| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 18 | Yes |
Popular Name: (3S,4R)-N4-ethyl-N3-methyl-N3-[(1R,3S)-3-methylcyclohexyl]tetrahydropyran-3,4-diamine (3S,4R)-N4-ethyl-N3-methyl-N3-[(…
| 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) | 2.51 | 6.88 | -113.1 | 3 | 3 | 2 | 30 | 256.434 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.51 | 3.8 | -0.93 | 1 | 3 | 0 | 24 | 254.418 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.51 | 5.68 | -32.98 | 2 | 3 | 1 | 26 | 255.426 | 4 | ↓ |
