| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 21 | Yes |
Popular Name: (1S,2R)-1-(4-chlorophenyl)-N1-propyl-N1-(2,2,2-trifluoroethyl)butane-1,2-diamine (1S,2R)-1-(4-chlorophenyl)-N1-pr…
| 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) | 4.15 | 6.02 | -44.43 | 3 | 2 | 1 | 31 | 323.81 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.15 | 5.74 | -2.23 | 2 | 2 | 0 | 29 | 322.802 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.15 | 8.03 | -116.03 | 4 | 2 | 2 | 32 | 324.818 | 8 | ↓ |
