In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 17 | Yes |
Popular Name: (1R,2S,4S)-4-methyl-2-(2-methylimidazol-1-yl)-N-propyl-cyclohexanamine (1R,2S,4S)-4-methyl-2-(2-methyli…
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) | 2.14 | 8.89 | -93.32 | 3 | 3 | 2 | 36 | 237.391 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.14 | 8.42 | -40.23 | 2 | 3 | 1 | 34 | 236.383 | 4 | ↓ |