In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 18 | Yes |
Popular Name: 1-[(3R,4R)-4-(ethylamino)tetrahydropyran-3-yl]-N,N-dimethyl-piperidin-4-amine 1-[(3R,4R)-4-(ethylamino)tetrahy…
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) | 1.01 | 4.02 | -113.16 | 3 | 4 | 2 | 34 | 257.422 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.01 | 3.97 | -34.92 | 2 | 4 | 1 | 29 | 256.414 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.01 | 3.11 | -33.9 | 2 | 4 | 1 | 29 | 256.414 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.01 | 6.63 | -197.17 | 4 | 4 | 3 | 35 | 258.43 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.01 | 4.75 | -86.49 | 3 | 4 | 2 | 34 | 257.422 | 4 | ↓ |