| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 17 | Yes |
Popular Name: (3R,4S)-N3-(2-dimethylaminoethyl)-N4-methyl-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) | 1.13 | 3.29 | -112.64 | 3 | 4 | 2 | 34 | 245.411 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.13 | 1.47 | -36.91 | 2 | 4 | 1 | 32 | 244.403 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.13 | 0.24 | -1.51 | 1 | 4 | 0 | 28 | 243.395 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.13 | 2.71 | -37.46 | 2 | 4 | 1 | 29 | 244.403 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.13 | 3.95 | -97.31 | 3 | 4 | 2 | 34 | 245.411 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.13 | 2 | -32.12 | 2 | 4 | 1 | 29 | 244.403 | 7 | ↓ |
