In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 28 | Yes |
Popular Name: 4-[3-[4-[2-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl]propyl]phenol 4-[3-[4-[2-(3,4-dimethoxyphenyl)…
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) | 3.53 | 8.24 | -47.54 | 2 | 5 | 1 | 46 | 385.528 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.53 | 5.97 | -9.44 | 1 | 5 | 0 | 45 | 384.52 | 9 | ↓ |