| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 19 | Yes |
Popular Name: (1S,2R)-1-(4-chlorophenyl)-N1-methyl-N1-(2,2,2-trifluoroethyl)butane-1,2-diamine (1S,2R)-1-(4-chlorophenyl)-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) | 3.27 | 4.72 | -45.9 | 3 | 2 | 1 | 31 | 295.756 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.27 | 4.42 | -4.15 | 2 | 2 | 0 | 29 | 294.748 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.27 | 7.6 | -127.37 | 4 | 2 | 2 | 32 | 296.764 | 6 | ↓ |
