In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 20 | Yes |
Popular Name: 2,2-diethyl-4-oxo-4-(4-propylpiperazin-1-yl)butanoic 2,2-diethyl-4-oxo-4-(4-propylpip…
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) | 1.78 | 6.95 | -58.62 | 0 | 5 | -1 | 64 | 283.392 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 9.07 | -79.32 | 1 | 5 | 0 | 65 | 284.4 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.78 | 7.09 | -50.96 | 2 | 5 | 1 | 62 | 285.408 | 7 | ↓ |