In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 26th, 2009 | 24 | Yes |
Popular Name: 4-methyl-N-[2-[4-(2-pyridyl)piperazin-1-yl]ethyl]benzamide 4-methyl-N-[2-[4-(2-pyridyl)pipe…
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) | 2.30 | 5.81 | -39.08 | 2 | 5 | 1 | 50 | 325.436 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.30 | 7.84 | -49.75 | 2 | 5 | 1 | 50 | 325.436 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.30 | 5.52 | -13.72 | 1 | 5 | 0 | 48 | 324.428 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.30 | 8.13 | -106.67 | 3 | 5 | 2 | 51 | 326.444 | 5 | ↓ |