In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 13 | Yes |
Popular Name: (1S,2S)-N1-(2-methoxyethyl)-N1-methyl-cyclohexane-1,2-diamine (1S,2S)-N1-(2-methoxyethyl)-N1-m…
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) | 0.59 | 0.9 | -35.02 | 3 | 3 | 1 | 40 | 187.307 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.59 | 2.57 | -29.29 | 3 | 3 | 1 | 40 | 187.307 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.59 | 0.62 | -1.77 | 2 | 3 | 0 | 38 | 186.299 | 4 | ↓ |