In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 18 | Yes |
Popular Name: (1S,2R)-1-(4-ethylpiperazin-1-yl)-1-phenyl-propan-2-amine (1S,2R)-1-(4-ethylpiperazin-1-yl…
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) | 1.40 | 5.93 | -98.44 | 4 | 3 | 2 | 35 | 249.402 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 3.66 | -38.58 | 3 | 3 | 1 | 34 | 248.394 | 4 | ↓ |