| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2010 | 13 | Yes |
Popular Name: (1R,2S)-N2-allyl-N1,N2-dimethyl-cyclohexane-1,2-diamine (1R,2S)-N2-allyl-N1,N2-dimethyl-…
| 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) | 2.16 | 4.5 | -31.47 | 2 | 2 | 1 | 20 | 183.319 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.16 | 3.7 | -0.26 | 1 | 2 | 0 | 15 | 182.311 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.16 | 5.59 | -31.27 | 2 | 2 | 1 | 16 | 183.319 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.16 | 6.47 | -104.56 | 3 | 2 | 2 | 21 | 184.327 | 4 | ↓ |
