In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: N,N-dimethyl-1-[(8S,9R)-8-(methylamino)-1,4-dioxaspiro[4.5]decan-9-yl]piperidin-4-amine N,N-dimethyl-1-[(8S,9R)-8-(methy…
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) | 1.07 | 5.06 | -88.02 | 3 | 5 | 2 | 43 | 299.459 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.07 | 4.38 | -114.28 | 3 | 5 | 2 | 43 | 299.459 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.07 | 3.51 | -34.08 | 2 | 5 | 1 | 38 | 298.451 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.07 | 5.91 | -96.15 | 3 | 5 | 2 | 39 | 299.459 | 3 | ↓ |