In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 1st, 2010 | 15 | Yes |
Popular Name: (2S)-N'-(1-ethyl-4-piperidyl)-N',2-dimethyl-propane-1,3-diamine (2S)-N'-(1-ethyl-4-piperidyl)-N'…
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) | 0.69 | 3.92 | -86.81 | 4 | 3 | 2 | 35 | 215.385 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.69 | 5.47 | -95.4 | 4 | 3 | 2 | 35 | 215.385 | 5 | ↓ |