In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 18 | Yes |
Popular Name: (1S,2R,4S)-N2-ethyl-N2-(2-methoxyethyl)-N1-methyl-4-propyl-cyclohexane-1,2-diamine (1S,2R,4S)-N2-ethyl-N2-(2-methox…
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) | 3.13 | 6.21 | -34.15 | 2 | 3 | 1 | 29 | 257.442 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.13 | 7.68 | -27.16 | 2 | 3 | 1 | 26 | 257.442 | 8 | ↓ |