UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

12233568
12233568
11027730
11027730

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Popular Name: N-benzyl-4-oxo-8-phenyl-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-benzyl-4-oxo-8-phenyl-6,7-dihy…

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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) 2.02 0.01 -17.24 1 7 0 80 347.378 4 ↓

Analogs

12233752
12233752

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Popular Name: N-[(2-chlorophenyl)methyl]-4-oxo-8-phenyl-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-[(2-chlorophenyl)methyl]-4-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) 2.65 -0.17 -18.16 1 7 0 80 381.823 4 ↓

Analogs

12233755
12233755

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Popular Name: N-[(4-fluorophenyl)methyl]-4-oxo-8-phenyl-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-[(4-fluorophenyl)methyl]-4-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) 2.19 0.75 -17.11 1 7 0 80 365.368 4 ↓

Analogs

12233759
12233759
12233944
12233944

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Popular Name: N-[(4-methoxyphenyl)methyl]-4-oxo-8-phenyl-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-[(4-methoxyphenyl)methyl]-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) 2.08 0.03 -18.27 1 8 0 89 377.404 5 ↓

Analogs

12233760
12233760
12233947
12233947

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Popular Name: N-[(2-methoxyphenyl)methyl]-4-oxo-8-phenyl-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-[(2-methoxyphenyl)methyl]-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) 2.03 0.08 -19.37 1 8 0 89 377.404 5 ↓

Analogs

12233763
12233763
12233553
12233553

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Popular Name: 4-oxo-8-phenyl-N-(p-tolylmethyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide 4-oxo-8-phenyl-N-(p-tolylmethyl)…

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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) 2.47 0.33 -17.23 1 7 0 80 361.405 4 ↓

Analogs

12233576
12233576
12233769
12233769
12233771
12233771

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Popular Name: 4-oxo-8-phenyl-N-[(1R)-1-phenylethyl]-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide 4-oxo-8-phenyl-N-[(1R)-1-phenyle…

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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) 2.58 0.76 -17.41 1 7 0 80 361.405 4 ↓

Analogs

12233769
12233769
12233771
12233771
12233572
12233572

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Popular Name: 4-oxo-8-phenyl-N-[(1S)-1-phenylethyl]-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide 4-oxo-8-phenyl-N-[(1S)-1-phenyle…

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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) 2.58 0.76 -17.38 1 7 0 80 361.405 4 ↓

Analogs

12233775
12233775

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Popular Name: N-[(4-chlorophenyl)methyl]-4-oxo-8-phenyl-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-[(4-chlorophenyl)methyl]-4-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) 2.70 -0.14 -16.74 1 7 0 80 381.823 4 ↓

Analogs

12233825
12233825
12233990
12233990

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Popular Name: N-[(3-methoxyphenyl)methyl]-4-oxo-8-phenyl-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-[(3-methoxyphenyl)methyl]-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) 2.06 0.03 -18.66 1 8 0 89 377.404 5 ↓

Analogs

12233830
12233830

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Popular Name: N-[(2,6-difluorophenyl)methyl]-4-oxo-8-phenyl-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-[(2,6-difluorophenyl)methyl]-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) 2.26 1.4 -20.04 1 7 0 80 383.358 4 ↓

Analogs

12233555
12233555

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Popular Name: N-[(2-chlorophenyl)methyl]-4-oxo-8-(p-tolyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-[(2-chlorophenyl)methyl]-4-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) 3.10 0.15 -18.11 1 7 0 80 395.85 4 ↓

Analogs

12233558
12233558

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Popular Name: N-[(4-fluorophenyl)methyl]-4-oxo-8-(p-tolyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-[(4-fluorophenyl)methyl]-4-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) 2.64 1.07 -17.1 1 7 0 80 379.395 4 ↓

Analogs

12233562
12233562

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Popular Name: N-[(4-methoxyphenyl)methyl]-4-oxo-8-(p-tolyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-[(4-methoxyphenyl)methyl]-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) 2.53 0.35 -18.15 1 8 0 89 391.431 5 ↓

Analogs

12233565
12233565

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Popular Name: N-[(2-methoxyphenyl)methyl]-4-oxo-8-(p-tolyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-[(2-methoxyphenyl)methyl]-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) 2.48 0.4 -19.26 1 8 0 89 391.431 5 ↓

Analogs

12233568
12233568
11027730
11027730

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Popular Name: 4-oxo-8-(p-tolyl)-N-(p-tolylmethyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide 4-oxo-8-(p-tolyl)-N-(p-tolylmeth…

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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 0.66 -17.16 1 7 0 80 375.432 4 ↓

