| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 34 | Yes |
Popular Name: (2S)-2-(4-butoxyphenyl)-2-[4-[(S)-(4-butoxyphenyl)-cyano-methyl]piperazin-1-yl]acetonitrile (2S)-2-(4-butoxyphenyl)-2-[4-[(S…
| 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) | 5.96 | 11.79 | -11.09 | 0 | 6 | 0 | 73 | 460.622 | 12 | ↓ |
| Lo Low (pH 4.5-6) | 5.96 | 13.84 | -53.19 | 1 | 6 | 1 | 74 | 461.63 | 12 | ↓ |
