In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 14 | Yes |
Popular Name: (1S,2R,4R)-4-methyl-2-(2-methylimidazol-1-yl)cyclohexanamine (1S,2R,4R)-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) | 0.35 | 4.03 | -101.38 | 4 | 3 | 2 | 47 | 195.31 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.35 | 3.56 | -51.93 | 3 | 3 | 1 | 45 | 194.302 | 1 | ↓ |