In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 22 | Yes |
Popular Name: 2-[4-[(1R)-2-amino-1-(4-isopropoxyphenyl)ethyl]piperazin-1-yl]ethanol 2-[4-[(1R)-2-amino-1-(4-isopropo…
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) | 0.78 | 0.39 | -49.83 | 4 | 5 | 1 | 64 | 308.446 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.78 | 2.77 | -119.71 | 5 | 5 | 2 | 65 | 309.454 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.78 | 2.2 | -126.26 | 5 | 5 | 2 | 65 | 309.454 | 7 | ↓ |