In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | Yes |
Popular Name: (2S)-N-[2-(dimethylamino)-2-methyl-propyl]-2-piperazin-1-yl-propanamide (2S)-N-[2-(dimethylamino)-2-meth…
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) | -0.09 | 2.15 | -85.58 | 4 | 5 | 2 | 53 | 258.41 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.09 | 0.81 | -40.29 | 3 | 5 | 1 | 49 | 257.402 | 5 | ↓ |