In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 16 | Yes |
Popular Name: 2-[4-(2-aminoethyl)piperazin-1-yl]-N,N-diethyl-ethanamine 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) | -0.18 | 1.31 | -82.51 | 4 | 4 | 2 | 39 | 230.4 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.18 | -0.85 | -42.5 | 3 | 4 | 1 | 37 | 229.392 | 7 | ↓ |
Lo Low (pH 4.5-6) | -0.18 | 3.56 | -174.6 | 5 | 4 | 3 | 40 | 231.408 | 7 | ↓ |
Lo Low (pH 4.5-6) | -0.18 | 3.58 | -175.37 | 5 | 4 | 3 | 40 | 231.408 | 7 | ↓ |