In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 20 | Yes |
Popular Name: (1R,2S)-N2-[(2-fluorophenyl)methyl]-N2-methyl-N1-propyl-cyclohexane-1,2-diamine (1R,2S)-N2-[(2-fluorophenyl)meth…
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) | 3.91 | 9.5 | -31.67 | 2 | 2 | 1 | 16 | 279.423 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.91 | 8.38 | -37.22 | 2 | 2 | 1 | 20 | 279.423 | 6 | ↓ |