In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2009 | 23 | Yes |
Popular Name: 2-[4-[(1R)-2-amino-1-(2-ethoxy-4-methoxy-phenyl)ethyl]piperazin-1-yl]ethanol 2-[4-[(1R)-2-amino-1-(2-ethoxy-4…
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) | 0.41 | -1.01 | -45.19 | 4 | 6 | 1 | 73 | 324.445 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.41 | 1.37 | -116.28 | 5 | 6 | 2 | 74 | 325.453 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.41 | 0.88 | -119.83 | 5 | 6 | 2 | 74 | 325.453 | 8 | ↓ |