In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2008 | 25 | Yes |
Popular Name: (4-ethylpiperazin-1-yl)-[2-(4-ethylpiperazin-1-yl)-4-methyl-pyrimidin-5-yl]methanone (4-ethylpiperazin-1-yl)-[2-(4-et…
None
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) | 0.68 | 9.09 | -87.81 | 2 | 7 | 2 | 58 | 348.495 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.68 | 4.5 | -6.94 | 0 | 7 | 0 | 56 | 346.479 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.68 | 6.81 | -40.64 | 1 | 7 | 1 | 57 | 347.487 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.68 | 6.78 | -45.06 | 1 | 7 | 1 | 57 | 347.487 | 4 | ↓ |