| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 15 | Yes |
Popular Name: (1R,2S)-N1-(1-ethylpropyl)-N1-methyl-cycloheptane-1,2-diamine (1R,2S)-N1-(1-ethylpropyl)-N1-me…
| 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) | 2.86 | 6.11 | -115.83 | 4 | 2 | 2 | 32 | 214.397 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.86 | 5.92 | -30.41 | 3 | 2 | 1 | 30 | 213.389 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.86 | 4.45 | -39.15 | 3 | 2 | 1 | 31 | 213.389 | 4 | ↓ |
