| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 20 | Yes |
Popular Name: (2S)-N-[(1S)-1-(2-bromophenyl)ethyl]-3-ethyl-N',N'-dimethyl-pentane-1,2-diamine (2S)-N-[(1S)-1-(2-bromophenyl)et…
| 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) | 4.96 | 9.31 | -37.14 | 2 | 2 | 1 | 20 | 342.345 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.96 | 10.32 | -37.4 | 2 | 2 | 1 | 16 | 342.345 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.96 | 10.44 | -121.82 | 3 | 2 | 2 | 21 | 343.353 | 8 | ↓ |
