In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2011 | 17 | Yes |
Popular Name: (1S,3R)-3-methyl-N-[(1-propylimidazol-2-yl)methyl]cyclohexanamine (1S,3R)-3-methyl-N-[(1-propylimi…
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) | 2.45 | 8.26 | -39.76 | 2 | 3 | 1 | 34 | 236.383 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.45 | 7.09 | -6.14 | 1 | 3 | 0 | 30 | 235.375 | 5 | ↓ |