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Analogs

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Popular Name: N-(oxoBLAHyl)isoxazole-5-carboxamide N-(oxoBLAHyl)isoxazole-5-carboxa…

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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 5.36 -13.41 1 7 0 85 341.367 2 ↓

Analogs

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Popular Name: N-(oxoBLAHyl)isoxazole-5-carboxamide N-(oxoBLAHyl)isoxazole-5-carboxa…

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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 5.34 -14.16 1 7 0 85 341.367 2 ↓

Analogs

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Popular Name: ethyl ethyl

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.88 6.65 -11.27 1 7 0 85 346.383 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) 1.88 6.65 -12.18 1 7 0 85 346.383 4 ↓

Analogs

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Popular Name: (2S)-5-oxo-N-(oxoBLAHyl)pyrrolidine-2-carboxamide (2S)-5-oxo-N-(oxoBLAHyl)pyrrolid…

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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) 1.14 3.9 -31.34 2 7 0 88 357.41 2 ↓

Analogs

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Popular Name: (2R)-5-oxo-N-(oxoBLAHyl)pyrrolidine-2-carboxamide (2R)-5-oxo-N-(oxoBLAHyl)pyrrolid…

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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) 1.14 3.9 -28.38 2 7 0 88 357.41 2 ↓

Analogs

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Popular Name: (2S)-5-oxo-N-(oxoBLAHyl)pyrrolidine-2-carboxamide (2S)-5-oxo-N-(oxoBLAHyl)pyrrolid…

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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) 1.14 3.9 -22.41 2 7 0 88 357.41 2 ↓

Analogs

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Popular Name: (2R)-5-oxo-N-(oxoBLAHyl)pyrrolidine-2-carboxamide (2R)-5-oxo-N-(oxoBLAHyl)pyrrolid…

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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) 1.14 3.92 -22.34 2 7 0 88 357.41 2 ↓

Analogs

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Popular Name: 6-oxo-N-(oxoBLAHyl)-1H-pyridazine-3-carboxamide 6-oxo-N-(oxoBLAHyl)-1H-pyridazin…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.80 1.97 -46.29 1 8 -1 107 367.385 2 ↓
Lo Low (pH 4.5-6) 1.34 3.81 -14.6 2 8 0 104 368.393 2 ↓

Analogs

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Popular Name: 6-oxo-N-(oxoBLAHyl)-1H-pyridazine-3-carboxamide 6-oxo-N-(oxoBLAHyl)-1H-pyridazin…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.80 1.98 -46.81 1 8 -1 107 367.385 2 ↓
Lo Low (pH 4.5-6) 1.34 3.83 -15.45 2 8 0 104 368.393 2 ↓

Analogs

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Popular Name: 2-methyl-N-(oxoBLAHyl)thiazole-4-carboxamide 2-methyl-N-(oxoBLAHyl)thiazole-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 5.98 -14.01 1 6 0 72 371.462 2 ↓

Analogs

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Popular Name: 2-methyl-N-(oxoBLAHyl)thiazole-4-carboxamide 2-methyl-N-(oxoBLAHyl)thiazole-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 5.96 -14.98 1 6 0 72 371.462 2 ↓

Analogs

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Popular Name: 2-methoxy-N-(oxoBLAHyl)pyridine-3-carboxamide 2-methoxy-N-(oxoBLAHyl)pyridine-…

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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 6.21 -17.08 1 7 0 81 381.432 3 ↓

Analogs

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Popular Name: 2-methoxy-N-(oxoBLAHyl)pyridine-3-carboxamide 2-methoxy-N-(oxoBLAHyl)pyridine-…

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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 6.2 -18.92 1 7 0 81 381.432 3 ↓

Analogs

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Popular Name: 1-methyl-6-oxo-N-(oxoBLAHyl)pyridazine-3-carboxamide 1-methyl-6-oxo-N-(oxoBLAHyl)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) 1.41 5.46 -14.62 1 8 0 94 382.42 2 ↓

Analogs

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Popular Name: 1-methyl-6-oxo-N-(oxoBLAHyl)pyridazine-3-carboxamide 1-methyl-6-oxo-N-(oxoBLAHyl)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) 1.41 5.45 -15.57 1 8 0 94 382.42 2 ↓

Analogs

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Popular Name: 2,4-dimethyl-N-(oxoBLAHyl)thiazole-5-carboxamide 2,4-dimethyl-N-(oxoBLAHyl)thiazo…

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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 6.87 -13.3 1 6 0 72 385.489 2 ↓

Analogs

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Popular Name: 2,4-dimethyl-N-(oxoBLAHyl)thiazole-5-carboxamide 2,4-dimethyl-N-(oxoBLAHyl)thiazo…

