| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 21 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[(1S)-1-[4…
| 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) | 4.06 | 8.29 | -38.61 | 2 | 2 | 1 | 20 | 303.392 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.06 | 7.29 | -2.51 | 1 | 2 | 0 | 15 | 302.384 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.06 | 9.21 | -37.79 | 2 | 2 | 1 | 16 | 303.392 | 8 | ↓ |
