| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2010 | 24 | Yes |
Popular Name: 4-[(4-methylpiperazin-1-yl)methyl]-N-(2-pyridylmethyl)benzamide 4-[(4-methylpiperazin-1-yl)methy…
| 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) | 1.05 | 6.11 | -42.24 | 2 | 5 | 1 | 50 | 325.436 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.05 | 5.99 | -46.13 | 2 | 5 | 1 | 50 | 325.436 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.05 | 3.74 | -9.89 | 1 | 5 | 0 | 48 | 324.428 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.05 | 6.52 | -80.01 | 3 | 5 | 2 | 51 | 326.444 | 5 | ↓ |