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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 6.87 -14.67 1 6 0 72 385.489 2 ↓

Analogs

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Popular Name: 2-cyclopentylsulfanyl-N-(oxoBLAHyl)acetamide 2-cyclopentylsulfanyl-N-(oxoBLAH…

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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 9.31 -21.42 1 5 0 59 388.533 4 ↓

Analogs

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Popular Name: 2-cyclopentylsulfanyl-N-(oxoBLAHyl)acetamide 2-cyclopentylsulfanyl-N-(oxoBLAH…

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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 9.32 -15.72 1 5 0 59 388.533 4 ↓

Analogs

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Popular Name: N-(oxoBLAHyl)-1H-indole-2-carboxamide N-(oxoBLAHyl)-1H-indole-2-carbox…

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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) 3.82 8.26 -13.53 2 6 0 74 389.455 2 ↓

Analogs

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Popular Name: N-(oxoBLAHyl)-1H-indole-2-carboxamide N-(oxoBLAHyl)-1H-indole-2-carbox…

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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) 3.82 8.28 -14.97 2 6 0 74 389.455 2 ↓

Analogs

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Popular Name: N-(oxoBLAHyl)-1H-benzimidazole-5-carboxamide N-(oxoBLAHyl)-1H-benzimidazole-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) 2.82 7.97 -19.89 2 7 0 87 390.443 2 ↓

Analogs

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Popular Name: N-(oxoBLAHyl)-1H-benzimidazole-5-carboxamide N-(oxoBLAHyl)-1H-benzimidazole-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) 2.82 7.97 -21.69 2 7 0 87 390.443 2 ↓

Analogs

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Popular Name: 3-(3,5-dimethylisoxazol-4-yl)-N-(oxoBLAHyl)propanamide 3-(3,5-dimethylisoxazol-4-yl)-N-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.82 8.08 -17.32 1 7 0 85 397.475 4 ↓

Analogs

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Popular Name: 3-(3,5-dimethylisoxazol-4-yl)-N-(oxoBLAHyl)propanamide 3-(3,5-dimethylisoxazol-4-yl)-N-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.82 8.08 -18.24 1 7 0 85 397.475 4 ↓

Analogs

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Popular Name: 1-acetyl-N-(oxoBLAHyl)piperidine-4-carboxamide 1-acetyl-N-(oxoBLAHyl)piperidine…

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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) 1.81 7.4 -19.1 1 7 0 79 399.491 2 ↓

Analogs

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Popular Name: 1-acetyl-N-(oxoBLAHyl)piperidine-4-carboxamide 1-acetyl-N-(oxoBLAHyl)piperidine…

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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) 1.81 7.4 -21.01 1 7 0 79 399.491 2 ↓

Analogs

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Popular Name: N-(oxoBLAHyl)quinoline-2-carboxamide N-(oxoBLAHyl)quinoline-2-carboxa…

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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) 3.43 8.78 -13.91 1 6 0 72 401.466 2 ↓

Analogs

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Popular Name: N-(oxoBLAHyl)quinoline-2-carboxamide N-(oxoBLAHyl)quinoline-2-carboxa…

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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) 3.43 8.78 -14.81 1 6 0 72 401.466 2 ↓

Analogs

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Popular Name: 2-indol-1-yl-N-(oxoBLAHyl)acetamide 2-indol-1-yl-N-(oxoBLAHyl)acetamide

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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) 3.56 10.48 -18.16 1 6 0 64 403.482 3 ↓

Analogs

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Popular Name: 2-indol-1-yl-N-(oxoBLAHyl)acetamide 2-indol-1-yl-N-(oxoBLAHyl)acetamide

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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) 3.56 10.48 -20.07 1 6 0 64 403.482 3 ↓

Analogs

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Popular Name: 2-(1H-indol-3-yl)-N-(oxoBLAHyl)acetamide 2-(1H-indol-3-yl)-N-(oxoBLAHyl)a…

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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 9.06 -17.11 2 6 0 74 403.482 3 ↓

Analogs

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Popular Name: 2-(1H-indol-3-yl)-N-(oxoBLAHyl)acetamide 2-(1H-indol-3-yl)-N-(oxoBLAHyl)a…

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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 9.05 -19 2 6 0 74 403.482 3 ↓

Analogs

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Popular Name: 2-methyl-N-(oxoBLAHyl)imidazo[1,2-a]pyridine-3-carboxamide 2-methyl-N-(oxoBLAHyl)imidazo[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) 3.18 9.16 -17 1 7 0 76 404.47 2 ↓
Mid Mid (pH 6-8) 3.18 9.59 -38.51 2 7 1 77 405.478 2 ↓

