| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 18 | Yes |
Popular Name: (3R,4S)-N3-(2-dimethylaminoethyl)-N4-ethyl-N3-propyl-tetrahydropyran-3,4-diamine (3R,4S)-N3-(2-dimethylaminoethyl…
| 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) | 1.50 | 4.14 | -112.02 | 3 | 4 | 2 | 34 | 259.438 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.50 | 2.32 | -35.53 | 2 | 4 | 1 | 32 | 258.43 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.50 | 1.19 | -1.27 | 1 | 4 | 0 | 28 | 257.422 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.50 | 3.65 | -37.57 | 2 | 4 | 1 | 29 | 258.43 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.50 | 2.94 | -32.33 | 2 | 4 | 1 | 29 | 258.43 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.50 | 4.8 | -96.8 | 3 | 4 | 2 | 34 | 259.438 | 8 | ↓ |
