In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 22 | Yes |
Popular Name: (2S)-2-(3,4-dimethoxyphenyl)-1-(4-ethylpiperazin-1-yl)propan-2-ol (2S)-2-(3,4-dimethoxyphenyl)-1-(…
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) | 1.65 | 5.07 | -39.28 | 2 | 5 | 1 | 46 | 309.43 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.65 | 2.76 | -8.68 | 1 | 5 | 0 | 45 | 308.422 | 6 | ↓ |