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Popular Name: (2R)-1-(1-methyltetrazol-5-yl)pyrrolidine-2-carboxylic (2R)-1-(1-methyltetrazol-5-yl)py…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -2.08 5.11 -57.67 0 7 -1 87 196.19 2 ↓

Analogs

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Popular Name: (2S)-1-(1-methyltetrazol-5-yl)pyrrolidine-2-carboxylic (2S)-1-(1-methyltetrazol-5-yl)py…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -2.08 4.82 -56.66 0 7 -1 87 196.19 2 ↓

Analogs

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Popular Name: (2R,4R)-4-hydroxy-1-(1-methyltetrazol-5-yl)pyrrolidine-2-carboxylic (2R,4R)-4-hydroxy-1-(1-methyltet…

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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) -3.00 1.72 -58.54 1 8 -1 107 212.189 2 ↓

Analogs

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Popular Name: (2R,4S)-4-hydroxy-1-(1-methyltetrazol-5-yl)pyrrolidine-2-carboxylic (2R,4S)-4-hydroxy-1-(1-methyltet…

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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) -3.00 1.72 -59.63 1 8 -1 107 212.189 2 ↓

Analogs

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Popular Name: (2R,4R)-4-methoxy-1-(1-methyltetrazol-5-yl)pyrrolidine-2-carboxylic (2R,4R)-4-methoxy-1-(1-methyltet…

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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) -2.38 3.78 -55.99 0 8 -1 96 226.216 3 ↓

Analogs

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Popular Name: (2R,4S)-4-methoxy-1-(1-methyltetrazol-5-yl)pyrrolidine-2-carboxylic (2R,4S)-4-methoxy-1-(1-methyltet…

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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) -2.38 3.78 -57.25 0 8 -1 96 226.216 3 ↓

Analogs

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Popular Name: 2-[(2R)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]acetic 2-[(2R)-1-(1-methyltetrazol-5-yl…

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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) -0.35 5.6 -52.83 0 7 -1 87 210.217 3 ↓

Analogs

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Popular Name: 2-[(2S)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]acetic 2-[(2S)-1-(1-methyltetrazol-5-yl…

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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) -0.35 4.32 -56.27 0 7 -1 87 210.217 3 ↓

Analogs

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Popular Name: (3S)-1-(1-methyltetrazol-5-yl)pyrrolidine-3-carboxylic (3S)-1-(1-methyltetrazol-5-yl)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) -0.51 4.98 -46.76 0 7 -1 87 196.19 2 ↓

Analogs

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Popular Name: (3R)-1-(1-methyltetrazol-5-yl)pyrrolidine-3-carboxylic (3R)-1-(1-methyltetrazol-5-yl)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) -0.51 4.98 -48.2 0 7 -1 87 196.19 2 ↓

Analogs

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Popular Name: (3S)-3-methyl-1-(1-methyltetrazol-5-yl)pyrrolidine-3-carboxylic (3S)-3-methyl-1-(1-methyltetrazo…

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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) -0.27 5.43 -49.47 0 7 -1 87 210.217 2 ↓

Analogs

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Popular Name: (3R)-3-methyl-1-(1-methyltetrazol-5-yl)pyrrolidine-3-carboxylic (3R)-3-methyl-1-(1-methyltetrazo…

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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) -0.27 5.45 -47.22 0 7 -1 87 210.217 2 ↓

Analogs

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Popular Name: (3S)-3-ethyl-1-(1-methyltetrazol-5-yl)pyrrolidine-3-carboxylic (3S)-3-ethyl-1-(1-methyltetrazol…

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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) 0.07 5.91 -48.64 0 7 -1 87 224.244 3 ↓

Analogs

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Popular Name: (3R)-3-ethyl-1-(1-methyltetrazol-5-yl)pyrrolidine-3-carboxylic (3R)-3-ethyl-1-(1-methyltetrazol…

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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) 0.07 6 -46.43 0 7 -1 87 224.244 3 ↓

