In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 18 | Yes |
Popular Name: (2S)-2-(4-ethylphenyl)-2-(4-methylpiperazin-1-yl)ethanamine (2S)-2-(4-ethylphenyl)-2-(4-meth…
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) | 1.54 | 5.82 | -105.87 | 4 | 3 | 2 | 35 | 249.402 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.54 | 3.35 | -45.44 | 3 | 3 | 1 | 34 | 248.394 | 4 | ↓ |