In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 20 | Yes |
Popular Name: (1S,2R,4S)-N2-(2-dimethylaminoethyl)-N1-methyl-N2,4-dipropyl-cyclohexane-1,2-diamine (1S,2R,4S)-N2-(2-dimethylaminoet…
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) | 3.67 | 8.75 | -88.05 | 3 | 3 | 2 | 24 | 285.52 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.67 | 6.26 | -35.98 | 2 | 3 | 1 | 23 | 284.512 | 9 | ↓ |