| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 20 | Yes |
Popular Name: (1S,2S)-N1-[(4-chlorophenyl)methyl]-N1-methyl-1-(3-methyl-2-thienyl)propane-1,2-diamine (1S,2S)-N1-[(4-chlorophenyl)meth…
| 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) | 3.48 | 7.02 | -42.6 | 3 | 2 | 1 | 31 | 309.886 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.48 | 8.6 | -35.64 | 3 | 2 | 1 | 30 | 309.886 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.48 | 6.31 | -3.11 | 2 | 2 | 0 | 29 | 308.878 | 5 | ↓ |
