In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 22 | Yes |
Popular Name: 2-[4-(2-aminoethyl)piperazin-1-yl]-6-phenyl-3H-pyrimidin-4-one 2-[4-(2-aminoethyl)piperazin-1-y…
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) | 1.01 | 3.05 | -56.35 | 4 | 6 | 1 | 80 | 300.386 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.01 | 5.42 | -139.48 | 5 | 6 | 2 | 81 | 301.394 | 4 | ↓ |