In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: (1S,2S)-N1-ethyl-N1-isopropyl-cyclododecane-1,2-diamine (1S,2S)-N1-ethyl-N1-isopropyl-cy…
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) | 4.69 | 7.51 | -105.76 | 4 | 2 | 2 | 32 | 270.505 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.69 | 6.72 | -41.25 | 3 | 2 | 1 | 31 | 269.497 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.69 | 8.39 | -27.34 | 3 | 2 | 1 | 30 | 269.497 | 3 | ↓ |