| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 21 | No |
Popular Name: 2-[[(1S)-2-(diethylamino)-1-methyl-ethyl]amino]-5-nitro-benzoic 2-[[(1S)-2-(diethylamino)-1-meth…
| 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) | 3.55 | 9.31 | -58.83 | 2 | 7 | 0 | 102 | 295.339 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.55 | 6.78 | -47.36 | 1 | 7 | -1 | 101 | 294.331 | 8 | ↓ |
