| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 20 | Yes |
Popular Name: (1S)-N-benzyl-N-methyl-1-(4-methylsulfanylphenyl)ethane-1,2-diamine (1S)-N-benzyl-N-methyl-1-(4-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) | 2.56 | 6.96 | -49.53 | 3 | 2 | 1 | 31 | 287.452 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.56 | 8.95 | -131.27 | 4 | 2 | 2 | 32 | 288.46 | 6 | ↓ |
