In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 16 | Yes |
Popular Name: 4-[4-[(2R)-3-amino-2-methyl-propyl]piperazin-1-yl]butan-1-ol 4-[4-[(2R)-3-amino-2-methyl-prop…
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) | -0.31 | 0.89 | -91.65 | 5 | 4 | 2 | 56 | 231.384 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.31 | -1.37 | -44.63 | 4 | 4 | 1 | 54 | 230.376 | 7 | ↓ |