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    • Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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    Analogs

    1995496
    1995496

    Draw Identity 99% 90% 80% 70%

    Popular Name: INN) INN)

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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) -0.14 -4.54 -15.28 2 5 0 75 234.255 3 ↓

    Analogs

    16556415
    16556415
    16559904
    16559904
    16563943
    16563943
    21762045
    21762045

    Draw Identity 99% 90% 80% 70%


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    Popular Name:

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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 12.38 -15.1 0 7 0 79 412.478 5 ↓

    Analogs

    6542027
    6542027
    4216025
    4216025

    Draw Identity 99% 90% 80% 70%

    Popular Name: N,N-dimethyl-2-[4-oxo-3-(4-sec-butylphenyl)-quinazolin-2-yl]sulfanyl-acetamide N,N-dimethyl-2-[4-oxo-3-(4-sec-b…

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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 1.42 -14.65 0 5 0 55 395.528 6 ↓

    Analogs

    6542031
    6542031

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-allyl-2-[4-oxo-3-(4-sec-butylphenyl)-quinazolin-2-yl]sulfanyl-acetamide N-allyl-2-[4-oxo-3-(4-sec-butylp…

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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) 4.85 0.17 -13.89 1 5 0 63 407.539 8 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[2-(2-chlorophenyl)vinyl]-3-(3-methoxyphenyl)-quinazolin-4-one 2-[2-(2-chlorophenyl)vinyl]-3-(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) 5.50 1.89 -13.57 0 4 0 44 388.854 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-(2-diethylaminoethylsulfanyl)-3-(4-methoxyphenyl)-quinazolin-4-one 2-(2-diethylaminoethylsulfanyl)-…

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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) 4.08 1.63 -45.78 1 5 1 48 384.525 8 ↓

    Analogs

    16425028
    16425028
    16425221
    16425221

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(2-dimethylaminoethyl)-N-[(1S)-1-[3-(4-hydroxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]decanamide N-(2-dimethylaminoethyl)-N-[(1S)…

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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) 6.14 14.39 -50.67 2 7 1 80 507.699 14 ↓

    Analogs

    16425028
    16425028
    16425221
    16425221

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(2-dimethylaminoethyl)-N-[(1R)-1-[3-(4-hydroxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]decanamide N-(2-dimethylaminoethyl)-N-[(1R)…

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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) 6.14 15.1 -59.23 2 7 1 80 507.699 14 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl]quinazolin-4-one 3-[[5-(4-bromophenyl)-1,3,4-oxad…

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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 -2.21 -17.14 0 6 0 73 383.205 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-[2-(1H-indol-3-yl)ethyl]-2-methyl-quinazolin-4-one 3-[2-(1H-indol-3-yl)ethyl]-2-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) 3.09 0.01 -11.81 1 4 0 50 303.365 3 ↓

    Analogs

    21622756
    21622756

    Draw Identity 99% 90% 80% 70%

    Popular Name: 7-[2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino-6-thiabicyclo[3.3.0]octa-7,9-diene-8-carbox 7-[2-(3-ethyl-4-oxo-quinazolin-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) 2.34 -4.56 -17.29 3 7 0 107 428.539 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-oxo-3H-quinazolin-2-yl)ethyl 1-(4-oxo-3H-quinazolin-2-yl)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) 2.31 7.83 -12.91 1 8 0 103 361.361 5 ↓
    Hi High (pH 8-9.5) 2.77 5.54 -54.93 0 8 -1 106 360.353 5 ↓

    Analogs

    7151115
    7151115

    Draw Identity 99% 90% 80% 70%

    Popular Name: 7-chloro-3-(o-tolyl)-2-(tetrahydrofuran-2-ylmethylsulfanyl)quinazolin-4-one 7-chloro-3-(o-tolyl)-2-(tetrahyd…

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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) 4.88 11.71 -9.43 0 4 0 44 386.904 4 ↓

    Analogs

    7151114
    7151114

    Draw Identity 99% 90% 80% 70%

    Popular Name: 7-chloro-3-(o-tolyl)-2-(tetrahydrofuran-2-ylmethylsulfanyl)quinazolin-4-one 7-chloro-3-(o-tolyl)-2-(tetrahyd…

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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) 4.88 11.7 -9.61 0 4 0 44 386.904 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 8-methyl-2-(quinazolin-4-ylsulfanylmethyl)-3H-quinazolin-4-one 8-methyl-2-(quinazolin-4-ylsulfa…

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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 -1.8 -13 1 5 0 71 334.404 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylmethyl]-8-methyl-3H-quinazolin-4-one 2-[[1-(4-methoxyphenyl)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) 2.71 0.71 -14.85 1 8 0 98 380.433 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[(5-benzo[1,3]dioxol-5-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-8-methyl-3H-quinazolin-4-one 2-[(5-benzo[1,3]dioxol-5-yl-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) 3.57 -4.04 -14.52 1 8 0 103 394.412 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[2-[(4-azepan-1-ylcarbonyl-1-piperidyl)carbonyl]ethyl]-3-methyl-quinazolin-4-one 2-[2-[(4-azepan-1-ylcarbonyl-1-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) 2.50 -0.24 -20.8 0 7 0 75 424.545 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-benzyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-2-phenoxy-acetamide N-benzyl-N-[(4-oxo-3H-quinazolin…

