In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 19 | Yes |
Popular Name: (1R,2S)-N2-ethyl-N1-(4-ethylcyclohexyl)-N1-methyl-cyclohexane-1,2-diamine (1R,2S)-N2-ethyl-N1-(4-ethylcycl…
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) | 4.25 | 8.96 | -32.17 | 2 | 2 | 1 | 16 | 267.481 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.25 | 8.25 | -30.81 | 2 | 2 | 1 | 20 | 267.481 | 5 | ↓ |