In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 19 | Yes |
Popular Name: (1R,2R,4S)-2-(2-methylimidazol-1-yl)-N,4-dipropyl-cyclohexanamine (1R,2R,4S)-2-(2-methylimidazol-1…
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) | 3.38 | 9.51 | -95.24 | 3 | 3 | 2 | 36 | 265.445 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.38 | 9.04 | -48.66 | 2 | 3 | 1 | 34 | 264.437 | 6 | ↓ |