In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 18 | Yes |
Popular Name: 2,2-diethyl-4-(4-methylpiperazin-1-yl)-4-oxo-butanoic 2,2-diethyl-4-(4-methylpiperazin…
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) | 0.90 | 5.29 | -59.37 | 0 | 5 | -1 | 64 | 255.338 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.90 | 7.76 | -79.37 | 1 | 5 | 0 | 65 | 256.346 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.90 | 5.25 | -42.7 | 2 | 5 | 1 | 62 | 257.354 | 5 | ↓ |