In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 17 | Yes |
Popular Name: piperazine, 1-methyl-4-[(3-oxo-2-piperazinyl)acetyl]- piperazine, 1-methyl-4-[(3-oxo-2…
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) | -0.21 | -2.06 | -9.92 | 2 | 6 | 0 | 65 | 240.307 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.21 | 0.29 | -44.36 | 3 | 6 | 1 | 66 | 241.315 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.21 | -0.89 | -40.84 | 3 | 6 | 1 | 69 | 241.315 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.21 | 1.45 | -92.73 | 4 | 6 | 2 | 70 | 242.323 | 2 | ↓ |