Analogs

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Popular Name: (3S)-1-(1-methyltetrazol-5-yl)-3-propyl-pyrrolidine-3-carboxylic (3S)-1-(1-methyltetrazol-5-yl)-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) 0.63 6.68 -48.9 0 7 -1 87 238.271 4 ↓

Analogs

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Popular Name: (3R)-1-(1-methyltetrazol-5-yl)-3-propyl-pyrrolidine-3-carboxylic (3R)-1-(1-methyltetrazol-5-yl)-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) 0.63 6.77 -46.68 0 7 -1 87 238.271 4 ↓

Analogs

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Popular Name: (3S)-1-(1-methyltetrazol-5-yl)pyrrolidin-3-amine (3S)-1-(1-methyltetrazol-5-yl)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) -1.26 1.72 -58.57 3 6 1 74 169.212 1 ↓
Hi High (pH 8-9.5) -1.26 1.44 -10.16 2 6 0 73 168.204 1 ↓

Analogs

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Popular Name: (3R)-1-(1-methyltetrazol-5-yl)pyrrolidin-3-amine (3R)-1-(1-methyltetrazol-5-yl)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) -1.26 1.72 -58.27 3 6 1 74 169.212 1 ↓
Hi High (pH 8-9.5) -1.26 1.44 -10.7 2 6 0 73 168.204 1 ↓

Analogs

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Popular Name: [(3R)-1-(1-methyltetrazol-5-yl)pyrrolidin-3-yl]methanamine [(3R)-1-(1-methyltetrazol-5-yl)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) -0.95 2.44 -59.86 3 6 1 74 183.239 2 ↓

Analogs

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Popular Name: [(3S)-1-(1-methyltetrazol-5-yl)pyrrolidin-3-yl]methanamine [(3S)-1-(1-methyltetrazol-5-yl)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) -0.95 2.42 -59.84 3 6 1 74 183.239 2 ↓

Analogs

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Popular Name: [(2R)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methanol [(2R)-1-(1-methyltetrazol-5-yl)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) -0.50 1.87 -10.41 1 6 0 67 183.215 2 ↓

Analogs

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Popular Name: [(2S)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methanol [(2S)-1-(1-methyltetrazol-5-yl)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) -0.50 1.86 -10.4 1 6 0 67 183.215 2 ↓

Analogs

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Popular Name: [(3S)-1-(1-methyltetrazol-5-yl)pyrrolidin-3-yl]methanol [(3S)-1-(1-methyltetrazol-5-yl)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) -0.39 1.76 -10.72 1 6 0 67 183.215 2 ↓

Analogs

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Popular Name: [(3R)-1-(1-methyltetrazol-5-yl)pyrrolidin-3-yl]methanol [(3R)-1-(1-methyltetrazol-5-yl)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) -0.39 1.74 -10.68 1 6 0 67 183.215 2 ↓

Analogs

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Popular Name: 3-[(2R)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]propan-1-ol 3-[(2R)-1-(1-methyltetrazol-5-yl…

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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) 0.04 3.15 -12 1 6 0 67 211.269 4 ↓

Analogs

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Popular Name: 3-[(2S)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]propan-1-ol 3-[(2S)-1-(1-methyltetrazol-5-yl…

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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) 0.04 2.45 -11.98 1 6 0 67 211.269 4 ↓

Analogs

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Popular Name: (3S)-1-(1-methyltetrazol-5-yl)pyrrolidin-3-ol (3S)-1-(1-methyltetrazol-5-yl)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) -0.77 1.09 -12.56 1 6 0 67 169.188 1 ↓

Analogs

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Popular Name: (3R)-1-(1-methyltetrazol-5-yl)pyrrolidin-3-ol (3R)-1-(1-methyltetrazol-5-yl)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) -0.77 1.09 -13 1 6 0 67 169.188 1 ↓

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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) 0.37 5.77 -16.53 0 7 0 73 225.252 4 ↓

