In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 21 | Yes |
Popular Name: [2-[2-[4-[(1R)-1-methylpropyl]piperazin-1-yl]ethoxy]phenyl]methanamine [2-[2-[4-[(1R)-1-methylpropyl]pi…
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) | 2.26 | 5.39 | -86.99 | 4 | 4 | 2 | 45 | 293.455 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.26 | 3.5 | -39.27 | 3 | 4 | 1 | 43 | 292.447 | 7 | ↓ |