| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 19 | Yes |
Popular Name: (1R,2S)-1-(4-ethylphenyl)-N2-methyl-N2-[(1R)-1-methylbutyl]propane-1,2-diamine (1R,2S)-1-(4-ethylphenyl)-N2-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) | 2.47 | 8.02 | -30.25 | 3 | 2 | 1 | 30 | 263.449 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.47 | 8.34 | -112.16 | 4 | 2 | 2 | 32 | 264.457 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.47 | 7.27 | -44.04 | 3 | 2 | 1 | 31 | 263.449 | 7 | ↓ |
