In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 20 | Yes |
Popular Name: 2,2-diethyl-4-(4-isopropylpiperazin-1-yl)-4-oxo-butanoic 2,2-diethyl-4-(4-isopropylpipera…
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) | 1.57 | 6.67 | -58.59 | 0 | 5 | -1 | 64 | 283.392 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.57 | 8.8 | -72.87 | 1 | 5 | 0 | 65 | 284.4 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.57 | 6.42 | -39.81 | 2 | 5 | 1 | 62 | 285.408 | 6 | ↓ |