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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) 3.29 0.36 -18.86 1 6 0 75 399.45 7 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-[3-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]carbonylpropyl]-8-methyl-quinazolin-4-one 3-[3-[4-(2-fluorophenyl)sulfonyl…

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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) 2.26 -3.05 -27.43 0 8 0 92 472.542 6 ↓

    Analogs

    12693741
    12693741

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    Popular Name: N-[1-(2,6-dioxabicyclo[5.4.0]undeca-8,10,12-trien-9-yl)-2-methyl-propyl]-2-(8-methyl-4-oxo-quinazoli N-[1-(2,6-dioxabicyclo[5.4.0]und…

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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) 3.04 0.25 -21.32 1 7 0 82 421.497 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-(4-oxoquinazolin-3-yl)-acetamide N-[2-(5-fluoro-1H-indol-3-yl)eth…

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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) 1.28 -0.88 -23.21 2 6 0 79 364.38 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(2-chloro-3-pyridyl)-3-(4-oxoquinazolin-3-yl)-propanamide N-(2-chloro-3-pyridyl)-3-(4-oxoq…

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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 -1.09 -16.06 1 6 0 76 328.759 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(5-methylthiazol-2-yl)-4-(4-oxoquinazolin-3-yl)-butanamide N-(5-methylthiazol-2-yl)-4-(4-ox…

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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 -1.05 -25.21 1 6 0 76 328.397 5 ↓

    Analogs

    6365283
    6365283
    6365291
    6365291

    Draw Identity 99% 90% 80% 70%

    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) 4.44 12.65 -11.29 0 7 0 88 426.494 8 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-(7-chloro-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-acetami 2-(7-chloro-3-isobutyl-4-oxo-qui…

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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) 4.64 0.15 -15.46 1 7 0 81 496.036 7 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[(6-bromo-4-oxo-3-phenyl-quinazolin-2-yl)sulfanylmethyl]isoindoline-1,3-dione 2-[(6-bromo-4-oxo-3-phenyl-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) 5.23 0.23 -13.5 0 6 0 73 492.354 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-(4-oxoquinazolin-3-yl)-N-(4-pyridyl)propanamide 3-(4-oxoquinazolin-3-yl)-N-(4-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) 0.84 6.4 -17.05 1 6 0 77 294.314 4 ↓
    Lo Low (pH 4.5-6) 0.84 -0.88 -44.23 2 6 1 78 295.322 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-[1-(4-phenylpiperazin-1-yl)carbonylpropyl]quinazolin-4-one 3-[1-(4-phenylpiperazin-1-yl)car…

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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 -1.43 -13.4 0 6 0 58 376.46 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-[1-(4-phenylpiperazin-1-yl)carbonylpropyl]quinazolin-4-one 3-[1-(4-phenylpiperazin-1-yl)car…

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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 -1.35 -12.88 0 6 0 58 376.46 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    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) 2.79 3.16 -17.76 0 7 0 83 389.411 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(benzenesulfonyl)-2-(8-methyl-4-oxo-quinazolin-3-yl)acetamide N-(benzenesulfonyl)-2-(8-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) 1.65 4.6 -60.88 0 7 -1 104 356.383 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-(4-oxoquinazolin-3-yl)-N-(2-pyridyl)butanamide 2-(4-oxoquinazolin-3-yl)-N-(2-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) 1.82 0.11 -17.85 1 6 0 76 308.341 4 ↓
    Lo Low (pH 4.5-6) 1.82 -0.25 -38.78 2 6 1 78 309.349 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-(4-oxoquinazolin-3-yl)-N-(2-pyridyl)butanamide 2-(4-oxoquinazolin-3-yl)-N-(2-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) 1.82 0.11 -17.72 1 6 0 76 308.341 4 ↓
    Lo Low (pH 4.5-6) 1.82 -0.24 -38.91 2 6 1 78 309.349 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-[1-[4-(4-fluorophenyl)piperazin-1-yl]carbonylpropyl]quinazolin-4-one 3-[1-[4-(4-fluorophenyl)piperazi…

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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) 3.02 -0.62 -12.94 0 6 0 58 394.45 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-[1-[4-(4-fluorophenyl)piperazin-1-yl]carbonylpropyl]quinazolin-4-one 3-[1-[4-(4-fluorophenyl)piperazi…

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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) 3.02 -0.61 -13.78 0 6 0 58 394.45 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[3-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]-2-nitro-benzenesulfonamide N-[3-(2-methyl-4-oxo-quinazolin-…

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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) 3.28 -1.97 -22.94 1 9 0 126 436.449 5 ↓
    Hi High (pH 8-9.5) 3.28 -1.46 -60.1 0 9 -1 128 435.441 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[4-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]-3-nitro-benzenesulfonamide N-[4-(2-methyl-4-oxo-quinazolin-…

