In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 17 | Yes |
Popular Name: (2S,3R)-2-amino-1-[4-(dimethylamino)-1-piperidyl]-3-methyl-pentan-1-one (2S,3R)-2-amino-1-[4-(dimethylam…
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) | 0.57 | 4.64 | -94.44 | 4 | 4 | 2 | 52 | 243.395 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.57 | 4.32 | -42.43 | 3 | 4 | 1 | 51 | 242.387 | 4 | ↓ |