In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 18 | No |
Popular Name: 4-[(2R)-2-piperazin-1-ylpropanoyl]piperazine-1-carbaldehyde 4-[(2R)-2-piperazin-1-ylpropanoy…
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) | -1.40 | 1.12 | -50 | 2 | 6 | 1 | 60 | 255.342 | 2 | ↓ |
Mid Mid (pH 6-8) | -1.40 | 1.9 | -38.88 | 2 | 6 | 1 | 57 | 255.342 | 2 | ↓ |
Lo Low (pH 4.5-6) | -1.40 | 3.31 | -121.85 | 3 | 6 | 2 | 62 | 256.35 | 2 | ↓ |