In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: 5-[[2-methyl-2-(4-methylpiperazin-1-yl)propyl]amino]-5-oxo-pentanoic 5-[[2-methyl-2-(4-methylpiperazi…
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) | 0.44 | 4.52 | -71.78 | 2 | 6 | 0 | 77 | 285.388 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.44 | 2.57 | -51.86 | 1 | 6 | -1 | 76 | 284.38 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.44 | 4.93 | -77.45 | 2 | 6 | 0 | 77 | 285.388 | 7 | ↓ |