| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 19 | No |
Popular Name: N',N',2-trimethyl-N-[(1S)-1-(3-nitrophenyl)ethyl]propane-1,2-diamine N',N',2-trimethyl-N-[(1S)-1-(3-n…
| 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) | 2.83 | 8.98 | -131.38 | 3 | 5 | 2 | 67 | 267.373 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.83 | 5.39 | -5.19 | 1 | 5 | 0 | 61 | 265.357 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.83 | 6.86 | -47.18 | 2 | 5 | 1 | 66 | 266.365 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.83 | 8.17 | -42.06 | 2 | 5 | 1 | 62 | 266.365 | 6 | ↓ |
