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Popular Name: (3S)-3-ethyl-N-methyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-3-ethyl-N-methyl-N-[[(2S)-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) 1.33 5.23 -43.6 2 4 1 46 269.409 4 ↓

Analogs

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Popular Name: (3R)-3-ethyl-N-methyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-3-ethyl-N-methyl-N-[[(2S)-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) 1.33 5.36 -39.93 2 4 1 46 269.409 4 ↓

Analogs

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Popular Name: (3S)-3-ethyl-N-methyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-3-ethyl-N-methyl-N-[[(2R)-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) 1.33 5.85 -45.69 2 4 1 46 269.409 4 ↓

Analogs

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Popular Name: (3R)-3-ethyl-N-methyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-3-ethyl-N-methyl-N-[[(2R)-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) 1.33 5.97 -41.2 2 4 1 46 269.409 4 ↓

Analogs

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Popular Name: (3S)-N,3-dimethyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-N,3-dimethyl-N-[[(2S)-tetra…

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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) 1.00 4.92 -32.7 2 4 1 46 255.382 3 ↓

Analogs

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Popular Name: (3R)-N,3-dimethyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-N,3-dimethyl-N-[[(2S)-tetra…

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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) 1.00 4.83 -33.21 2 4 1 46 255.382 3 ↓

Analogs

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Popular Name: (3S)-N,3-dimethyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-N,3-dimethyl-N-[[(2R)-tetra…

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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) 1.00 5.05 -32.19 2 4 1 46 255.382 3 ↓

Analogs

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Popular Name: (3R)-N,3-dimethyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-N,3-dimethyl-N-[[(2R)-tetra…

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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) 1.00 4.91 -33.64 2 4 1 46 255.382 3 ↓

Analogs

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Popular Name: (3S)-N-methyl-3-propyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-N-methyl-3-propyl-N-[[(2S)-…

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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) 1.89 5.98 -43.81 2 4 1 46 283.436 5 ↓

Analogs

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Popular Name: (3R)-N-methyl-3-propyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-N-methyl-3-propyl-N-[[(2S)-…

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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) 1.89 6.12 -40.1 2 4 1 46 283.436 5 ↓

Analogs

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Popular Name: (3S)-N-methyl-3-propyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-N-methyl-3-propyl-N-[[(2R)-…

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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) 1.89 6.61 -45.77 2 4 1 46 283.436 5 ↓

Analogs

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Popular Name: (3R)-N-methyl-3-propyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-N-methyl-3-propyl-N-[[(2R)-…

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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) 1.89 6.73 -41.41 2 4 1 46 283.436 5 ↓

Analogs

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Popular Name: (3S)-3-ethyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-3-ethyl-N-[[(2S)-tetrahydro…

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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 3.6 -34.48 3 4 1 55 255.382 4 ↓

Analogs

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Popular Name: (3R)-3-ethyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-3-ethyl-N-[[(2S)-tetrahydro…

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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 3.65 -33.22 3 4 1 55 255.382 4 ↓

Analogs

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Popular Name: (3S)-3-ethyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-3-ethyl-N-[[(2R)-tetrahydro…

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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 3.65 -33.22 3 4 1 55 255.382 4 ↓

Analogs

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Popular Name: (3R)-3-ethyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-3-ethyl-N-[[(2R)-tetrahydro…

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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 3.7 -34.5 3 4 1 55 255.382 4 ↓

Analogs

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Popular Name: (3S)-3-methyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-3-methyl-N-[[(2S)-tetrahydr…

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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) 1.08 3.21 -33.34 3 4 1 55 241.355 3 ↓

Analogs

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Popular Name: (3R)-3-methyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-3-methyl-N-[[(2S)-tetrahydr…

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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) 1.08 3.21 -32.56 3 4 1 55 241.355 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-methyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-3-methyl-N-[[(2R)-tetrahydr…

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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) 1.08 3.27 -32.48 3 4 1 55 241.355 3 ↓

Analogs

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Popular Name: (3R)-3-methyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-3-methyl-N-[[(2R)-tetrahydr…

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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) 1.08 3.27 -33.24 3 4 1 55 241.355 3 ↓

Analogs

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Popular Name: (3S)-3-propyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-3-propyl-N-[[(2S)-tetrahydr…

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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) 1.97 4.37 -34.86 3 4 1 55 269.409 5 ↓

Analogs

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Popular Name: (3R)-3-propyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-3-propyl-N-[[(2S)-tetrahydr…

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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) 1.97 4.41 -33.56 3 4 1 55 269.409 5 ↓

Analogs

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Popular Name: (3S)-3-propyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-3-propyl-N-[[(2R)-tetrahydr…

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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) 1.97 4.42 -33.6 3 4 1 55 269.409 5 ↓

Analogs

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Popular Name: (3R)-3-propyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-3-propyl-N-[[(2R)-tetrahydr…

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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) 1.97 4.46 -34.97 3 4 1 55 269.409 5 ↓

Analogs

42466005
42466005
42466007
42466007
42466009
42466009
42466011
42466011
44804620
44804620

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Popular Name: (3S)-1-butanoyl-N-propyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-1-butanoyl-N-propyl-N-[[(2S…

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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) 2.98 9.01 -16.02 0 5 0 50 338.492 7 ↓

Analogs

42466005
42466005
42466007
42466007
42466009
42466009
42466011
42466011
44804631
44804631

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Popular Name: (3R)-1-butanoyl-N-propyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-1-butanoyl-N-propyl-N-[[(2S…

