| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 18 | Yes |
Popular Name: (2S)-N2-[(3,5-dimethylphenyl)methyl]-N1,N1-diethyl-propane-1,2-diamine (2S)-N2-[(3,5-dimethylphenyl)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) | 3.43 | 8 | -34.2 | 2 | 2 | 1 | 20 | 249.422 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.43 | 8.8 | -33.17 | 2 | 2 | 1 | 16 | 249.422 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.43 | 10.09 | -112.76 | 3 | 2 | 2 | 21 | 250.43 | 7 | ↓ |
