In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 19 | Yes |
Popular Name: 2-(4-ethylpiperazin-1-yl)-1-(4-methoxyphenyl)ethan-1-one 2-(4-ethylpiperazin-1-yl)-1-(4-m…
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) | 1.81 | 5.95 | -36.91 | 1 | 4 | 1 | 34 | 263.361 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.81 | 3.66 | -7.64 | 0 | 4 | 0 | 33 | 262.353 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.81 | 5.87 | -40.19 | 1 | 4 | 1 | 34 | 263.361 | 5 | ↓ |