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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) 2.98 8.95 -14.71 0 5 0 50 338.492 7 ↓

Analogs

42466005
42466005
42466007
42466007
42466009
42466009
42466011
42466011
44804631
44804631

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Popular Name: (3S)-1-butanoyl-N-propyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-1-butanoyl-N-propyl-N-[[(2R…

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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) 2.98 9.05 -16.39 0 5 0 50 338.492 7 ↓

Analogs

42466005
42466005
42466007
42466007
42466009
42466009
42466011
42466011
44804631
44804631

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Popular Name: (3R)-1-butanoyl-N-propyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-1-butanoyl-N-propyl-N-[[(2R…

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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) 2.98 8.99 -15.96 0 5 0 50 338.492 7 ↓

Analogs

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Popular Name: (3S)-N-[(1R,2S)-2-chloro-1-[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl] (3S)-N-[(1R,2S)-2-chloro-1-[(2R,…

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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) -0.58 -0.25 -40.29 6 7 1 116 383.918 5 ↓

Analogs

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Popular Name: (3S)-N-[(1R,2R)-2-chloro-1-[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl] (3S)-N-[(1R,2R)-2-chloro-1-[(2R,…

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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) -0.58 -0.06 -39.08 6 7 1 116 383.918 5 ↓

Analogs

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Popular Name: (3S)-N-[(1S,2S)-2-chloro-1-[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl] (3S)-N-[(1S,2S)-2-chloro-1-[(2R,…

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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) -0.58 -0.86 -45.55 6 7 1 116 383.918 5 ↓

Analogs

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Popular Name: (3S)-N-[(1S,2R)-2-chloro-1-[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl] (3S)-N-[(1S,2R)-2-chloro-1-[(2R,…

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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) -0.58 -0.89 -50.18 6 7 1 116 383.918 5 ↓

Analogs

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Popular Name: (3R)-N-[(1R,2S)-2-chloro-1-[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl] (3R)-N-[(1R,2S)-2-chloro-1-[(2R,…

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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) -0.58 -0.24 -40.25 6 7 1 116 383.918 5 ↓

Analogs

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Popular Name: (3R)-N-[(1R,2R)-2-chloro-1-[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl] (3R)-N-[(1R,2R)-2-chloro-1-[(2R,…

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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) -0.58 -0.05 -38.64 6 7 1 116 383.918 5 ↓

Analogs

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Popular Name: (3R)-N-[(1S,2S)-2-chloro-1-[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl] (3R)-N-[(1S,2S)-2-chloro-1-[(2R,…

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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) -0.58 -0.86 -45.64 6 7 1 116 383.918 5 ↓

Analogs

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Popular Name: (3R)-N-[(1S,2R)-2-chloro-1-[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl] (3R)-N-[(1S,2R)-2-chloro-1-[(2R,…

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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) -0.58 -0.89 -49.68 6 7 1 116 383.918 5 ↓

Analogs

51003466
51003466
51003469
51003469
51062590
51062590
51062591
51062591
69743718
69743718

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Popular Name: (3R)-N-methyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-N-methyl-N-[[(2S)-tetrahydr…

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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) 0.75 5.16 -42.84 2 4 1 46 241.355 3 ↓

Analogs

51003466
51003466
51003469
51003469
51062590
51062590
51062591
51062591
69743718
69743718

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Popular Name: (3R)-N-methyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R)-N-methyl-N-[[(2R)-tetrahydr…

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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) 0.75 4.57 -41.49 2 4 1 46 241.355 3 ↓

Analogs

51003466
51003466
51003469
51003469
51062590
51062590
51062591
51062591
69743718
69743718

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-methyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-N-methyl-N-[[(2S)-tetrahydr…

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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) 0.75 4.83 -42.19 2 4 1 46 241.355 3 ↓

Analogs

51003466
51003466
51003469
51003469
51062590
51062590
51062591
51062591
69743718
69743718

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-methyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S)-N-methyl-N-[[(2R)-tetrahydr…

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) 0.75 4.48 -40.74 2 4 1 46 241.355 3 ↓

Analogs

51056244
51056244
51056246
51056246
64995395
64995395
66473924
66473924
66473927
66473927

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,6R)-N,6-dimethyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S,6R)-N,6-dimethyl-N-[[(2S)-te…

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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) 1.43 5.12 -40.24 2 4 1 46 255.382 3 ↓

Analogs

51056244
51056244
51056246
51056246
64995395
64995395
66473924
66473924
66473927
66473927

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,6S)-N,6-dimethyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3S,6S)-N,6-dimethyl-N-[[(2S)-te…

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) 1.43 5.14 -45.26 2 4 1 46 255.382 3 ↓

Analogs

51056244
51056244
51056246
51056246
64995395
64995395
66473924
66473924
66473927
66473927

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,6R)-N,6-dimethyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R,6R)-N,6-dimethyl-N-[[(2S)-te…

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) 1.43 5.2 -44.19 2 4 1 46 255.382 3 ↓

Analogs

51056244
51056244
51056246
51056246
64995395
64995395
66473924
66473924
66473927
66473927

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,6S)-N,6-dimethyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]piperidine-3-carboxamide (3R,6S)-N,6-dimethyl-N-[[(2S)-te…

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) 1.43 5.21 -38.15 2 4 1 46 255.382 3 ↓

Parameters Provided:

ring.id = 292803
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 = 292803 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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