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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) 0.37 5.68 -16.46 0 7 0 73 225.252 4 ↓

Analogs

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Popular Name: [(2R)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methanamine [(2R)-1-(1-methyltetrazol-5-yl)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) -1.06 2.37 -50.27 3 6 1 74 183.239 2 ↓

Analogs

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Popular Name: [(2S)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methanamine [(2S)-1-(1-methyltetrazol-5-yl)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) -1.06 2.67 -36.41 3 6 1 74 183.239 2 ↓

Analogs

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Popular Name: N-[[(2S)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methyl]propan-1-amine N-[[(2S)-1-(1-methyltetrazol-5-y…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.44 5.85 -45.12 2 6 1 63 225.32 5 ↓

Analogs

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Popular Name: N-[[(2R)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methyl]propan-1-amine N-[[(2R)-1-(1-methyltetrazol-5-y…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.44 6.3 -33.4 2 6 1 63 225.32 5 ↓

Analogs

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Popular Name: N-[[(2S)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methyl]propan-2-amine N-[[(2S)-1-(1-methyltetrazol-5-y…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.59 5.65 -43.35 2 6 1 63 225.32 4 ↓

Analogs

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Popular Name: N-[[(2R)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methyl]propan-2-amine N-[[(2R)-1-(1-methyltetrazol-5-y…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.59 6.08 -31.46 2 6 1 63 225.32 4 ↓

Analogs

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Popular Name: 2-methyl-N-[[(2S)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methyl]propan-2-amine 2-methyl-N-[[(2S)-1-(1-methyltet…

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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) 1.10 6.07 -42.05 2 6 1 63 239.347 4 ↓

Analogs

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Popular Name: 2-methyl-N-[[(2R)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methyl]propan-2-amine 2-methyl-N-[[(2R)-1-(1-methyltet…

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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) 1.10 6.44 -30.56 2 6 1 63 239.347 4 ↓

Analogs

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Popular Name: N-[[(2S)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methyl]ethanamine N-[[(2S)-1-(1-methyltetrazol-5-y…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.06 5.09 -44.1 2 6 1 63 211.293 4 ↓

Analogs

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Popular Name: N-[[(2R)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methyl]ethanamine N-[[(2R)-1-(1-methyltetrazol-5-y…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.06 5.54 -33.04 2 6 1 63 211.293 4 ↓

Analogs

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Popular Name: 2-methyl-N-[[(2S)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methyl]propan-1-amine 2-methyl-N-[[(2S)-1-(1-methyltet…

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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) 0.69 6.55 -45.19 2 6 1 63 239.347 5 ↓

Analogs

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Popular Name: 2-methyl-N-[[(2R)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methyl]propan-1-amine 2-methyl-N-[[(2R)-1-(1-methyltet…

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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) 0.69 6.99 -33.4 2 6 1 63 239.347 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methoxy-N-[[(2R)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methyl]ethanamine 2-methoxy-N-[[(2R)-1-(1-methylte…

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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) -0.45 4.25 -44.94 2 7 1 73 241.319 6 ↓
Hi High (pH 8-9.5) -0.45 4.49 -10.05 1 7 0 68 240.311 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methoxy-N-[[(2S)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methyl]ethanamine 2-methoxy-N-[[(2S)-1-(1-methylte…

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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) -0.45 4.64 -33.8 2 7 1 73 241.319 6 ↓
Hi High (pH 8-9.5) -0.45 2.9 -10.44 1 7 0 68 240.311 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-1-[(2S)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methanamine N-methyl-1-[(2S)-1-(1-methyltetr…

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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) -0.08 4.23 -45.42 2 6 1 63 197.266 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-1-[(2R)-1-(1-methyltetrazol-5-yl)pyrrolidin-2-yl]methanamine N-methyl-1-[(2R)-1-(1-methyltetr…

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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) -0.08 4.71 -33.14 2 6 1 63 197.266 3 ↓

Parameters Provided:

ring.id = 312101
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 = 312101 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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