| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 15 | Yes |
Popular Name: (3S,4R)-N3,N4-dimethyl-N3-(2,2,2-trifluoroethyl)tetrahydropyran-3,4-diamine (3S,4R)-N3,N4-dimethyl-N3-(2,2,2…
| 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) | 1.14 | 1.61 | -38.07 | 2 | 3 | 1 | 29 | 227.25 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.14 | 3.48 | -114.97 | 3 | 3 | 2 | 30 | 228.258 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.14 | 2.2 | -36.47 | 2 | 3 | 1 | 26 | 227.25 | 4 | ↓ |
