| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 21 | Yes |
Popular Name: (1S,2S)-1-(4-chlorophenyl)-N1-methyl-N1-(1-methyl-4-piperidyl)butane-1,2-diamine (1S,2S)-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) | 2.76 | 6.51 | -122.23 | 4 | 3 | 2 | 35 | 311.901 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.76 | 6.78 | -108.58 | 4 | 3 | 2 | 35 | 311.901 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.76 | 6.24 | -37.48 | 3 | 3 | 1 | 34 | 310.893 | 5 | ↓ |
