In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 5th, 2006 | 17 | No |
Popular Name: 3-[(2-chlorophenyl)methylene]-6-methyl-piperazine-2,5-dione 3-[(2-chlorophenyl)methylene]-6-…
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) | 1.63 | 2.89 | -8.01 | 2 | 4 | 0 | 58 | 250.685 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.00 | -2.15 | -44.83 | 1 | 4 | -1 | 68 | 249.677 | 1 | ↓ |