| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 17 | Yes |
Popular Name: (1S,2S)-N2-ethyl-N1-(1-ethylpropyl)-N1-methyl-cycloheptane-1,2-diamine (1S,2S)-N2-ethyl-N1-(1-ethylprop…
| 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) | 4.14 | 9.03 | -107.28 | 3 | 2 | 2 | 21 | 242.451 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.14 | 7.65 | -30.88 | 2 | 2 | 1 | 20 | 241.443 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.14 | 8.22 | -27.05 | 2 | 2 | 1 | 16 | 241.443 | 6 | ↓ |
