In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 17 | Yes |
Popular Name: 1-[(1S)-2-(2-methoxyphenyl)-1-methyl-ethyl]piperazine 1-[(1S)-2-(2-methoxyphenyl)-1-me…
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) | 1.78 | 4.29 | -42.24 | 2 | 3 | 1 | 29 | 235.351 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.78 | 6.35 | -112.93 | 3 | 3 | 2 | 30 | 236.359 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.78 | 4.95 | -28.87 | 2 | 3 | 1 | 26 | 235.351 | 4 | ↓ |