Analogs

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Popular Name: 2-methyl-N-(oxoBLAHyl)imidazo[1,2-a]pyridine-3-carboxamide 2-methyl-N-(oxoBLAHyl)imidazo[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) 3.18 9.15 -18.82 1 7 0 76 404.47 2 ↓
Mid Mid (pH 6-8) 3.18 9.59 -39.81 2 7 1 77 405.478 2 ↓

Analogs

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Popular Name: 2-(benzimidazol-1-yl)-N-(oxoBLAHyl)acetamide 2-(benzimidazol-1-yl)-N-(oxoBLAH…

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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) 2.83 10.07 -22.04 1 7 0 76 404.47 3 ↓
Mid Mid (pH 6-8) 2.83 10.55 -47.63 2 7 1 78 405.478 3 ↓

Analogs

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Popular Name: 2-(benzimidazol-1-yl)-N-(oxoBLAHyl)acetamide 2-(benzimidazol-1-yl)-N-(oxoBLAH…

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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) 2.83 10.05 -23.64 1 7 0 76 404.47 3 ↓
Mid Mid (pH 6-8) 2.83 10.54 -48.82 2 7 1 78 405.478 3 ↓

Analogs

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Popular Name: 2-(1,2-benzoxazol-3-yl)-N-(oxoBLAHyl)acetamide 2-(1,2-benzoxazol-3-yl)-N-(oxoBL…

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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) 3.48 8.33 -21.34 1 7 0 85 405.454 3 ↓

Analogs

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Popular Name: 2-(1,2-benzoxazol-3-yl)-N-(oxoBLAHyl)acetamide 2-(1,2-benzoxazol-3-yl)-N-(oxoBL…

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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) 3.48 8.32 -21.94 1 7 0 85 405.454 3 ↓

Analogs

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Popular Name: 4-tert-butyl-N-(oxoBLAHyl)benzamide 4-tert-butyl-N-(oxoBLAHyl)benzamide

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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) 5.06 10.64 -12.36 1 5 0 59 406.526 3 ↓

Analogs

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Popular Name: 4-tert-butyl-N-(oxoBLAHyl)benzamide 4-tert-butyl-N-(oxoBLAHyl)benzamide

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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) 5.06 10.65 -13.81 1 5 0 59 406.526 3 ↓

Analogs

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Popular Name: N-[2-oxo-2-[(oxoBLAHyl)amino]ethyl]benzamide N-[2-oxo-2-[(oxoBLAHyl)amino]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) 2.83 6.82 -15.85 2 7 0 88 407.47 4 ↓

Analogs

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Popular Name: N-[2-oxo-2-[(oxoBLAHyl)amino]ethyl]benzamide N-[2-oxo-2-[(oxoBLAHyl)amino]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) 2.83 6.81 -16.67 2 7 0 88 407.47 4 ↓

Analogs

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Popular Name: 4-acetamido-N-(oxoBLAHyl)benzamide 4-acetamido-N-(oxoBLAHyl)benzamide

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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) 2.57 7.22 -20.13 2 7 0 88 407.47 3 ↓

Analogs

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Popular Name: 4-acetamido-N-(oxoBLAHyl)benzamide 4-acetamido-N-(oxoBLAHyl)benzamide

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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) 2.57 7.21 -22.37 2 7 0 88 407.47 3 ↓

Analogs

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Popular Name: N-(oxoBLAHyl)-1,3-benzothiazole-6-carboxamide N-(oxoBLAHyl)-1,3-benzothiazole-…

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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) 3.76 7.75 -15.55 1 6 0 72 407.495 2 ↓

Analogs

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Popular Name: N-(oxoBLAHyl)-1,3-benzothiazole-6-carboxamide N-(oxoBLAHyl)-1,3-benzothiazole-…

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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) 3.76 7.75 -16.92 1 6 0 72 407.495 2 ↓

Analogs

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Popular Name: 3-(2,4-dioxopyrimidin-1-yl)-N-(oxoBLAHyl)propanamide 3-(2,4-dioxopyrimidin-1-yl)-N-(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) 0.67 5.32 -27.12 2 9 0 114 412.446 4 ↓

Analogs

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Popular Name: 3-(2,4-dioxopyrimidin-1-yl)-N-(oxoBLAHyl)propanamide 3-(2,4-dioxopyrimidin-1-yl)-N-(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) 0.67 5.32 -23.66 2 9 0 114 412.446 4 ↓

Parameters Provided:

ring.id = 577825
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 = 577825 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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