In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 17 | Yes |
Popular Name: 3-amino-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]propan-1-one 3-amino-1-[4-[2-(dimethylamino)a…
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) | -2.02 | 2.14 | -95.58 | 4 | 6 | 2 | 73 | 244.339 | 4 | ↓ |
Hi High (pH 8-9.5) | -2.02 | -0.26 | -54.91 | 3 | 6 | 1 | 71 | 243.331 | 4 | ↓ |