Analogs

12233771
12233771
12233572
12233572
12233576
12233576

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Popular Name: 4-oxo-N-[(1R)-1-phenylethyl]-8-(p-tolyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide 4-oxo-N-[(1R)-1-phenylethyl]-8-(…

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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) 3.03 1.09 -17.38 1 7 0 80 375.432 4 ↓

Analogs

12233572
12233572
12233576
12233576
12233769
12233769

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Popular Name: 4-oxo-N-[(1S)-1-phenylethyl]-8-(p-tolyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide 4-oxo-N-[(1S)-1-phenylethyl]-8-(…

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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) 3.03 1.08 -17.38 1 7 0 80 375.432 4 ↓

Analogs

12233578
12233578

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Popular Name: N-[(4-chlorophenyl)methyl]-4-oxo-8-(p-tolyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-[(4-chlorophenyl)methyl]-4-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) 3.15 0.19 -16.63 1 7 0 80 395.85 4 ↓

Analogs

12233618
12233618

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Popular Name: N-[(3-methoxyphenyl)methyl]-4-oxo-8-(p-tolyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-[(3-methoxyphenyl)methyl]-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) 2.51 0.35 -18.57 1 8 0 89 391.431 5 ↓

Analogs

12233625
12233625

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Popular Name: N-[(2,6-difluorophenyl)methyl]-4-oxo-8-(p-tolyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxam N-[(2,6-difluorophenyl)methyl]-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) 2.70 1.73 -20 1 7 0 80 397.385 4 ↓

Analogs

12233944
12233944
12233949
12233949

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Popular Name: N-benzyl-8-(4-methoxyphenyl)-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-benzyl-8-(4-methoxyphenyl)-4-o…

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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) 2.08 0.02 -18.9 1 8 0 89 377.404 5 ↓

Analogs

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Popular Name: N-[(2-chlorophenyl)methyl]-8-(4-methoxyphenyl)-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carb N-[(2-chlorophenyl)methyl]-8-(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) 2.71 -0.16 -19.82 1 8 0 89 411.849 5 ↓

Analogs

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Popular Name: N-[(4-fluorophenyl)methyl]-8-(4-methoxyphenyl)-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carb N-[(4-fluorophenyl)methyl]-8-(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) 2.24 0.76 -18.92 1 8 0 89 395.394 5 ↓

Analogs

12233562
12233562
12233935
12233935

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Popular Name: 8-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-car 8-(4-methoxyphenyl)-N-[(4-methox…

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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) 2.14 0.04 -19.89 1 9 0 99 407.43 6 ↓

Analogs

12233565
12233565

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Popular Name: 8-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-car 8-(4-methoxyphenyl)-N-[(2-methox…

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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) 2.09 0.09 -21.02 1 9 0 99 407.43 6 ↓

Analogs

12233935
12233935

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Popular Name: 8-(4-methoxyphenyl)-4-oxo-N-(p-tolylmethyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide 8-(4-methoxyphenyl)-4-oxo-N-(p-t…

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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) 2.53 0.34 -18.89 1 8 0 89 391.431 5 ↓

Analogs

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Popular Name: N-[(4-chlorophenyl)methyl]-8-(4-methoxyphenyl)-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carb N-[(4-chlorophenyl)methyl]-8-(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) 2.76 -0.13 -18.48 1 8 0 89 411.849 5 ↓

Analogs

12233618
12233618

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Popular Name: 8-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-car 8-(4-methoxyphenyl)-N-[(3-methox…

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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) 2.11 0.04 -20.34 1 9 0 99 407.43 6 ↓

Analogs

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Popular Name: N-[(2,6-difluorophenyl)methyl]-8-(4-methoxyphenyl)-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3- N-[(2,6-difluorophenyl)methyl]-8…

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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 1.41 -21.67 1 8 0 89 413.384 5 ↓

Analogs

12234117
12234117
12234123
12234123

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Popular Name: N-benzyl-8-(4-ethoxyphenyl)-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-benzyl-8-(4-ethoxyphenyl)-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) 2.46 0.04 -18.72 1 8 0 89 391.431 6 ↓

Analogs

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Popular Name: N-[(2-chlorophenyl)methyl]-8-(4-ethoxyphenyl)-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carbo N-[(2-chlorophenyl)methyl]-8-(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) 3.09 -0.14 -19.69 1 8 0 89 425.876 6 ↓

Analogs

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Popular Name: 8-(4-ethoxyphenyl)-N-[(4-fluorophenyl)methyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carbo 8-(4-ethoxyphenyl)-N-[(4-fluorop…

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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 0.77 -18.76 1 8 0 89 409.421 6 ↓

Analogs

12234107
12234107

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Popular Name: 8-(4-ethoxyphenyl)-N-[(4-methoxyphenyl)methyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carb 8-(4-ethoxyphenyl)-N-[(4-methoxy…

