| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 18 | Yes |
Popular Name: (2S)-N1-[(1R)-1-cyclohexylethyl]-N2,N2,4-trimethyl-pentane-1,2-diamine (2S)-N1-[(1R)-1-cyclohexylethyl]…
| 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) | 4.39 | 7.62 | -33.45 | 2 | 2 | 1 | 20 | 255.47 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.39 | 9.73 | -31.58 | 2 | 2 | 1 | 16 | 255.47 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.39 | 9.53 | -117.38 | 3 | 2 | 2 | 21 | 256.478 | 7 | ↓ |
