| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 24th, 2011 | 21 | No |
Popular Name: (1S)-N,N-dimethyl-N'-[(1R)-1-methyloctyl]-1-phenyl-ethane-1,2-diamine (1S)-N,N-dimethyl-N'-[(1R)-1-met…
| 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) | 5.50 | 10.22 | -35.22 | 2 | 2 | 1 | 20 | 291.503 | 11 | ↓ |
| Hi High (pH 8-9.5) | 5.50 | 10.03 | -0.87 | 1 | 2 | 0 | 15 | 290.495 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 5.50 | 12.3 | -112.35 | 3 | 2 | 2 | 21 | 292.511 | 11 | ↓ |
