In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 18 | Yes |
Popular Name: (1R,2S)-2-[4-(aminomethyl)phenoxy]-N,N-dimethyl-cyclohexanamine (1R,2S)-2-[4-(aminomethyl)phenox…
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) | 2.60 | 6.55 | -89.54 | 4 | 3 | 2 | 41 | 250.386 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.60 | 4.06 | -46.5 | 3 | 3 | 1 | 40 | 249.378 | 4 | ↓ |