| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 18 | No |
Popular Name: N',N'-dimethyl-N-[(1S)-1-(3-nitrophenyl)propyl]ethane-1,2-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) | 1.62 | 6.15 | -50.2 | 2 | 5 | 1 | 66 | 252.338 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.62 | 4.92 | -5.92 | 1 | 5 | 0 | 61 | 251.33 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.62 | 7.39 | -42.5 | 2 | 5 | 1 | 62 | 252.338 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.62 | 8.63 | -127.69 | 3 | 5 | 2 | 67 | 253.346 | 7 | ↓ |
