

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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) 4.18 12.53 -19 1 6 0 63 433.943 4 ↓

Analogs

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Popular Name: 3-chloro-5-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-methyl-pyrazolo[1,5-a]quinazoline 3-chloro-5-[4-(3-fluorophenyl)su…

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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) 4.09 8.91 -16.7 0 7 0 71 459.934 3 ↓

Analogs

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Popular Name: azepan-1-yl-[1-(3-chloro-2-methyl-pyrazolo[1,5-a]quinazolin-5-yl)-4-piperidyl]methanone azepan-1-yl-[1-(3-chloro-2-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) 4.69 12.22 -12.64 0 6 0 54 425.964 2 ↓

Analogs

16737897
16737897

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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) 3.79 9.85 -11.7 0 6 0 60 358.829 3 ↓

Analogs

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Popular Name: 3-chloro-2-methyl-5-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]pyrazolo[1,5-a]quinazoline 3-chloro-2-methyl-5-[4-[5-(trifl…

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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) 4.74 10.57 -11.73 0 6 0 50 446.864 3 ↓

Analogs

14245857
14245857
14245858
14245858

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Popular Name: 3-chloro-5-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-methyl-pyrazolo[1,5-a]quinazoline 3-chloro-5-[(2R,6R)-2,6-dimethyl…

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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) 3.72 8.51 -10.83 0 5 0 43 330.819 1 ↓

Analogs

14245858
14245858
14245855
14245855

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Popular Name: 3-chloro-5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methyl-pyrazolo[1,5-a]quinazoline 3-chloro-5-[(2R,6S)-2,6-dimethyl…

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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) 3.72 8.46 -11.2 0 5 0 43 330.819 1 ↓

Analogs

14245855
14245855
14245857
14245857

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Popular Name: 3-chloro-5-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-methyl-pyrazolo[1,5-a]quinazoline 3-chloro-5-[(2S,6S)-2,6-dimethyl…

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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) 3.72 8.5 -10.82 0 5 0 43 330.819 1 ↓

Analogs

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Popular Name: 5-(azepan-1-yl)-3-chloro-2-methyl-pyrazolo[1,5-a]quinazoline 5-(azepan-1-yl)-3-chloro-2-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) 4.57 9.81 -9.67 0 4 0 33 314.82 1 ↓

Analogs

16737801
16737801
25523167
25523167
9499599
9499599

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Popular Name: 3-chloro-5-(4-ethylpiperazin-1-yl)-2-methyl-pyrazolo[1,5-a]quinazoline 3-chloro-5-(4-ethylpiperazin-1-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) 3.42 9.77 -45.28 1 5 1 38 330.843 2 ↓

Analogs

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Popular Name: 3-chloro-2-methyl-5-pyrrolidin-1-yl-pyrazolo[1,5-a]quinazoline 3-chloro-2-methyl-5-pyrrolidin-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) 3.55 8.37 -11.66 0 4 0 33 286.766 1 ↓

Analogs

14245865
14245865

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Popular Name: 3-chloro-N-[(1R)-2-methoxy-1-methyl-ethyl]-2-methyl-pyrazolo[1,5-a]quinazolin-5-amine 3-chloro-N-[(1R)-2-methoxy-1-met…

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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) 3.22 7.62 -11.96 1 5 0 51 304.781 4 ↓

Analogs

14245864
14245864

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Popular Name: 3-chloro-N-[(1S)-2-methoxy-1-methyl-ethyl]-2-methyl-pyrazolo[1,5-a]quinazolin-5-amine 3-chloro-N-[(1S)-2-methoxy-1-met…

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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) 3.22 7.6 -11.97 1 5 0 51 304.781 4 ↓

Analogs

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Popular Name: 3-chloro-2-methyl-N-(2-methyl-2-morpholino-propyl)pyrazolo[1,5-a]quinazolin-5-amine 3-chloro-2-methyl-N-(2-methyl-2-…

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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) 3.59 7.53 -13.86 1 6 0 55 373.888 4 ↓

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) 4.16 10.78 -11.44 0 6 0 60 372.856 4 ↓

Analogs

14246014
14246014

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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) 4.16 10.75 -14.83 0 6 0 60 372.856 4 ↓

Analogs

14246013
14246013

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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) 4.16 10.91 -14 0 6 0 60 372.856 4 ↓

Parameters Provided:

ring.id = 11296
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

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 = 11296 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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