| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2008 | 20 | Yes |
Popular Name: (1S,2S,4S)-N'-butyl-N'-ethyl-4-phenyl-cyclohexane-1,2-diamine (1S,2S,4S)-N'-butyl-N'-ethyl-4-p…
| 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) | 3.75 | 9.58 | -127.13 | 4 | 2 | 2 | 32 | 276.468 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.75 | 7.67 | -43.41 | 3 | 2 | 1 | 31 | 275.46 | 6 | ↓ |
