| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 18 | Yes |
Popular Name: (3S,4R)-3-[4-(dimethylaminomethyl)-1-piperidyl]-N-methyl-tetrahydropyran-4-amine (3S,4R)-3-[4-(dimethylaminomethy…
| 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) | 1.02 | 4.29 | -84.22 | 3 | 4 | 2 | 34 | 257.422 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.02 | 3.08 | -36.15 | 2 | 4 | 1 | 29 | 256.414 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.02 | 2.74 | -33.2 | 2 | 4 | 1 | 29 | 256.414 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.02 | 4.99 | -94.49 | 3 | 4 | 2 | 30 | 257.422 | 4 | ↓ |
