In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 28 | Yes |
Popular Name: N-[6-[4-(3-chlorobenzoyl)piperazin-1-yl]-3-pyridyl]-3-methyl-but-2-enamide N-[6-[4-(3-chlorobenzoyl)piperaz…
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) | 3.27 | 9.5 | -13.82 | 1 | 6 | 0 | 66 | 398.894 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.27 | 9.86 | -41.99 | 2 | 6 | 1 | 67 | 399.902 | 4 | ↓ |