In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 18 | Yes |
Popular Name: (4-Aminomethyl-1-benzyl-piperidin-4-yl)-dimethyl-amine (4-Aminomethyl-1-benzyl-piperidi…
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CAS Number: N/A
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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 |
---|---|---|---|---|---|---|---|---|---|---|
Hi High (pH 8-9.5) | 1.04 | 6.36 | -96.72 | 4 | 3 | 2 | 35 | 249.402 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.04 | 4.45 | -34.33 | 3 | 3 | 1 | 34 | 248.394 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.04 | 2.73 | -42.71 | 3 | 3 | 1 | 34 | 248.394 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.04 | 4.99 | -106.69 | 4 | 3 | 2 | 35 | 249.402 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.04 | 4.61 | -119.73 | 4 | 3 | 2 | 35 | 249.402 | 4 | ↓ |