| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 17 | Yes |
Popular Name: (1R,2S)-N1-methyl-N1-[(1R)-1,2,2-trimethylpropyl]cyclooctane-1,2-diamine (1R,2S)-N1-methyl-N1-[(1R)-1,2,2…
| 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) | 3.65 | 6.52 | -115.29 | 4 | 2 | 2 | 32 | 242.451 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.65 | 5.12 | -40.08 | 3 | 2 | 1 | 31 | 241.443 | 3 | ↓ |
