In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 27 | Yes |
Popular Name: 2-[(2S)-1-[(2-ethoxyphenyl)methyl]-4-(p-tolylmethyl)piperazin-2-yl]ethanol 2-[(2S)-1-[(2-ethoxyphenyl)methy…
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) | 3.49 | 8.05 | -45.36 | 2 | 4 | 1 | 37 | 369.529 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.49 | 7.95 | -31.17 | 2 | 4 | 1 | 37 | 369.529 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.49 | 5.66 | -7.98 | 1 | 4 | 0 | 36 | 368.521 | 8 | ↓ |