| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 21 | No |
Popular Name: N',N'-dimethyl-N-[(1S)-1-(3-nitrophenyl)butyl]butane-1,4-diamine N',N'-dimethyl-N-[(1S)-1-(3-nitr…
| 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) | 2.72 | 10.93 | -110.82 | 3 | 5 | 2 | 67 | 295.427 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.72 | 9.71 | -39.95 | 2 | 5 | 1 | 62 | 294.419 | 10 | ↓ |
