In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 15 | Yes |
Popular Name: (2S)-2-amino-1-[4-(dimethylamino)-1-piperidyl]butan-1-one (2S)-2-amino-1-[4-(dimethylamino…
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) | -0.17 | 3.42 | -92.73 | 4 | 4 | 2 | 52 | 215.341 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.17 | 3.11 | -42.02 | 3 | 4 | 1 | 51 | 214.333 | 3 | ↓ |