| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 18 | Yes |
Popular Name: (1R,2S)-1-(4-chlorophenyl)-N1-isobutyl-N1-methyl-butane-1,2-diamine (1R,2S)-1-(4-chlorophenyl)-N1-is…
| 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) | 3.47 | 8.69 | -121.76 | 4 | 2 | 2 | 32 | 270.848 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.47 | 7.57 | -35.26 | 3 | 2 | 1 | 30 | 269.84 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.47 | 7.2 | -39.5 | 3 | 2 | 1 | 31 | 269.84 | 6 | ↓ |
