In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 29 | Yes |
Popular Name: 2-[(2S)-1-benzyl-4-[(2,4,6-trimethoxyphenyl)methyl]piperazin-2-yl]ethanol 2-[(2S)-1-benzyl-4-[(2,4,6-trime…
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) | 2.68 | 5.52 | -34.97 | 2 | 6 | 1 | 56 | 401.527 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.68 | 5.42 | -36.57 | 2 | 6 | 1 | 56 | 401.527 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.68 | 3.18 | -9.79 | 1 | 6 | 0 | 54 | 400.519 | 9 | ↓ |