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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) 3.12 -2.9 -23.98 1 9 0 126 436.449 5 ↓
    Hi High (pH 8-9.5) 3.12 -2.32 -48.5 0 9 -1 128 435.441 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[4-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]-4-nitro-benzenesulfonamide N-[4-(2-methyl-4-oxo-quinazolin-…

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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) 3.14 -2.69 -18.47 1 9 0 126 436.449 5 ↓
    Hi High (pH 8-9.5) 3.14 -2.11 -39.39 0 9 -1 128 435.441 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-methyl-N-[3-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]-5-nitro-benzenesulfonamide 2-methyl-N-[3-(2-methyl-4-oxo-qu…

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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) 3.70 -2.15 -19.81 1 9 0 126 450.476 5 ↓
    Hi High (pH 8-9.5) 3.70 -1.6 -43.23 0 9 -1 128 449.468 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-methyl-N-[4-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]-5-nitro-benzenesulfonamide 2-methyl-N-[4-(2-methyl-4-oxo-qu…

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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) 3.52 -2.53 -20.62 1 9 0 126 450.476 5 ↓
    Hi High (pH 8-9.5) 3.52 -1.99 -44 0 9 -1 128 449.468 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-N-[3-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]-5-nitro-benzenesulfonamide 2-chloro-N-[3-(2-methyl-4-oxo-qu…

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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) 3.93 -2.66 -16.56 1 9 0 126 470.894 5 ↓
    Hi High (pH 8-9.5) 3.93 -2.08 -41.67 0 9 -1 128 469.886 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-N-[4-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]-5-nitro-benzenesulfonamide 2-chloro-N-[4-(2-methyl-4-oxo-qu…

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    Activity (Go SEA)

    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) 3.75 -2.6 -18.27 1 9 0 126 470.894 5 ↓
    Hi High (pH 8-9.5) 3.75 -2.02 -44.48 0 9 -1 128 469.886 5 ↓

    Analogs

    5203544
    5203544
    5204339
    5204339
    5204342
    5204342

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[3-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]naphthalene-2-sulfonamide N-[3-(2-methyl-4-oxo-quinazolin-…

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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) 4.55 -3.03 -15.73 1 6 0 81 441.512 4 ↓
    Hi High (pH 8-9.5) 4.55 -2.45 -50.3 0 6 -1 83 440.504 4 ↓

    Analogs

    5203545
    5203545
    4270391
    4270391

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[4-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]naphthalene-2-sulfonamide N-[4-(2-methyl-4-oxo-quinazolin-…

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    Activity (Go SEA)

    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) 4.36 -3.07 -17.26 1 6 0 81 441.512 4 ↓
    Hi High (pH 8-9.5) 4.36 -2.49 -50.02 0 6 -1 83 440.504 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[3-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]tetralin-2-sulfonamide N-[3-(2-methyl-4-oxo-quinazolin-…

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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) 4.55 -3.27 -14.88 1 6 0 81 445.544 4 ↓
    Hi High (pH 8-9.5) 4.55 -2.69 -49.87 0 6 -1 83 444.536 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[4-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]tetralin-2-sulfonamide N-[4-(2-methyl-4-oxo-quinazolin-…

    Find On: PubMed — Wikipedia — Google

    Activity (Go SEA)

    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) 4.36 -3.31 -16.56 1 6 0 81 445.544 4 ↓
    Hi High (pH 8-9.5) 4.36 -2.73 -49.73 0 6 -1 83 444.536 4 ↓

    Analogs

    5204357
    5204357
    4270391
    4270391

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2,4-difluoro-N-[3-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]-benzenesulfonamide 2,4-difluoro-N-[3-(2-methyl-4-ox…

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    Activity (Go SEA)

    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 -2 -14.49 1 6 0 81 427.432 4 ↓
    Hi High (pH 8-9.5) 3.62 -1.42 -46.15 0 6 -1 83 426.424 4 ↓

    Analogs

    5204357
    5204357
    4270391
    4270391

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2,4-difluoro-N-[4-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]-benzenesulfonamide 2,4-difluoro-N-[4-(2-methyl-4-ox…

    Find On: PubMed — Wikipedia — Google

    Activity (Go SEA)

    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 8.52 -14.15 1 6 0 81 427.432 4 ↓
    Mid Mid (pH 6-8) 3.44 8.48 -46.51 0 6 -1 83 426.424 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2,4-difluoro-N-[2-methyl-4-(2-methyl-4-oxo-quinazolin-3-yl)-phenyl]-benzenesulfonamide 2,4-difluoro-N-[2-methyl-4-(2-me…

    Find On: PubMed — Wikipedia — Google

    Activity (Go SEA)

    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) 4.02 -1.75 -16.18 1 6 0 81 441.459 4 ↓
    Hi High (pH 8-9.5) 4.02 -1.17 -44.41 0 6 -1 83 440.451 4 ↓

    Parameters Provided:

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    Structural Results Found: (before additional filtering)

    SQL Query Was

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    //zinc12.docking.org/results/combination?ring.id=182&filter.purchasability=annotated

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