In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 23 | Yes |
Popular Name: 2-[(2S)-1-methyl-4-[(2,4,6-trimethoxyphenyl)methyl]piperazin-2-yl]ethanol 2-[(2S)-1-methyl-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) | 1.28 | 1.71 | -35.47 | 2 | 6 | 1 | 56 | 325.429 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.28 | 1.68 | -31.85 | 2 | 6 | 1 | 56 | 325.429 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.28 | -0.61 | -7.92 | 1 | 6 | 0 | 54 | 324.421 | 7 | ↓ |