| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 18 | No |
Popular Name: (2S)-N1,N1-diethyl-N2-(3-nitrophenyl)propane-1,2-diamine (2S)-N1,N1-diethyl-N2-(3-nitroph…
| 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) | 3.51 | 8.47 | -44.04 | 2 | 5 | 1 | 62 | 252.338 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.51 | 6.23 | -6.26 | 1 | 5 | 0 | 61 | 251.33 | 7 | ↓ |
