| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 10th, 2009 | 25 | No |
Popular Name: 1-(m-tolylmethyl)-4-[(1S)-1-(3-nitrophenyl)ethyl]piperazine 1-(m-tolylmethyl)-4-[(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) | 3.95 | 11.78 | -46.58 | 1 | 5 | 1 | 53 | 340.447 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.95 | 11.4 | -49.53 | 1 | 5 | 1 | 53 | 340.447 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.95 | 9.46 | -7.17 | 0 | 5 | 0 | 52 | 339.439 | 5 | ↓ |
