In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2011 | 20 | Yes |
Popular Name: (2S)-2-[4-(2,2-difluoroethyl)piperazin-1-yl]-N-pentyl-propanamide (2S)-2-[4-(2,2-difluoroethyl)pip…
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) | 2.18 | 3.03 | -9.08 | 1 | 4 | 0 | 36 | 291.386 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.18 | 5.15 | -39.29 | 2 | 4 | 1 | 37 | 292.394 | 8 | ↓ |