In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2011 | 20 | No |
Popular Name: 5-[4-(2-dimethylaminoethyl)piperazin-1-yl]-1,3-dimethyl-pyrazole-4-carbaldehyde 5-[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) | 0.47 | 5.63 | -43.97 | 1 | 6 | 1 | 46 | 280.396 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.47 | 3.14 | -7.26 | 0 | 6 | 0 | 45 | 279.388 | 5 | ↓ |