In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 19 | Yes |
Popular Name: 2-[4-[(1R)-2-amino-1-(p-tolyl)ethyl]piperazin-1-yl]ethanol 2-[4-[(1R)-2-amino-1-(p-tolyl)et…
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) | 0.44 | 0.2 | -47.03 | 4 | 4 | 1 | 54 | 264.393 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.44 | 2.57 | -116.76 | 5 | 4 | 2 | 56 | 265.401 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.44 | 2.01 | -122.76 | 5 | 4 | 2 | 56 | 265.401 | 5 | ↓ |