| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 21 | Yes |
Popular Name: (1S,2R)-1-(4-fluorophenyl)-N1-methyl-N1-[(1R,2S)-2-methylcyclohexyl]butane-1,2-diamine (1S,2R)-1-(4-fluorophenyl)-N1-me…
| 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) | 3.98 | 6.88 | -44.6 | 3 | 2 | 1 | 31 | 293.45 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.98 | 8.42 | -35.47 | 3 | 2 | 1 | 30 | 293.45 | 5 | ↓ |