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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) 2.51 0.05 -19.76 1 9 0 99 421.457 7 ↓

Analogs

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Popular Name: 8-(4-ethoxyphenyl)-N-[(2-methoxyphenyl)methyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carb 8-(4-ethoxyphenyl)-N-[(2-methoxy…

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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) 2.47 0.1 -20.88 1 9 0 99 421.457 7 ↓

Analogs

12234107
12234107

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Popular Name: 8-(4-ethoxyphenyl)-4-oxo-N-(p-tolylmethyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide 8-(4-ethoxyphenyl)-4-oxo-N-(p-to…

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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) 2.91 0.36 -18.66 1 8 0 89 405.458 6 ↓

Analogs

12234135
12234135

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Popular Name: 8-(4-ethoxyphenyl)-4-oxo-N-[(1S)-1-phenylethyl]-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxami 8-(4-ethoxyphenyl)-4-oxo-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) 3.02 0.79 -18.93 1 8 0 89 405.458 6 ↓

Analogs

12234130
12234130

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Popular Name: 8-(4-ethoxyphenyl)-4-oxo-N-[(1R)-1-phenylethyl]-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxami 8-(4-ethoxyphenyl)-4-oxo-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) 3.02 0.79 -18.94 1 8 0 89 405.458 6 ↓

Analogs

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Popular Name: N-[(4-chlorophenyl)methyl]-8-(4-ethoxyphenyl)-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carbo N-[(4-chlorophenyl)methyl]-8-(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) 3.14 -0.11 -18.25 1 8 0 89 425.876 6 ↓

Analogs

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Popular Name: 8-(4-ethoxyphenyl)-N-[(3-methoxyphenyl)methyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carb 8-(4-ethoxyphenyl)-N-[(3-methoxy…

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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) 2.49 0.05 -20.18 1 9 0 99 421.457 7 ↓

Analogs

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Popular Name: N-[(2,6-difluorophenyl)methyl]-8-(4-ethoxyphenyl)-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-c N-[(2,6-difluorophenyl)methyl]-8…

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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 1.43 -21.44 1 8 0 89 427.411 6 ↓

Analogs

12234296
12234296

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Popular Name: N-benzyl-8-(4-fluorophenyl)-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide N-benzyl-8-(4-fluorophenyl)-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) 2.19 0.75 -18.11 1 7 0 80 365.368 4 ↓

Analogs

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Popular Name: N-[(2-chlorophenyl)methyl]-8-(4-fluorophenyl)-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carbo N-[(2-chlorophenyl)methyl]-8-(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) 2.82 0.57 -19.05 1 7 0 80 399.813 4 ↓

Analogs

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Popular Name: 8-(4-fluorophenyl)-N-[(4-fluorophenyl)methyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carbo 8-(4-fluorophenyl)-N-[(4-fluorop…

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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) 2.35 1.49 -18.18 1 7 0 80 383.358 4 ↓

Analogs

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Popular Name: 8-(4-fluorophenyl)-N-[(4-methoxyphenyl)methyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carb 8-(4-fluorophenyl)-N-[(4-methoxy…

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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 0.77 -19.19 1 8 0 89 395.394 5 ↓

Analogs

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Popular Name: 8-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carb 8-(4-fluorophenyl)-N-[(2-methoxy…

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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) 2.20 0.82 -20.16 1 8 0 89 395.394 5 ↓

Analogs

12234284
12234284

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Popular Name: 8-(4-fluorophenyl)-4-oxo-N-(p-tolylmethyl)-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxamide 8-(4-fluorophenyl)-4-oxo-N-(p-to…

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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) 2.64 1.07 -18.13 1 7 0 80 379.395 4 ↓

Analogs

12234302
12234302

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Popular Name: 8-(4-fluorophenyl)-4-oxo-N-[(1R)-1-phenylethyl]-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxami 8-(4-fluorophenyl)-4-oxo-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) 2.75 1.5 -18.36 1 7 0 80 379.395 4 ↓

Analogs

12234301
12234301

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Popular Name: 8-(4-fluorophenyl)-4-oxo-N-[(1S)-1-phenylethyl]-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carboxami 8-(4-fluorophenyl)-4-oxo-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) 2.75 1.5 -18.38 1 7 0 80 379.395 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4-chlorophenyl)methyl]-8-(4-fluorophenyl)-4-oxo-6,7-dihydroimidazo[2,3-c][1,2,4]triazine-3-carbo N-[(4-chlorophenyl)methyl]-8-(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) 2.87 0.6 -17.71 1 7 0 80 399.813 4 ↓

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
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Structural Results Found: (before additional filtering)

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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 = 97766 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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