| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 20 | Yes |
Popular Name: (1S,2S)-1-(4-chlorophenyl)-N1-methyl-N1-tetrahydropyran-4-yl-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) | 2.72 | 6.65 | -123.26 | 4 | 3 | 2 | 41 | 298.858 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.72 | 4.55 | -50.39 | 3 | 3 | 1 | 40 | 297.85 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.72 | 6.38 | -38.69 | 3 | 3 | 1 | 40 | 297.85 | 5 | ↓ |
