In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2011 | 16 | Yes |
Popular Name: 1-[4-(2-dimethylaminoethyl)piperazin-1-yl]-2-methyl-propan-2-amine 1-[4-(2-dimethylaminoethyl)piper…
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) | 0.48 | 2.01 | -84.47 | 4 | 4 | 2 | 39 | 230.4 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.48 | -0.47 | -37.71 | 3 | 4 | 1 | 37 | 229.392 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.48 | 3.84 | -177.55 | 5 | 4 | 3 | 40 | 231.408 | 5 | ↓ |