In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: 2,2-diethyl-4-(4-isobutylpiperazin-1-yl)-4-oxo-butanoic 2,2-diethyl-4-(4-isobutylpiperaz…
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 | 7.99 | -56.65 | 0 | 5 | -1 | 64 | 297.419 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.02 | 9.85 | -76.64 | 1 | 5 | 0 | 65 | 298.427 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.02 | 7.35 | -41.94 | 2 | 5 | 1 | 62 | 299.435 | 7 | ↓ |