In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 18 | Yes |
Popular Name: (2R)-3-[4-(2-diethylaminoethyl)piperazin-1-yl]-2-methyl-propan-1-amine (2R)-3-[4-(2-diethylaminoethyl)p…
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) | 0.57 | 5.07 | -163.52 | 5 | 4 | 3 | 40 | 259.462 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.57 | 0.97 | -42.6 | 3 | 4 | 1 | 37 | 257.446 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.57 | 3.08 | -81.57 | 4 | 4 | 2 | 39 | 258.454 | 8 | ↓ |